# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2025-06-12T15:15:00+02:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Acta Crystallographica, Section E') AND 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
"1100118","8.493","0.0008","8.932","0.001","13.434","0.002","90","","97.141","0.008","90","","1011.2","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1,4,8,11-Tetraazacyclodecane-1,4,8,11-tetraium bis(aquapentafluoroaluminate) dihydrate","","- C10 H36 Al2 F10 N4 O4 -","- C10 H36 Al2 F10 N4 O4 -","- C20 H72 Al4 F20 N8 O8 -","2","0.5","","Goreshnik, E.; Leblanc, M.; Maisonneuve, V.","1,4,8,11-Tetraazacyclodecane-1,4,8,11-tetraium bis(aquapentafluoroaluminate) dihydrate","Acta Crystallographica, Section E: Structure Reports Online","2003","59","11","1059","1061","10.1107/S1600536803023699","","","0.71069","MoKα","","0.1639","0.0632","","","0.1198","0.1508","","","","","","1.094","","","","has coordinates","297521","2025-01-29","07:25:19",""
"1100119","7.6996","0.0016","8.838","0.002","12.197","0.004","105.87","0.02","97.74","0.03","106.317","0.015","745.8","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","[HN(CH2CH2NH3)3].(Al2F10).H2O","","","- C6 H24 Al2 F10 N4 O -","- C6 H24 Al2 F10 N4 O -","- C12 H48 Al4 F20 N8 O2 -","2","1","","K. Adil; M. Leblanc; V. Maisonneuve","[H~4~tren].(Al~2~F~10~).H~2~O","Acta Crystallographica, Section E","2004","60","10","m1379","m1381","10.1107/S1600536804020203","","","0.71069","MoKα","","0.0749","0.0432","","","0.1075","0.1233","","","","","","1.053","","","","has coordinates","277833","2022-09-14","15:22:10",""
"1100133","7.119","0.008","11.532","0.006","12.49","0.007","107.14","0.05","95.43","0.07","92.03","0.06","973.3","1.3","280","2","280","2","","","","","","","","5","P -1","-P 1","2","Bis(p-toluidinium) tetrachlorozincate(II)","Bis(p-toluidinium) tetrachlorozincate(II)","","- C14 H20 Cl4 N2 Zn -","- C14 H20 Cl4 N2 Zn -","- C28 H40 Cl8 N4 Zn2 -","2","1","","Rademeyer, M.","Bis(p-toluidinium) tetrachlorozincate(II)","Acta Crystallographica Section E","2005","61","","m304","m306","10.1107/S1600536805000747","","","0.71073","MoKα","","0.0789","0.0436","","","0.094","0.106","","","","","","0.895","","","","has coordinates","277831","2022-09-14","14:31:32",""
"1100172","10.432","0.0003","5.645","0.0002","16.783","0.0002","90","","94.943","0.003","90","","984.65","0.05","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","D-Phynylglycinium nitrate","D-Phenylglycinium nitrate","","- C8 H10 N2 O5 -","- C8 H10 N2 O5 -","- C32 H40 N8 O20 -","4","2","","Bouchouit, Karim; Bendheif, Leulmi; Benali-Cherif, Nouredine","D-Phenylglycinium nitrate","Acta Crystallographica, Section E","2004","60","","o272","o274","10.1107/S1600536804000972","","","0.71073","MoKα","","0.0858","0.0563","","","0.116","0.1381","","","","","","1.158","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1100263","14.684","0.006","9.355","0.001","22.515","0.009","90","","101.68","0.02","90","","3028.82","","","","193","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","3,3-Diethyl-5-diisopropylamino-2-(2,4-dimethyl-3-(t-butyl-dimethylsilyloxy)-pe ntyliden)-4-oxonia-3-borata-2,3-dihydrofuran","","- C25 H52 B N O3 Si -","- C28 H60 B N O3 Si -","- C112 H240 B4 N4 O12 Si4 -","4","1","","Kocienski, P.; Marsch, M.; Harms, K.; Boche, G.","A vinylic α-carbamoyloxy boran with a carbenoid-type bonding situation","Acta Crystallographica Section E","2002","58","3","o336","o337","10.1107/S1600536802003215","","","","","","","5.89","","","5.89","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1101077","8.2437","0.0002","8.2437","0.0002","8.2437","0.0002","90","","90","","90","","560.23","0.02","295","","","","","","","","","","Synthetic","3","F d -3 m :2","-F 4vw 2vw 3","227","","","","- Li O4 V2 -","- Li O4 V2 -","- Li8 O32 V16 -","8","0.0416667","MG6039","Matsushita, Yoshitaka; Yamaura, Jun-Ichi; Ueda, Yutaka","Lithium divanadate spinel, LiV~2~O~4~","Acta Crystallographica, Section E","2005","61","8","i137","i139","10.1107/S1600536805020155","","","0.71073","MoKα","","","0.0261","","","","0.0762","","","","","","0.845","","","","has coordinates","282068","2023-03-26","10:11:44",""
"1544027","13.538","0.004","5.123","0.0018","30.167","0.01","90","","95.968","0.009","90","","2080.9","1.2","200","2","200","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","bis(3-Chlorothiophene-2-carboxylic acid); 4,4'-bipyridine","","- C20 H14 Cl2 N2 O4 S2 -","- C20 H14 Cl2 N2 O4 S2 -","- C80 H56 Cl8 N8 O16 S8 -","4","0.5","HG5476","Prajina, Olakkandiyil; Thomas Muthiah, Packianathan; Geiger, David K.","Supramolecular interactions in the 1:2 co-crystal of 4,4'-bipyridine and 3-chlorothiophene-2-carboxylic acid","Acta Crystallographica Section E","2016","72","10","1362","1365","10.1107/S2056989016013724","","","0.71073","MoKα","","0.0692","0.0545","","","0.131","0.1358","","","","","","1.194","","","","has coordinates,has Fobs","187992","2020-10-21","18:00:00",""
"1572947","46.5945","0.0013","13.9309","0.0004","23.4225","0.0007","90","","104.053","0.001","90","","14748.6","0.7","123","2","123","2","","","","","","","","4","C 1 2 1","C 2y","5","Lopinavir–ethane-1,2-diol–water (8/3/7)","(2<i>S</i>)-<i>N</i>-[(2<i>S</i>,4<i>S</i>,5<i>S</i>)-5-[2-(2,6-Dimethylphenoxy)acetamido]-4-hydroxy-1,6-diphenylhexan-2-yl]-3-methyl-2-(2-oxo-1,3-diazinan-1-yl)butanamide–ethane-1,2-diol–water (8/2/1/7)","","- C302 H416 N32 O53 -","- C302 H416 N32 O53 -","- C604 H832 N64 O106 -","2","0.5","EX2081","Mokoto, Tebogo M. L.; Lemmerer, Andreas; Sayed, Yasien; Smith, Mark G.","Structural multiplicity in a solvated hydrate of the antiretroviral protease inhibitor Lopinavir","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1206","1209","10.1107/S2056989024004158","","x-ray","1.54178","CuKα","","0.0424","0.0382","","","0.0955","0.099","","","","","","1.027","","","","has coordinates,has disorder","296770","2024-12-07","17:09:31",""
"1572948","10.4571","0.0005","13.9115","0.0005","18.5703","0.001","90","","100.372","0.005","90","","2657.4","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dichlorido[2-(4-nitrophenyl)-4-phenylquinolin-8-olato]zinc(II)","","- C27 H29 Cl2 N3 O3 Zn -","- C27 H29 Cl2 N3 O3 Zn -","- C108 H116 Cl8 N12 O12 Zn4 -","4","1","OO2008","Le Thi Hong, Hai; Nguyen, Hien; Trinh Hong, Duong; Nguyen Hoang, Ninh; Nguyen Nhat, Khanh; Van Meervelt, Luc","Crystal structures and photophysical properties of mono- and dinuclear ZnII complexes flanked by triethylammonium","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1210","1216","10.1107/S2056989024010302","","x-ray","0.71073","MoKα","","0.0623","0.0433","","","0.1012","0.1133","","","","","","1.029","","","","has coordinates","296775","2024-12-07","17:10:34",""
"1572949","11.9843","0.0009","13.457","0.0007","11.9944","0.0011","90","","103.838","0.009","90","","1878.2","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(triethylammonium) {2,2'-[1,4-phenylenebis(nitrilomethylidyne)]diphenolato}bis[dichloridozinc(II)]","","- C32 H46 Cl4 N4 O2 Zn2 -","- C32 H46 Cl4 N4 O2 Zn2 -","- C64 H92 Cl8 N8 O4 Zn4 -","2","0.5","OO2008","Le Thi Hong, Hai; Nguyen, Hien; Trinh Hong, Duong; Nguyen Hoang, Ninh; Nguyen Nhat, Khanh; Van Meervelt, Luc","Crystal structures and photophysical properties of mono- and dinuclear ZnII complexes flanked by triethylammonium","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1210","1216","10.1107/S2056989024010302","","x-ray","0.71073","MoKα","","0.0743","0.0525","","","0.1389","0.1575","","","","","","1.053","","","","has coordinates","296775","2024-12-07","17:10:34",""
"1572950","10.0737","0.0005","11.1039","0.0006","11.5835","0.0006","107.025","0.004","114.263","0.004","93.898","0.004","1102.82","0.11","123","2","123","","","","","","","","","4","P -1","-P 1","2","","2-(3,4,5-Triphenylphenyl)acetic acid acetonitrile monosolvate","","- C28 H23 N O2 -","- C28 H23 N O2 -","- C56 H46 N2 O4 -","2","1","JY2053","Seidel, Pierre; Gottwald, Franziska; Meier, Eric; Mazik, Monika","Crystal structure of an acetonitrile solvate of 2-(3,4,5-triphenylphenyl)acetic acid","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1198","1201","10.1107/S2056989024009976","","x-ray","0.71073","MoKα","","0.0551","0.0396","","","0.0993","0.1056","","","","","","1.066","","","","has coordinates,has disorder","296779","2024-12-07","17:11:09",""
"1572951","10.2557","0.0005","8.3978","0.0005","13.7681","0.0007","90","","91.422","0.004","90","","1185.42","0.11","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>trans</i>-2,5-Dimethylpiperazine-1,4-diium dihydrogen diphosphate","","- C6 H18 N2 O7 P2 -","- C6 H18 N2 O7 P2 -","- C24 H72 N8 O28 P8 -","4","0.5","HB8111","Mrad, Houda; Elboulali, Adel; Baptiste, Benoît; Akriche, Samah","Synthesis and structure of trans-2,5-dimethylpiperazine-1,4-diium dihydrogen diphosphate","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1202","1205","10.1107/S2056989024010132","","x-ray","0.71073","MoKα","","0.0601","0.0405","","","0.0904","0.1034","","","","","","1.045","","","","has coordinates","296783","2024-12-07","17:11:47",""
"1572952","4.9435","0.0002","14.2798","0.0005","23.1247","0.0009","90","","95.512","0.002","90","","1624.88","0.11","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>,<i>N</i>',<i>N</i>''-Tricyclopropylbenzene-1,3,5-tricarboxamide","","- C18 H21 N3 O3 -","- C18 H21 N3 O3 -","- C72 H84 N12 O12 -","4","1","EX2087","Stapf, Manuel; Miyyapuram, Venugopal Rao; Seichter, Wilhelm; Mazik, Monika","Crystal structure of N,N′,N′′-tricyclopropylbenzene-1,3,5-tricarboxamide","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1194","1197","10.1107/S2056989024009800","","","0.71073","MoKα","","0.0539","0.0395","","","0.0925","0.1011","","","","","","1.019","","","","has coordinates,has disorder","296784","2024-12-07","17:11:57",""
"1572953","7.6472","0.0002","10.418","0.0003","12.7214","0.0003","77.288","0.001","77.649","0.001","75.4","0.001","943.16","0.04","105","2","104.95","","","","","","","","","5","P -1","-P 1","2","","Hexaaquanickel(II) dichloride–1,4,7,10,13,16-hexaoxacyclooctadecane–water (1/2/2)","","- C12 H32 Cl Ni0.5 O10 -","- C12 H32 Cl Ni0.5 O10 -","- C24 H64 Cl2 Ni O20 -","2","1","OI2011","Brannon, Jacob P.; Liang, Kevin; Stieber, S. Chantal E.","Crystal structure of [Ni(OH2)6]Cl2·(18-crown-6)2·2H2O","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1190","1193","10.1107/S2056989024010041","","","0.71073","MoKα","","0.0226","0.0216","","","0.0548","0.0556","","","","","","1.052","","","","has coordinates","296785","2024-12-07","17:12:18",""
"2000054","7.467","0.002","6.802","0.001","9.673","0.003","90","","108.07","0.02","90","","467.065","","","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C9 H12 N2 O5 -","- C9 H12 N2 O5 -","- C18 H24 N4 O10 -","2","1","","Averbuch-Pouchot, M.-T.; Durif, A.; Renard, A.; Kotera, M.; Lhomme, J.","(3S,2R)-3-Hydroxy-2-hydroxymethyl-7,9-diazaspiro[4.5]decane-6,8,10-trione","Acta Crystallographica Section E","2002","58","3","o256","o258","10.1107/S1600536802002337","","","","","","","0.0386","","","0.0386","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2002982","6.7685","0.0001","32.2337","0.0001","8.173","0.0001","90","","111.578","0.001","90","","1658.17","0.03","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[hexaaquacerium(III)] tetraaquacopper(II) tetrasquarate dihydrate","","- C16 H36 Ce2 Cu O34 -","- C16 H36 Ce2 Cu O34 -","- C32 H72 Ce4 Cu2 O68 -","2","0.5","","Ng, Seik Weng; Hu, Sheng-Zhi; Razak, Ibrahim Abdul; Fun, Hoong-Kun","Bis[hexaaquacerium(III)] tetraaquacopper(II) tetrasquarate dihydrate","Acta Crystallographica, Section E","2001","57","","m28","m30","10.1107/S1600536800018791","","","0.71073","MoKα","","0.055","0.043","","","","0.105","","","","","","1.02","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003034","9.9147","0.0003","9.9147","0.0003","8.6508","0.0006","90","","90","","90","","850.38","0.07","293","2","293","2","","","","","","","","3","I 4/m","-I 4","87","","","","- Mo6 O12 Pr -","- Mo6 O12 Pr -","- Mo24 O48 Pr4 -","4","0.25","","Barrier, N.; Tortelier, J.; Gougeon, P.","A new reduced molybdenum oxide with hollandite-type structure, PrMo~6~O~12~","Acta Crystallographica, Section E","2001","57","","i3","i5","10.1107/S1600536800019048","","","0.71073","MoKα","","0.038","0.032","","","","0.081","","","","","","1.176","","","","has coordinates","282068","2023-03-26","10:12:03",""
"2017770","16.24649","0.00013","16.59379","0.00012","7.40433","0.00004","90","","90","","90","","1996.14","0.02","298","","298","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Poly[μ-bromido-μ-(2,2-dimethylpropane-1,3-diyl diisocyanide)-silver(I)]","","- C7 H10 Ag Br N2 -","- C7 H10 Ag Br N2 -","- C56 H80 Ag8 Br8 N16 -","8","1","ER2080","Al-Ktaifani, Mahmoud; Rukiah, Mwaffak","Poly[μ-bromido-μ-(2,2-dimethylpropane-1,3-diyl diisocyanide)-silver(I)]: a powder diffraction study","Acta Crystallographica, Section E","2010","66","12","m1555","m1556","10.1107/S1600536810044703","powder diffraction","","1.5406","CuKα~1~","","","","","","","","","","1.28","","","","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2019769","10.1924","0.0003","10.8732","0.0003","16.9675","0.0006","97.926","0.002","93.711","0.002","107.729","0.002","1762.6","0.1","293","","293","2","","","","","","","","4","P -1","-P 1","2","chalcone","(<i>E</i>)-1-(4'-Methoxy-[1,1'-biphenyl]-4-yl)-3-(3-nitrophenyl)prop-2-en-1-one","","- C22 H17 N O4 -","- C22 H17 N O4 -","- C88 H68 N4 O16 -","4","2","SU5021","Vidhyasagar, T.; Rajeswari, K.; Shanthi, D.; Kayalvizhi, M.; Vasuki, G.; Thiruvalluvar, A.","Crystal structure of (E)-1-(4′-methoxy-[1,1′-biphenyl]-4-yl)-3-(3-nitrophenyl)prop-2-en-1-one","Acta Crystallographica Section E Crystallographic Communications","2015","71","1","1","","10.1107/S2056989014025110","","","0.71073","MoKα","","0.1325","0.062","","","0.1671","0.2129","","","","","","1.047","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2019773","5.9506","0.0002","8.1608","0.0003","27.0175","0.001","90","","90.379","0.005","90","","1311.99","0.08","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Pyridinium 3-hydroxy-2,4,6-trinitrophenolate","","- C11 H8 N4 O8 -","- C11 H8 N4 O8 -","- C44 H32 N16 O32 -","4","1","SU5046","Muthulakshmi, Selvarasu; Kalaivani, Doraisamyraja","Crystal structure and thermal behaviour of pyridinium styphnate","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","117","","10.1107/S2056989014027704","","","0.71073","MoKα","","0.0767","0.0593","","","0.1768","0.1979","","","","","","1.139","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019807","8.9129","0.0004","13.9987","0.0007","32.2568","0.0016","90","","90","","90","","4024.6","0.3","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","C23H19CuN3O3","(Pyridine-κ<i>N</i>)bis(quinolin-2-olato-κ^2^<i>N</i>,<i>O</i>)copper(II) monohydrate","","- C23 H19 Cu N3 O3 -","- C23 H19 Cu N3 O3 -","- C184 H152 Cu8 N24 O24 -","8","1","JJ2192","Hawks, Benjamin; Yan, Jingjing; Basa, Prem; Burdette, Shawn","Crystal structure of (pyridine-κN)bis(quinolin-2-olato-κ2N,O)copper(II) monohydrate","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","m38","","10.1107/S2056989015001279","","","0.71073","MoKα","","0.0774","0.0377","","","0.0797","0.0925","","","","","","1.013","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019808","8.7146","0.0003","12.3963","0.0004","16.6117","0.0006","90","","101.523","0.002","90","","1758.37","0.11","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Chloro-1-(3-methyl-2,6-diphenylpiperidin-1-yl)ethanone","","- C20 H22 Cl N O -","- C20 H22 Cl N O -","- C80 H88 Cl4 N4 O4 -","4","1","","Shreevidhyaa Suressh, V.; Prathebha, K.; Abdul Basheer, S.; Ponnuswamy, S.; Usha, G.","Crystal structure of 2-chloro-1-(3-methyl-2,6-diphenylpiperidin-1-yl)ethanone","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","o135","","10.1107/S205698901500122X","","","0.71073","MoKα","","0.072","0.0503","","","0.1971","0.2363","","","","","","0.915","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019809","11.035","0.007","9.073","0.006","12.859","0.008","90","","91.69","0.02","90","","1286.9","1.4","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-[(1-Methyl-5-nitro-1<i>H</i>-imidazol-2-yl)methyl]pyridinium iodide","","- C10 H11 I N4 O2 -","- C10 H11 I N4 O2 -","- C40 H44 I4 N16 O8 -","4","1","HG5425","Belguedj, Roumaissa; Bouraiou, Abdelmalek; Merazig, Hocine; Belfaitah, Ali; Bouacida, Sofiane","Crystal structure of 1-[(1-methyl-5-nitro-1H-imidazol-2-yl)methyl]pyridinium iodide","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","o133","","10.1107/S2056989015001541","","","0.71073","MoKα","","0.0764","0.0292","","","0.0561","0.0666","","","","","","0.988","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019810","6.4237","0.0008","8.8412","0.0011","11.7799","0.0015","88.606","0.006","76.588","0.006","70.193","0.005","611.19","0.14","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","3-{(<i>E</i>)-[(3,4-Dichlorophenyl)imino]methyl}benzene-1,2-diol","","- C13 H9 Cl2 N O2 -","- C13 H9 Cl2 N O2 -","- C26 H18 Cl4 N2 O4 -","2","1","HB7353","Tahir, Muhammad Nawaz; Shad, Hazoor Ahmad; Rauf, Abdul; Khan, Abdul Haleem","Crystal structure of 3-{(E)-[(3,4-dichlorophenyl)imino]methyl}benzene-1,2-diol","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","o137","","10.1107/S2056989015001401","","","0.71073","MoKα","","0.0791","0.0524","","","0.1372","0.1637","","","","","","1.041","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019811","10.0605","0.0003","12.7027","0.0004","23.1455","0.0006","90","","94.107","0.003","90","","2950.3","0.15","293","2","293.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-<i>tert</i>-Butyl-2-{2-[<i>N</i>-(3,3-dimethyl-2-oxobutyl)-<i>N</i>-isopropylcarbamoyl]phenyl}-1-isopropyl-1<i>H</i>-imidazol-3-ium perchlorate","","- C26 H40 Cl N3 O6 -","- C26 H40 Cl N3 O6 -","- C104 H160 Cl4 N12 O24 -","4","1","LH5748","Hordiyenko, Olga V.; Zubatyuk, Roman I.","Crystal structure of 4-tert-butyl-2-{2-[N-(3,3-dimethyl-2-oxobutyl)-N-isopropylcarbamoyl]phenyl}-1-isopropyl-1H-imidazol-3-ium perchlorate","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","223","","10.1107/S2056989015001486","","","0.71073","MoKα","","0.0805","0.0596","","","0.1627","0.1788","","","","","","1.042","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2019812","26.2042","0.0009","15.312","0.0005","16.793","0.0005","90","","90","","90","","6738","0.4","160","2","160","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","Bis[1,3-bis(diphenylphosphanyl)propane-κ^2^<i>P</i>,<i>P</i>']platinum(II) dichloride chloroform pentasolvate","","- C59 H57 Cl17 P4 Pt -","- C59 H57 Cl17 P4 Pt -","- C236 H228 Cl68 P16 Pt4 -","4","0.5","GG2144","Anderson, Bradley G.; Hoyte, Sarah A.; Spencer, John L.","Crystal structure of bis[1,3-bis(diphenylphosphanyl)propane-κ2P,P′]platinum(II) dichloride chloroform pentasolvate","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","m37","","10.1107/S205698901500136X","","","0.71073","MoKα","","0.0602","0.0373","","","0.0661","0.0728","","","","","","1.195","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2019813","18.324","0.0002","7.166","0.0001","19.508","0.0002","90","","109.341","0.004","90","","2417.03","0.08","298","1","298","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(μ-<i>N</i>,<i>N</i>'-Dibenzyldithiooxamidato-κ<i>N</i>,<i>S</i>:<i>N</i>',<i>S</i>')bis[(η^3^-crotyl)palladium(II)]","","- C24 H28 N2 Pd2 S2 -","- C24 H28 N2 Pd2 S2 -","- C96 H112 N8 Pd8 S8 -","4","0.5","ZS2324","Bruno, Giuseppe; Lanza, Santo; Giannetto, Antonino; Sacca, Alessandro; Amiri Rudbari, Hadi","Crystal structure of (μ-N,N′-dibenzyldithiooxamidato-κN,S:N′,S′)bis[(η3-crotyl)palladium(II)]","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","m40","","10.1107/S2056989015001292","","","0.71073","MoKα","","0.0338","0.0314","","","","0.0846","","","","","","1.032","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019814","5.3068","0.0003","26.711","0.0018","9.4679","0.0006","90","","117.431","0.003","90","","1191.18","0.13","295","2","295","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3-Hydroxy-2-phenylchroman-4-one","","- C15 H12 O3 -","- C15 H12 O3 -","- C60 H48 O12 -","4","1","LH5747","Belguedj, Roumaissa; Bouacida, Sofiane; Merazig, Hocine; Chibani, Aissa; Bouraiou, Abdelmalek","Crystal structure of (2S/2R,3S/3R)-3-hydroxy-2-phenylchroman-4-one","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","o131","","10.1107/S2056989015001346","","","0.71073","MoKα","","0.0921","0.0575","","","0.1319","0.1482","","","","","","1.057","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2019815","15.0519","0.0006","15.1758","0.0005","17.9186","0.0008","90","","107.886","0.002","90","","3895.2","0.3","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Bis(thiourea-κ<i>S</i>)bis(triphenylphosphane-κ<i>P</i>)silver(I) nitrate","","- C38 H38 Ag N5 O3 P2 S2 -","- C38 H38 Ag N5 O3 P2 S2 -","- C152 H152 Ag4 N20 O12 P8 S8 -","4","1","HB7352","Nawaz, Sidra; Tahir, Muhammad Nawaz; Nadeem, Muhammad Amir; Mehmood, Bushra; Ahmad, Saeed","Crystal structure of bis(thiourea-κS)bis(triphenylphosphane-κP)silver(I) nitrate","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","220","","10.1107/S2056989015001395","","","0.71073","MoKα","","0.1395","0.0507","","","0.0663","0.0881","","","","","","0.982","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019821","15.865","0.0012","9.0396","0.0003","14.8223","0.0018","90","","120.82","0.007","90","","1825.5","0.3","298","","298","","","","","","","","","6","C 1 c 1","C -2yc","9","","<i>fac</i>-Trichloridotris(trimethylphosphane-κ<i>P</i>)rhodium monohydrate","","- C9 H29 Cl3 O P3 Rh -","- C9 H29 Cl3 O P3 Rh -","- C36 H116 Cl12 O4 P12 Rh4 -","4","1","PK2543","Merola, Joseph S.; Franks, Marion A.","Crystal structures offac-trichloridotris(trimethylphosphane-κP)rhodium(III) monohydrate andfac-trichloridotris(trimethylphosphane-κP)rhodium(III) methanol hemisolvate: rhodium structures that are isotypic with their iridium analogs","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","226","","10.1107/S2056989015001516","","","0.71073","MoKα","","0.0233","0.023","","","0.0583","0.0585","","","","","","1.08","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2019822","16.0993","0.0016","15.591","0.0009","16.4152","0.0014","90","","115.084","0.013","90","","3731.7","0.7","298","","298","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","<i>fac</i>-Trichloridotris(trimethylphosphane-κ<i>P</i>)rhodium methanol hemisolvate","","- C9.5 H29 Cl3 O0.5 P3 Rh -","- C9.5 H29 Cl3 O0.5 P3 Rh -","- C76 H232 Cl24 O4 P24 Rh8 -","8","2","","Merola, Joseph S.; Franks, Marion A.","Crystal structures offac-trichloridotris(trimethylphosphane-κP)rhodium(III) monohydrate andfac-trichloridotris(trimethylphosphane-κP)rhodium(III) methanol hemisolvate: rhodium structures that are isotypic with their iridium analogs","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","226","","10.1107/S2056989015001516","","","0.71073","MoKα","","0.0375","0.0286","","","0.0671","0.0709","","","","","","1.079","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2019823","10.3522","0.0006","13.001","0.0008","21.9803","0.0014","99.823","0.002","99.061","0.002","102.677","0.002","2784.8","0.3","115","","115","","","","","","","","","8","P -1","-P 1","2","","Tricarbonyl(μ-diphenylphosphido-κ^2^<i>P</i>:<i>P</i>)(methyldiphenylsilyl-κ<i>Si</i>)bis(triphenylphosphane-κ<i>P</i>)iron(II)platinum(0)(<i>Fe</i>—<i>Pt</i>) dichloromethane hemisolvate","","- C64.5 H54 Cl Fe O3 P3 Pt Si -","- C64.5 H54 Cl Fe O3 P3 Pt Si -","- C129 H108 Cl2 Fe2 O6 P6 Pt2 Si2 -","2","1","GK2624","Mohamed, Ahmed Said; Jourdain, Isabelle; Knorr, Michael; Rousselin, Yoann; Kubicki, Marek M.","Crystal structure of tricarbonyl(μ-diphenylphosphido-κ2P:P)(methyldiphenylsilyl-κSi)bis(triphenylphosphane-κP)iron(II)platinum(0)(Fe—Pt)","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","241","","10.1107/S2056989015001565","","","0.71073","MoKα","","0.037","0.0271","","","0.0595","0.0626","","","","","","1.055","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2019824","28.0866","0.001","9.0052","0.0003","7.4023","0.0002","90","","90","","90","","1872.23","0.1","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","2-Amino-5-nitropyridinium sulfamate","","- C5 H8 N4 O5 S -","- C5 H8 N4 O5 S -","- C40 H64 N32 O40 S8 -","8","1","SU5048","Rajkumar, M. Ambrose; NizamMohideen, M.; Xavier, S. Stanly John; Anbarasu, S.; Devarajan, Dr. Prem Anand","Crystal structure of 2-amino-5-nitropyridinium sulfamate","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","231","","10.1107/S2056989015000365","","","0.71073","MoKα","","0.0582","0.0552","","","0.1089","0.1108","","","","","","1.284","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2019825","10.5568","0.0014","4.0728","0.0006","19.257","0.003","90","","95.28","0.003","90","","824.5","0.2","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[μ-methoxy(pyridin-2-yl)methanolato-κ^3^<i>N</i>,<i>O</i>:<i>O</i>]bis[chloridocopper(II)]","","- C14 H16 Cl2 Cu2 N2 O4 -","- C14 H16 Cl2 Cu2 N2 O4 -","- C28 H32 Cl4 Cu4 N4 O8 -","2","0.5","CQ2013","Boonlue, Sujirat; Sirikulkajorn, Anchalee; Chainok, Kittipong","Crystal structure of bis[μ-methoxy(pyridin-2-yl)methanolato-κ3N,O:O]bis[chloridocopper(II)]","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","m44","","10.1107/S2056989015001310","","","0.71073","MoKα","","0.0838","0.0454","","","0.0962","0.1076","","","","","","1.037","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019826","7.9947","0.0006","13.9384","0.0018","19.923","0.002","72.942","0.01","82.968","0.007","87.936","0.008","2106.5","0.4","110","2","110","2","","","","","","","","8","P -1","-P 1","2","","(Acetone-κ<i>O</i>)tris(μ-ferrocene-1,1'-dicarbonitrile-κ^2^<i>N</i>:<i>N</i>')dicopper(I) bis(tetrafluoridoborate) acetone monosolvate","","- C42 H36 B2 Cu2 F8 Fe3 N6 O2 -","- C42 H36 B2 Cu2 F8 Fe3 N6 O2 -","- C84 H72 B4 Cu4 F16 Fe6 N12 O4 -","2","1","WM5104","Strehler, Frank; Korb, Marcus; Lang, Heinrich","Crystal structure of paddle-wheel sandwich-type [Cu2{(CH3)2CO}{μ-Fe(η5-C5H4C[triple-bond]N)2}3](BF4)2·(CH3)2CO","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","244","","10.1107/S2056989015001760","","","1.54184","CuKα","","0.0441","0.0407","","","0.1044","0.1071","","","","","","1.049","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2019827","7.8655","0.0004","7.8655","0.0004","7.7938","0.0006","90","","90","","90","","482.17","0.05","293","2","293","2","","","","","","","Langban, Sweden","4","P 42/n :2","-P 4bc","86","Tetrawickmanite","Manganese(II) tin(IV) hexahydroxide]","Tetrawickmanite","- H6 Mn O6 Sn -","- H6 Mn O6 Sn -","- H24 Mn4 O24 Sn4 -","4","0.5","WM5112","Lafuente, Barbara; Yang, Hexiong; Downs, Robert T.","Crystal structure of tetrawickmanite, Mn2+Sn4+(OH)6","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","234","237","10.1107/S2056989015001632","","","0.71073","MoKα","","0.0516","0.0205","","","0.046","0.0557","","","","","","1.004","","","","has coordinates,has Fobs","282068","2023-03-26","10:12:06",""
"2019828","4.98211","0.0001","12.5624","0.0003","11.8156","0.0003","90","","91.1262","0.0014","90","","739.36","0.03","295","","295","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","β-<i>D,L</i>-Allose","","- C6 H12 O6 -","- C6 H12 O6 -","- C24 H48 O24 -","4","1","","Ishii, Tomohiko; Senoo, Tatsuya; Kozakai, Taro; Fukada, Kazuhiro; Sakane, Genta","Crystal structure of β-D,L-allose","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","o139","","10.1107/S2056989015000353","","","1.54187","CuKα","","","0.0374","","","","0.1015","","","","","","1.069","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019829","9.6432","0.0005","10.796","0.001","16.1673","0.001","90.899","0.006","97.203","0.005","91.2","0.006","1669.2","0.2","100","","100","","","","","","","","","5","P -1","-P 1","2","","Benzyl (<i>E</i>)-2-(3,4-dimethoxybenzylidene)hydrazine-1-carbodithioate","","- C17 H18 N2 O2 S2 -","- C17 H18 N2 O2 S2 -","- C68 H72 N8 O8 S8 -","4","2","SU5044","Tan, Yew-Fung; Break, Mohammed Khaled bin; Tahir, M. Ibrahim M.; Khoo, Teng-Jin","Crystal structure of benzyl (E)-2-(3,4-dimethoxybenzylidene)hydrazine-1-carbodithioate","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","238","","10.1107/S205698901500095X","","","1.5418","CuKα","","0.0437","0.0365","","0.1055","0.0985","0.1055","","","","","","0.9887","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019830","29.265","0.005","7.5671","0.0013","18.811","0.003","90","","99.271","0.007","90","","4111.3","1.2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichlorido{<i>N</i>^1^-phenyl-<i>N</i>^4^-[(quinolin-2-yl-κ<i>N</i>)methylidene]benzene-1,4-diamine-κ<i>N</i>^4^}mercury(II)","","- C22 H17 Cl2 Hg N3 -","- C22 H17 Cl2 Hg N3 -","- C176 H136 Cl16 Hg8 N24 -","8","1","WM5117","Faizi, Md. Serajul Haque; Prisyazhnaya, Elena V.; Iskenderov, Turganbay S.","Crystal structure of dichlorido{N1-phenyl-N4-[(quinolin-2-yl-κN)methylidene]benzene-1,4-diamine-κN4}mercury(II)","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","m46","","10.1107/S2056989015001620","","","0.71073","MoKα","","0.0885","0.0381","","","0.0739","0.0865","","","","","","1.002","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019831","11.8412","0.0003","12.7764","0.0003","13.8298","0.0003","67.217","0.001","66.915","0.001","85.51","0.001","1767.88","0.07","120","","120","","","","","","","","","6","P -1","-P 1","2","","Bis(tetraphenylphosphonium) bis(cyanido-κ<i>C</i>)(29<i>H</i>,31<i>H</i>-tetrabenzo[<i>b</i>,<i>g</i>,<i>l</i>,<i>q</i>]porphinato-κ^4^<i>N</i>^29^,<i>N</i>^30^,<i>N</i>^31^,<i>N</i>^32^)ferrate(II) acetone disolvate","","- C92 H72 Fe N6 O2 P2 -","- C92 H72 Fe N6 O2 P2 -","- C92 H72 Fe N6 O2 P2 -","1","0.5","","Nishi, Miki; Matsuda, Masaki; Hoshino, Norihisa; Akutagawa, Tomoyuki","Crystal structure of bis(tetraphenylphosphonium) bis(cyanido-κC)(29H,31H-tetrabenzo[b,g,l,q]porphinato-κ4N29,N30,N31,N32)ferrate(II) acetone disolvate","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","m48","","10.1107/S2056989015001735","","","1.54187","CuKα","","0.1009","0.0681","","","0.1676","0.1975","","","","","","0.981","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019832","17.763","0.003","17.652","0.003","20.145","0.004","90","","110.57","0.004","90","","5913.8","1.8","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Chlorido{5,10,15,20-tetrakis[2-(2,2-dimethylpropanamido)phenyl]porphyrinato-κ^4^<i>N</i>}iron(III)","","- C64 H64 Cl Fe N8 O4 -","- C64 H64 Cl Fe N8 O4 -","- C256 H256 Cl4 Fe4 N32 O16 -","4","1","","Awasabisah, Dennis; Powell, Douglas R.; Richter-Addo, George B.","Crystal structure of chlorido{5,10,15,20-tetrakis[2-(2,2-dimethylpropanamido)phenyl]porphyrinato-κ4N}iron(III)","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","m42","","10.1107/S205698901500153X","","","0.71073","MoKα","","0.1693","0.0923","","","0.2449","0.2798","","","","","","1.012","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2019833","11.92","0.002","6.7919","0.0013","12.144","0.003","90","","101.659","0.006","90","","962.9","0.3","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(1<i>S</i>,2<i>R</i>,4<i>R</i>,9<i>S</i>,11<i>S</i>,12<i>R</i>)-9α-Hydroxy-4,8-dimethyl-12-[(thiomorpholin-4-yl)methyl]-3,14-dioxatricyclo[9.3.0.0^2,4^]tetradec-7-en-13-one","","- C19 H29 N O4 S -","- C19 H29 N O4 S -","- C38 H58 N2 O8 S2 -","2","1","HB7355","Benharref, Ahmed; Akssira, Mohamed; El Ammari, Lahcen; Saadi, Mohamed; Berraho, Moha","Crystal structure of (1S,2R,4R,9S,11S,12R)-9α-hydroxy-4,8-dimethyl-12-[(thiomorpholin-4-yl)methyl]-3,14-dioxatricyclo[9.3.0.02,4]tetradec-7-en-13-one","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","o140","","10.1107/S205698901500170X","","","0.71073","MoKα","","0.0334","0.0314","","","0.0811","0.0829","","","","","","1.026","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019834","7.2944","0.0005","7.1464","0.0005","9.2736","0.0007","90","","101.546","0.004","90","","473.64","0.06","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","<i>catena</i>-Poly[silver(I)-μ-<i>L</i>-tyrosinato-κ^2^<i>O</i>:<i>N</i>]","","- C9 H10 Ag N O3 -","- C9 H10 Ag N O3 -","- C18 H20 Ag2 N2 O6 -","2","1","IM2459","Yousaf, Aqsa; Tahir, Muhammad Nawaz; Rauf, Abdul; Awan, Shafique Ahmad; Ahmad, Saeed","Crystal structure ofcatena-poly[silver(I)-μ-L-tyrosinato-κ2O:N]","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","m50","","10.1107/S2056989015001905","","","0.71073","MoKα","","0.0237","0.0222","","","0.0512","0.052","","","","","","1.108","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019835","12.6068","0.0005","9.9798","0.0004","22.7581","0.0009","90","","100.174","0.002","90","","2818.25","0.19","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-poly[[trimethyltin(IV)]-μ-2-(2-nitrophenyl)acetato-κ^2^<i>O</i>:<i>O</i>']","","- C11 H15 N O4 Sn -","- C11 H15 N O4 Sn -","- C88 H120 N8 O32 Sn8 -","8","1","HB7359","Danish, Muhammad; Tahir, Muhammad Nawaz; Iftikhar, Sana; Raza, Muhammad Asam; Ashfaq, Muhammad","Crystal structure ofcatena-poly[[trimethyltin(IV)]-μ-2-(2-nitrophenyl)acetato-κ2O:O′]","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","m52","","10.1107/S205698901500198X","","","0.71073","MoKα","","0.0292","0.0246","","","0.0539","0.0569","","","","","","1.099","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019836","7.518","0.0005","9.7274","0.0005","30.2035","0.0015","90","","90","","90","","2208.8","0.2","283","2","283","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(3<i>S</i>)-3-Acetoxy-17-(pyridin-3-yl)androsta-5,16-diene","(3<i>S</i>,8<i>R</i>,9<i>S</i>,10<i>R</i>,13<i>S</i>,14<i>S</i>)-10,13-Dimethyl-17-(pyridin-3-yl)-2,3,4,7,8,9,10,11,12,13,14,15-dodecahydro-1<i>H</i>-cyclopenta[<i>a</i>]phenanthren-3-yl acetate","","- C26 H33 N O2 -","- C26 H33 N O2 -","- C104 H132 N4 O8 -","4","1","HB7357","Zhou, Shengjun; Huang, Huaqi; Huang, Rongbin","Crystal structure of (3S)-3-acetoxy-17-(pyridin-3-yl)androsta-5,16-diene","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","o146","","10.1107/S2056989015001966","","","0.71073","MoKα","","0.0789","0.0558","","","0.1162","0.1282","","","","","","1.057","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019837","23.7049","0.0011","8.2632","0.0003","22.1003","0.0008","90","","102.337","0.002","90","","4229","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Ethyl 1',1''-dimethyl-2'',3-dioxo-1'',2''-dihydro-3<i>H</i>-dispiro[1-benzothiophene-2,3'-pyrrolidine-2',3''-indole]-4'-carboxylate","Ethyl 1',1''-dimethyl-2'',3-dioxo-3<i>H</i>-dispiro[benzo[<i>b</i>]thiophene-2,3'-pyrrolidine-2',3''-indoline]-4'-carboxylate","","- C23 H22 N2 O4 S -","- C23 H22 N2 O4 S -","- C184 H176 N16 O32 S8 -","8","1","SU5065","Savithri, M. P.; Suresh, M.; Raghunathan, R.; Raja, R.; SubbiahPandi, A.","Crystal structure of ethyl 1′,1′′-dimethyl-2′′,3-dioxo-3H-dispiro[benzo[b]thiophene-2,3′-pyrrolidine-2′,3′′-indoline]-4′-carboxylate","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","o142","","10.1107/S2056989015002042","","","0.71073","MoKα","","0.0472","0.0378","","","0.0979","0.105","","","","","","1.028","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019838","16.5301","0.0013","6.0573","0.0004","17.0036","0.0012","90","","100.81","0.004","90","","1672.3","0.2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-{[(Naphthalen-2-yl)sulfonylamino]methyl}cyclohexanecarboxylic acid","","- C18 H21 N O4 S -","- C18 H21 N O4 S -","- C72 H84 N4 O16 S4 -","4","1","GK2626","Danish, Muhammad; Tahir, Muhammad Nawaz; Hussain, Asif; Ashfaq, Muhammad; Sadiq, Muhammad Nadeem","Crystal structure of 4-{[(naphthalen-2-yl)sulfonylamino]methyl}cyclohexanecarboxylic acid","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","o145","","10.1107/S2056989015002054","","","0.71073","MoKα","","0.0838","0.0454","","","0.1004","0.1173","","","","","","1.02","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019839","6.5067","0.0002","9.7385","0.0002","21.078","0.0005","90","","97.154","0.001","90","","1325.22","0.06","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-(4-Methylphenyl)-4-azatricyclo[5.2.1.0^2,6^]dec-8-ene-3,5-dione","<i>rac</i>-3-Hydroxy-2-(<i>p</i>-tolyl)-2,3,3a,4,7,7a-hexahydro-1<i>H</i>-4,7-methanoisoindol-1-one","","- C16 H17 N O2 -","- C16 H17 N O2 -","- C64 H68 N4 O8 -","4","1","SU5074","Aslantaş, Mehmet; Çelik, Cumali; Çelik, Ömer; Karayel, Arzu","Crystal structure ofrac-3-hydroxy-2-(p-tolyl)-2,3,3a,4,7,7a-hexahydro-1H-4,7-methanoisoindol-1-one","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","o143","","10.1107/S2056989015001942","","","0.71073","MoKα","","0.0816","0.0626","","","0.1602","0.1795","","","","","","1.086","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019844","13.0433","0.0006","12.27","0.0005","13.4981","0.0007","90","","114.269","0.002","90","","1969.34","0.16","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","PPBD","<i>N</i>^1^-Phenyl-<i>N</i>^4^-[(<i>E</i>)-(pyren-1-yl)methylidene]benzene-1,4-diamine","","- C29 H20 N2 -","- C29 H20 N2 -","- C116 H80 N8 -","4","1","SU5072","Faizi, Md. Serajul Haque; Prisyazhnaya, Elena V.","Crystal structure ofN1-phenyl-N4-[(E)-(pyren-1-yl)methylidene]benzene-1,4-diamine","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","261","","10.1107/S2056989015001814","","","0.71073","MoKα","","0.1123","0.0562","","","0.115","0.1357","","","","","","1.019","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019845","7.133","0.0014","8.7013","0.0016","11.979","0.002","103.969","0.002","101.052","0.002","100.882","0.003","686.2","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Diaqua(μ~2~-triethylenetetraminehexaacetato)dizinc tetrahydrate","","- C18 H38 N4 O18 Zn2 -","- C18 H38 N4 O18 Zn2 -","- C18 H38 N4 O18 Zn2 -","1","0.5","HB7351","Liu, Huan; Lu, Li-Ping","Crystal structure of diaqua(μ2-triethylenetetraminehexaacetato)dizinc tetrahydrate","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","m55","","10.1107/S2056989015002108","","","0.71073","MoKα","","0.0389","0.0342","","","0.087","0.0888","","","","","","0.993","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019846","16.311","0.005","11.103","0.005","23.585","0.005","90","0.005","98.354","0.005","90","0.005","4226","2","293","2","293","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","Ethyl 1',5-dimethyl-2'',3-dioxo-3<i>H</i>-dispiro[benzo[<i>b</i>]thiophene-2,3'-pyrrolidine-2',3''-indoline]-4'-carboxylate","","- C23 H22 N2 O4 S -","- C23 H22 N2 O4 S -","- C184 H176 N16 O32 S8 -","8","2","SU5064","Raja, R.; Govindaraj, J.; Suresh, M.; Raghunathan, R.; SubbiahPandi, A.","Crystal structure of ethyl 1′,5-dimethyl-2′′,3-dioxo-3H-dispiro[benzo[b]thiophene-2,3′-pyrrolidine-2′,3′′-indoline]-4′-carboxylate","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","o152","","10.1107/S2056989015001528","","","0.71073","MoKα","","0.1083","0.0542","","","0.1523","0.1822","","","","","","1.071","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019847","13.0774","0.0005","13.4537","0.0005","26.5153","0.0009","90","","90","","90","","4665.1","0.3","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Chlorido(2-{1-[2-(4-chlorophenyl)hydrazin-1-ylidene-κ<i>N</i>]ethyl}pyridine-κ<i>N</i>)(η^5^-pentamethylcyclopentadienyl)rhodium(III) chloride","","- C23 H27 Cl3 N3 Rh -","- C23 H27 Cl3 N3 Rh -","- C184 H216 Cl24 N24 Rh8 -","8","1","RZ5146","Devika, Neelakandan; Raja, Nandhagopal; Ananthalakshmi, Subbiah; Therrien, Bruno","Crystal structure of chlorido(2-{1-[2-(4-chlorophenyl)hydrazin-1-ylidene-κN]ethyl}pyridine-κN)(η5-pentamethylcyclopentadienyl)rhodium(III) chloride","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","248","","10.1107/S205698901500184X","","","0.71073","MoKα","","0.0587","0.0318","","","0.0501","0.0535","","","","","","0.958","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019848","9.7935","0.0016","11.2141","0.0018","19.57","0.003","103.601","0.004","90.867","0.003","108.24","0.004","1974.9","0.5","195","2","195","2","","","","","","","","6","P -1","-P 1","2","","[1-(2,6-Diisopropylphenyl)-2,4-bis(dimethylamino)-5-trimethylsilyl-1,3,5-triazapentadienyl-κ^2^<i>N</i>^1^,<i>N</i>^5^](triphenylphosphane-κ<i>P</i>)copper(I)","","- C39 H53 Cu N5 P Si -","- C39 H53 Cu N5 P Si -","- C78 H106 Cu2 N10 P2 Si2 -","2","1","","Li, Feiguang; Yan, Lei; Tong, Hongbo; Zhou, Meisu","Crystal structure of [1-(2,6-diisopropylphenyl)-2,4-bis(dimethylamino)-5-trimethylsilyl-1,3,5-triazapentadienyl-κ2N1,N5](triphenylphosphane-κP)copper(I)","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","m54","","10.1107/S2056989015002169","","","0.71073","MoKα","","0.1189","0.0509","","","0.0748","0.0891","","","","","","0.749","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019849","11.2426","0.0003","11.4899","0.0003","30.372","0.0009","79.121","0.001","88.628","0.002","81.85","0.001","3813.91","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(<i>Z</i>)-2-(1-Benzyl-2-oxoindolin-3-ylidene)-<i>N</i>-phenylhydrazine-1-carbothioamide","","- C22 H18 N4 O S -","- C22 H18 N4 O S -","- C176 H144 N32 O8 S8 -","8","4","SU5069","Vimala, G.; Haribabu, J.; Karvembu, R.; Kumar, B. V. N. Phani; SubbiahPandi, A.","Crystal structure of (Z)-2-(1-benzyl-2-oxoindolin-3-ylidene)-N-phenylhydrazine-1-carbothioamide","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","o160","","10.1107/S2056989015002248","","","0.71073","MoKα","","0.167","0.0525","","","0.1116","0.1556","","","","","","0.986","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019850","10.7726","0.0006","9.7572","0.0003","12.2084","0.0005","90","","115.547","0.006","90","","1157.77","0.11","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3-[2-(thiophen-3-yl)ethynyl]-2H-chromen-2-one","3-[2-(Thiophen-3-yl)ethynyl]-2<i>H</i>-chromen-2-one","","- C15 H8 O2 S -","- C15 H8 O2 S -","- C60 H32 O8 S4 -","4","1","","Caracelli, Ignez; Maganhi, Stella H.; Stefani, Hélio A.; Gueogjian, Karina; Tiekink, Edward R. T.","Crystal structure of 3-[2-(thiophen-3-yl)ethynyl]-2H-chromen-2-one","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","o154","","10.1107/S2056989015002157","","","1.54184","CuKα","","0.0548","0.0504","","","0.1499","0.1557","","","","","","1.063","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019851","10.8336","0.0011","11.7927","0.0011","13.7275","0.0014","90","","108.357","0.002","90","","1664.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Methylamino-3-nitro-4-<i>p</i>-tolylpyrano[3,2-<i>c</i>]chromen-5(4<i>H</i>)-one","","- C20 H16 N2 O5 -","- C20 H16 N2 O5 -","- C80 H64 N8 O20 -","4","1","HB7345","Govindaraj, J.; AaminaNaaz, Y.; Kamalraja, Jayabal; Perumal, Paramasivam T.; SubbiahPandi, A.","Crystal structure of 2-methylamino-3-nitro-4-p-tolylpyrano[3,2-c]chromen-5(4H)-one","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","o158","","10.1107/S205698901500225X","","","0.71073","MoKα","","0.0931","0.0498","","","0.1188","0.1508","","","","","","1.028","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019852","10.85","0.01","9.51","0.009","11.2","0.011","90","","94.85","0.02","90","","1151.5","1.9","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","<i>N</i>-{<i>N</i>-[<i>N</i>-Acetyl-(<i>S</i>)-leucyl]-(<i>S</i>)-leucyl}norleucinal","","- C20 H37 N3 O4 -","- C20 H37 N3 O4 -","- C40 H74 N6 O8 -","2","1","GK2625","Czerwinski, Andrzej; Basava, Channa; Dauter, Miroslawa; Dauter, Zbigniew","Crystal structure ofN-{N-[N-acetyl-(S)-leucyl]-(S)-leucyl}norleucinal (ALLN), an inhibitor of proteasome","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","254","","10.1107/S2056989015002091","","","0.6199","synchrotron","","0.0417","0.0412","","","0.1142","0.115","","","","","","1.073","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019853","34.883","0.005","8.3956","0.0009","6.583","0.0008","90","","95.65","0.011","90","","1918.6","0.4","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","1,1'-[Imidazolidine-1,3-diylbis(methylene)]bis(naphthalen-2-ol)","1-({3-[(2-Hydroxynaphthalen-1-yl)methyl]imidazolidin-1-yl}methyl)naphthalen-2-ol","","- C25 H24 N2 O2 -","- C25 H24 N2 O2 -","- C100 H96 N8 O8 -","4","0.5","","Rivera, Augusto; Rojas, Jicli José; Ríos-Motta, Jaime; Bolte, Michael","Crystal structure of 1,1′-[imidazolidine-1,3-diylbis(methylene)]bis(naphthalen-2-ol)","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","258","","10.1107/S2056989015002078","","","0.71073","MoKα","","0.0686","0.0546","","","0.1503","0.1585","","","","","","1.088","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019854","11.8894","0.0005","10.2181","0.0004","17.5044","0.0008","90","","97.991","0.002","90","","2105.91","0.15","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Ethyl 2'',3-dioxo-1'',2'',3',3'a,4',6'-hexahydro-3<i>H</i>-dispiro[1-benzothiophene-2,2'-pyrrolo[1,2-<i>c</i>][1,3]thiazole-1',3''-indole]-3'-carboxylate","2'',3-Dioxo-7',7a'-dihydro-1'<i>H</i>,3<i>H</i>,3'<i>H</i>-dispiro[benzo[<i>b</i>]thiophene-2,6'-pyrrolo[1,2-<i>c</i>]thiazole-5',3''-indoline]-7'-carboxylate","","- C23 H20 N2 O4 S2 -","- C23 H20 N2 O4 S2 -","- C92 H80 N8 O16 S8 -","4","1","SU5067","Savithri, M. P.; Suresh, M.; Raghunathan, R.; Raja, R.; SubbiahPandi, A.","Crystal structure of ethyl 2′′,3-dioxo-7′,7a'-dihydro-1′H,3H,3′H-dispiro[benzo[b]thiophene-2,6′-pyrrolo[1,2-c]thiazole-5′,3′′-indoline]-7′-carboxylate","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","o148","","10.1107/S2056989015002030","","","0.71073","MoKα","","0.0397","0.0319","","","0.0806","0.0877","","","","","","0.977","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2019855","13.877","0.002","11.8999","0.0019","15.426","0.004","90","","116.463","0.004","90","","2280.5","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Ethyl 5''-fluoro-2'',3-dioxo-1'',2',2'',5',6',7',8',8'a-\ octahydro-3<i>H</i>-dispiro[1-benzothiophene-2,1'-indolizine-3',3''-\ indole]-2'-carboxylate","Ethyl 5''-fluoro-2'',3-dioxo-6',7',8',8a'-tetrahydro-\ 2'<i>H</i>,3<i>H</i>,5'<i>H</i>-dispiro[benzo[<i>b</i>]thiophene-2,1'-\ indolizine-3',3''-indoline]-2'-carboxylate","","- C25 H23 F N2 O4 S -","- C25 H23 F N2 O4 S -","- C100 H92 F4 N8 O16 S4 -","4","1","SU5063","Raja, R.; Govindaraj, J.; Suresh, M.; Raghunathan, R.; SubbiahPandi, A.","Crystal structure of ethyl 5′′-fluoro-2′′,3-dioxo-6′,7′,8′,8a'-tetrahydro-2′H,3H,5′H-dispiro[benzo[b]thiophene-2,1′-indolizine-3′,3′′-indoline]-2′-carboxylate","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","o156","","10.1107/S2056989015002121","","","0.71073","MoKα","","0.0656","0.0438","","","0.1039","0.1188","","","","","","1.035","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019856","9.8527","0.0001","9.8527","0.0001","9.8527","0.0001","90","","90","","90","","956.458","0.017","293","2","293","2","","","","","","","","6","P 21 3","P 2ac 2ab 3","198","","Potassium rubidium cobalt(II)/titanium(IV) tris(orthophosphate)","","- Co0.293 K0.845 O12 P3 Rb0.743 Ti1.707 -","- Co0.2927 K0.844 O12 P3 Rb0.743 Ti1.7073 -","- Co1.1708 K3.376 O48 P12 Rb2.972 Ti6.8292 -","4","0.333333","BR2246","Strutynska, Nataliia Yu.; Bondarenko, Marina A.; Ogorodnyk, Ivan V.; Baumer, Vyacheslav N.; Slobodyanik, Nikolay S.","Crystal structure of langbeinite-related Rb0.743K0.845Co0.293Ti1.707(PO4)3","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","251","","10.1107/S2056989015001826","","","0.71073","MoKα","","0.0306","0.0258","","","","0.0514","","","","","","1.053","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019857","9.4184","0.0003","9.8804","0.0004","12.5401","0.0005","95.341","0.002","107.535","0.002","99.94","0.002","1082.87","0.07","293","2","293","2","","","","","","","","4","P -1","-P 1","2","20-(Naphthalen-1-yl)-19-oxa-8,17-diazapentacyclo[8.7.3.0^1,10^.0^2,7^.0^12,17^]icosa-2(7),3,5-triene-9,18-dione","15-(Naphthalen-1-yl)-7,7a,8,9,10,11-hexahydro-6a,12a-(methanoepoxymethano)indolizino[2,3-<i>c</i>]quinoline-6,13(5<i>H</i>)-dione","","- C27 H24 N2 O3 -","- C27 H24 N2 O3 -","- C54 H48 N4 O6 -","2","1","SU5066","Savithri, M. P.; Suresh, M.; Raghunathan, R.; Raja, R.; SubbiahPandi, A.","Crystal structure of 15-(naphthalen-1-yl)-7,7a,8,9,10,11-hexahydro-6a,12a-(methanoepoxymethano)indolizino[2,3-c]quinoline-6,13(5H)-dione","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","o150","","10.1107/S2056989015002017","","","0.71073","MoKα","","0.057","0.0402","","","0.1146","0.1573","","","","","","0.872","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019858","7.432","0.0003","11.9278","0.0003","15.3152","0.0006","90","","90","","90","","1357.65","0.08","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3,4a,8-Trimethyldodecahydroazuleno[6,5-<i>b</i>]furan-2,5-dione","","- C15 H22 O3 -","- C15 H22 O3 -","- C60 H88 O12 -","4","1","","Beghidja, Noureddine; Benayache, Samir; Benayache, Fadila; Knight, David W.; Kariuki, Benson M.","Crystal structure of pseudoguainolide","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","o162","","10.1107/S2056989015002510","","","0.71073","MoKα","","0.0637","0.0474","","","0.099","0.107","","","","","","1.077","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019859","9.9727","0.0015","31.971","0.005","10.2162","0.0015","90","","110.022","0.002","90","","3060.4","0.8","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","[1,3-Bis(diphenylphosphanyl)propane-κ^2^<i>P</i>,<i>P</i>'](<i>N</i>,<i>N</i>'-dimethylthiourea-κ<i>S</i>)(thiocyanato-κ<i>N</i>)copper(I)","","- C31 H34 Cu N3 P2 S2 -","- C31 H34 Cu N3 P2 S2 -","- C124 H136 Cu4 N12 P8 S8 -","4","2","LH5751","Wattanakanjana, Yupa; Nimthong-Roldán, Arunpatcha; Ratthiwan, Janejira","Crystal structure of [1,3-bis(diphenylphosphanyl)propane-κ2P,P′](N,N′-dimethylthiourea-κS)(thiocyanato-κN)copper(I)","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","m61","","10.1107/S2056989015002479","","","0.71073","MoKα","","0.0511","0.0454","","","0.1084","0.1106","","","","","","1.061","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2019860","5.4431","0.0003","6.4313","0.0004","28.5697","0.0015","90","","92.762","0.002","90","","998.96","0.1","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetraaquabis[2-(2-nitrophenyl)acetato-κ<i>O</i>]cobalt(II)","","- C16 H20 Co N2 O12 -","- C16 H20 Co N2 O12 -","- C32 H40 Co2 N4 O24 -","2","0.5","WM5121","Danish, Muhammad; Tahir, Muhammad Nawaz; Iftikhar, Sana; Raza, Muhammad Asam; Ashfaq, Muhammad","Tetraaquabis[2-(2-nitrophenyl)acetato-κO]cobalt(II)","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","m59","","10.1107/S2056989015002467","","","0.71073","MoKα","","0.0323","0.0277","","","0.0677","0.0704","","","","","","1.044","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019861","18.3559","0.0011","9.6747","0.0005","10.3368","0.0006","90","","116.81","0.002","90","","1638.37","0.16","173","2","173","2","","","","","","","","5","C 1 2 1","C 2y","5","","Bis[<i>S</i>-hexyl 3-(4-methylbenzylidene)dithiocarbazato-κ^2^<i>N</i>^3^,<i>S</i>]palladium(II)","","- C30 H42 N4 Pd S4 -","- C30 H42 N4 Pd S4 -","- C60 H84 N8 Pd2 S8 -","2","0.5","","Begum, M. Sabina; Howlader, M. Belayet Hossain; Sheikh, M. Chanmiya; Miyatake, Ryuta; Zangrando, Ennio","Crystal structure of bis[S-hexyl 3-(4-methylbenzylidene)dithiocarbazato-κ2N3,S]palladium(II)","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","m63","","10.1107/S2056989015002236","","","1.54187","CuKα","","0.0989","0.0905","","","0.2136","0.2245","","","","","","1.029","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019862","8.019","0.006","9.562","0.008","9.984","0.008","88.937","0.013","76.254","0.012","71.586","0.013","704.2","1","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","2,3-Bis(4-chlorophenyl)-1,3-thiazolidin-4-one","","- C15 H11 Cl2 N O S -","- C15 H11 Cl2 N O S -","- C30 H22 Cl4 N2 O2 S2 -","2","1","SU5062","Yennawar, Hemant P.; Tierney, John; Hullihen, Patrick D.; Silverberg, Lee J.","Crystal structures of 2,3-bis(4-chlorophenyl)-1,3-thiazolidin-4-one andtrans-2,3-bis(4-chlorophenyl)-1,3-thiazolidin-4-one 1-oxide","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","264","","10.1107/S2056989015001954","","","0.71073","MoKα","","0.0393","0.0359","","","0.0956","0.0987","","","","","","1.046","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019863","7.1094","0.0017","20.94","0.005","20.94","","90","","90","","90","","3117.4","1.1","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","2,3-Bis(4-chlorophenyl)-1,3-thiazolidin-4-one 1-oxide","","- C15 H11 Cl2 N O2 S -","- C15 H11 Cl2 N O2 S -","- C120 H88 Cl16 N8 O16 S8 -","8","1","SU5062","Yennawar, Hemant P.; Tierney, John; Hullihen, Patrick D.; Silverberg, Lee J.","Crystal structures of 2,3-bis(4-chlorophenyl)-1,3-thiazolidin-4-one andtrans-2,3-bis(4-chlorophenyl)-1,3-thiazolidin-4-one 1-oxide","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","264","","10.1107/S2056989015001954","","","0.71073","MoKα","","0.0791","0.0513","","","0.1263","0.1381","","","","","","1.065","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2019864","9.3108","0.0004","10.1943","0.0004","13.4745","0.0005","81.557","0.002","79.143","0.002","77.797","0.003","1220.03","0.09","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","Bis(1-methyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)(5,10,15,20-tetraphenylporphyrinato-κ^4^<i>N</i>)iron(II)‒1-methyl-1<i>H</i>-imidazole (1/2)","","- C60 H52 Fe N12 -","- C60 H52 Fe N12 -","- C60 H52 Fe N12 -","1","0.5","","Guan, Ye; Powell, Douglas R.; Richter-Addo, George B.","Crystal structure of bis(1-methyl-1H-imidazole-κN3)(5,10,15,20-tetraphenylporphyrinato-κ4N)iron(II)‒1-methyl-1H-imidazole (1/2)","Acta Crystallographica Section E Crystallographic Communications","2015","71","3","m57","","10.1107/S2056989015002364","","","0.71073","MoKα","","0.0469","0.0402","","","0.1121","0.1191","","","","","","0.999","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2019884","16.2389","0.0005","15.3506","0.0005","16.5549","0.0005","90","","99.3892","0.0017","90","","4071.5","0.2","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis[4'-(pyridin-4-yl)-2,2':6',2''-terpyridine]manganese(II) bis(hexafluoridophosphate) monohydrate","","- C40 H30 F12 Mn N8 O P2 -","- C40 H28 F12 Mn N8 O P2 -","- C160 H112 F48 Mn4 N32 O4 P8 -","4","1","HG5428","Lourenço, Leandro M. O.; Almeida Paz, Filipe A.; Fernandes, José A.","Crystal structures of the water and acetone monosolvates of bis[4′-(pyridin-4-yl)-2,2′:6′,2′′-terpyridine]manganese(II) bis(hexafluoridophosphate)","Acta Crystallographica Section E Crystallographic Communications","2015","71","4","330","","10.1107/S2056989015003503","","","0.71073","MoKα","","0.1174","0.0885","","","0.2176","0.2444","","","","","","1.067","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2019885","18.0996","0.0015","27.47","0.002","8.5734","0.0006","90","","90","","90","","4262.7","0.6","150","2","150","2","","","","","","","","7","C 2 2 21","C 2c 2","20","","Bis[4'-(pyridin-4-yl)-2,2':6',2''-terpyridine]manganese(II) bis(hexafluoridophosphate) acetone monosolvate","","- C43 H34 F12 Mn N8 O P2 -","- C43 H34 F12 Mn N8 O P2 -","- C172 H136 F48 Mn4 N32 O4 P8 -","4","0.5","","Lourenço, Leandro M. O.; Almeida Paz, Filipe A.; Fernandes, José A.","Crystal structures of the water and acetone monosolvates of bis[4′-(pyridin-4-yl)-2,2′:6′,2′′-terpyridine]manganese(II) bis(hexafluoridophosphate)","Acta Crystallographica Section E Crystallographic Communications","2015","71","4","330","","10.1107/S2056989015003503","","","0.71073","MoKα","","0.1446","0.1036","","","0.2439","0.27","","","","","","1.068","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2019920","14.707","0.005","14.707","0.005","19.175","0.007","90","","90","","120","","3592","2","298","2","298","2","","","","","","","","4","R -3 c :H","-R 3 2""c","167","Double hexakismolybdate(VI) de chrome et de nonasodium","Nonasodium chromium(III) hexakis[molybdate(VI)]","","- Cr Mo6 Na9 O24 -","- Cr Mo6 Na9 O24 -","- Cr6 Mo36 Na54 O144 -","6","0.166667","RU2063","Dridi, Wassim; Ennajeh, Ines; Zid, Mohamed Faouzi","Synthèse et étude structurale de Na9Cr(MoO4)6","Acta Crystallographica Section E Crystallographic Communications","2015","71","5","435","","10.1107/S2056989015005976","","","0.71073","MoKα","","0.0518","0.0282","","","0.0729","0.0779","","","","","","1.126","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019951","8.0357","0.0003","5.5554","0.0002","12.8733","0.0005","90","","101.312","0.001","90","","563.52","0.04","100","","100","0.1","","","","","","","","4","P 1 c 1","P -2yc","7","(<i>E</i>)-2-Hydroxy-4'-methoxyazastilbene","(<i>E</i>)-2-[(4-Methoxybenzylidene)amino]phenol","","- C14 H13 N O2 -","- C14 H13 N O2 -","- C28 H26 N2 O4 -","2","1","SU5124","Chantrapromma, Suchada; Kaewmanee, Narissara; Boonnak, Nawong; Chantrapromma, Kan; Ghabbour, Hazem A.; Fun, Hoong-Kun","Crystal structure of (E)-2-hydroxy-4′-methoxyazastilbene","Acta Crystallographica Section E Crystallographic Communications","2015","71","6","571","","10.1107/S2056989015008348","","","0.71073","MoKα","","0.0369","0.0366","","","0.0993","0.0996","","","","","","1.09","","","","has coordinates,has Fobs","136425","2020-10-21","18:00:00",""
"2019956","15.1241","0.0009","6.0111","0.0004","14.3212","0.0009","90","","110.268","0.002","90","","1221.36","0.13","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-(<i>p</i>-tolyl)-4<i>H</i>-benzo[<i>e</i>][1,3]thiazine","2-(4-Methylphenyl)-4<i>H</i>-1,3-benzothiazine","","- C15 H13 N S -","- C15 H13 N S -","- C60 H52 N4 S4 -","4","1","IS5385","Sandhya, N. C.; Chandra,; Suresha, G. P.; Lokanath, N. K.; Mahendra, M.","Crystal structure of 2-(4-methylphenyl)-4H-1,3-benzothiazine","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","o74","","10.1107/S205698901402725X","","","1.54178","CuKα","","0.0372","0.0359","","","0.1008","0.1019","","","","","","1.054","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"2019957","14.0819","0.0007","9.747","0.0005","24.0399","0.0012","90","","90","","90","","3299.6","0.3","293","","293","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Ethyl 6-bromo-2-[(<i>E</i>)-2-phenylethenyl]quinoline-4-carboxylate","","- C20 H16 Br N O2 -","- C20 H16 Br N O2 -","- C160 H128 Br8 N8 O16 -","8","1","SU5042","Shrungesh Kumar, T. O.; Naveen, S.; Kumara, M. N.; Mahadevan, K. M.; Lokanath, N. K.","Crystal structure of ethyl 6-bromo-2-[(E)-2-phenylethenyl]quinoline-4-carboxylate","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","o121","","10.1107/S2056989014028266","","","1.54178","CuKα","","0.0566","0.0459","","","0.1228","0.1341","","","","","","1.043","","","","has coordinates,has Fobs","136871","2020-10-21","18:00:00",""
"2019958","17.6546","0.0005","6.1464","0.0002","30.0234","0.0009","90","","99.899","0.004","90","","3209.4","0.17","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","chalcone","(<i>E</i>)-1-([1,1'-Biphenyl]-4-yl)-3-(3-nitrophenyl)prop-2-en-1-one","","- C21 H15 N O3 -","- C21 H15 N O3 -","- C168 H120 N8 O24 -","8","1","SU5060","Shanthi, D.; Vidhyasagar, T.; Rajeswari, K.; Kayalvizhi, M.; Vasuki, G.; Thiruvalluvar, A.","Crystal structure of (E)-1-([1,1′-biphenyl]-4-yl)-3-(3-nitrophenyl)prop-2-en-1-one","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","o119","","10.1107/S2056989015000523","","","0.71073","MoKα","","0.0649","0.0486","","","0.1252","0.1379","","","","","","1.081","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"2019959","7.9925","0.0003","12.1761","0.0005","14.2313","0.0006","93.549","0.002","95.52","0.002","101.602","0.002","1345.67","0.09","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","2-[2-(4-Chlorophenyl)-1-(4-methoxyphenyl)-4-oxoazetidin-3-yl]benzo[<i>de</i>]isoquinoline-1,3-dione dimethyl sulfoxide monosolvate","","- C30 H25 Cl N2 O5 S -","- C30 H25 Cl N2 O5 S -","- C60 H50 Cl2 N4 O10 S2 -","2","1","HB7354","Çelik, Ísmail; Akkurt, Mehmet; Jarrahpour, Aliasghar; Rad, Javad Ameri; Çelik, Ömer","Crystal structure of 2-[4-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-oxoazetidin-3-yl]benzo[de]isoquinoline-1,3-dione dimethyl sulfoxide monosolvate","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","o129","","10.1107/S2056989015001425","","","0.71073","MoKα","","0.0786","0.0608","","","0.172","0.1907","","","","","","1.053","","","","has coordinates,has disorder,has Fobs","136884","2020-10-21","18:00:00",""
"2019960","6.871","0.0004","10.7188","0.0006","14.9178","0.0007","103.569","0.004","93.094","0.004","105.878","0.005","1019.03","0.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4-[1-(2-Hydroxypropyl)-4,5-diphenyl-1<i>H</i>-imidazol-2-yl]benzoic acid","","- C25 H22 N2 O3 -","- C25 H22 N2 O3 -","- C50 H44 N4 O6 -","2","1","HB7338","Jasinski, Jerry P.; Mohamed, Shaaban K.; Akkurt, Mehmet; Abdelhamid, Antar A.; Albayati, Mustafa R.","Crystal structure of 4-[1-(2-hydroxypropyl)-4,5-diphenyl-1H-imidazol-2-yl]benzoic acid","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","o77","","10.1107/S2056989014027078","","","1.54184","CuKα","","0.0574","0.0482","","","0.1269","0.1358","","","","","","1.02","","","","has coordinates,has Fobs","136888","2020-10-21","18:00:00",""
"2019961","12.3449","0.0006","13.4266","0.0006","15.7404","0.0007","72.926","0.004","67.39","0.004","76.824","0.004","2282.6","0.2","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","4-[(<i>E</i>)-(4-Nitrobenzylidene)amino]phenol","","- C13 H10 N2 O3 -","- C13 H10 N2 O3 -","- C104 H80 N16 O24 -","8","4","HB7349","Atioğlu, Zeliha; Akkurt, Mehmet; Jarrahpour, Aliasghar; Ebrahimi, Edris; Büyükgüngör, Orhan","Crystal structure of 4-[(E)-(4-nitrobenzylidene)amino]phenol","Acta Crystallographica Section E Crystallographic Communications","2015","71","2","o113","","10.1107/S2056989015000511","","","0.71073","MoKα","","0.1366","0.0697","","","0.1665","0.1967","","","","","","0.957","","","","has coordinates,has disorder,has Fobs","136895","2020-10-21","18:00:00",""
"2019971","8.1623","0.0007","12.5953","0.0009","13.251","0.0008","90","","90.226","0.003","90","","1362.28","0.17","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-<i>N</i>'-(5-Bromo-2-hydroxybenzylidene)nicotinohydrazide monohydrate","","- C13 H12 Br N3 O3 -","- C13 H12 Br N3 O3 -","- C52 H48 Br4 N12 O12 -","4","1","SU5132","Sravya, S.; Sruthy, S.; Aiswarya, N.; Sithambaresan, M.; Kurup, M. R. Prathapachandra","Crystal structure of (E)-N′-(5-bromo-2-hydroxybenzylidene)nicotinohydrazide monohydrate","Acta Crystallographica Section E Crystallographic Communications","2015","71","7","734","","10.1107/S2056989015009627","","","0.71073","MoKα","","0.0671","0.036","","","0.0909","0.1022","","","","","","0.989","","","","has coordinates,has Fobs","138433","2020-10-21","18:00:00",""
"2020017","22.2647","0.0016","14.6139","0.0011","18.6288","0.0014","90","","102.447","0.001","90","","5918.9","0.8","100","2","100","2","","","","","","","","6","C 1 c 1","C -2yc","9","","[1,1'''-Bis(pyrimidin-2-yl)-4,4':2',2'':4'',4'''-quaterpyridine-1,1'''-diium-κ^2^<i>N</i>^1'^,<i>N</i>^1''^]bis[2-(pyridin-2-yl)phenyl-κ^2^<i>N</i>,<i>C</i>^1^]iridium(III) tris(hexafluoridophosphate) acetonitrile trisolvate","","- C56 H45 F18 Ir N13 P3 -","- C56 H45 F18 Ir N13 P3 -","- C224 H180 F72 Ir4 N52 P12 -","4","1","ZL2625","Coe, Benjamin J.; Peers, Martyn K.; Raftery, James; Scrutton, Nigel S.","Crystal structure of [1,1′′′-bis(pyrimidin-2-yl)-4,4′:2′,2′′:4′′,4′′′-quaterpyridine-1,1′′′-diium-κ2N1′,N1′′]bis[2-(pyridin-2-yl)phenyl-κ2N,C1]iridium(III) tris(hexafluoridophosphate) acetonitrile trisolvate","Acta Crystallographica Section E Crystallographic Communications","2015","71","8","879","","10.1107/S2056989015012463","","","0.71073","MoKα","","0.052","0.0407","","","0.0891","0.0926","","","","","","0.998","","","","has coordinates,has Fobs","139968","2020-10-21","18:00:00",""
"2020085","10.9786","0.0003","10.9374","0.0003","23.5429","0.0005","90","","97.554","0.002","90","","2802.43","0.12","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6,6,12,12-Tetrachlorotricyclo[8.2.0.0^4,7^]dodecane-5,11-dione","","- C12 H12 Cl4 O2 -","- C12 H12 Cl4 O2 -","- C96 H96 Cl32 O16 -","8","2","XU5862","Turan Akın, Esra; Hökelek, Tuncer","Crystal structure of 6,6,12,12-tetrachlorotricyclo[8.2.0.04,7]dodecane-5,11-dione","Acta Crystallographica Section E Crystallographic Communications","2015","71","9","1000","","10.1107/S2056989015014383","","","0.71073","MoKα","","0.1102","0.0643","","","0.116","0.1309","","","","","","1.104","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"2020127","9.682","0.0006","10.654","0.0003","23.3676","0.0007","90","","97.184","0.01","90","","2391.49","0.19","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(±)-<i>N</i>-[(1<i>RS</i>,2<i>RS</i>,4<i>RS</i>)-1,7,7-Trimethylbicyclo[2.2.1]heptan-2-yl]acetamide","","- C12 H21 N O -","- C12 H21 N O -","- C96 H168 N8 O8 -","8","2","","Stepanovs, Dmitrijs; Posevins, Daniels; Turks, Maris","Crystal structures of two (±)-exo-N-isobornylacetamides","Acta Crystallographica Section E Crystallographic Communications","2015","71","10","1117","","10.1107/S2056989015015984","","","0.71073","MoKα","","0.1175","0.0647","","","0.1441","0.1594","","","","","","1.05","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"2020128","9.6852","0.0002","10.7589","0.0003","23.7261","0.0008","90","","90","","90","","2472.31","0.12","173","2","173","2","","","","","","","","5","P c a b","-P 2bc 2ac","61","","(±)-2-Chloro-<i>N</i>-[(1<i>RS</i>,2<i>RS</i>,4<i>RS</i>)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl]acetamide","","- C12 H20 Cl N O -","- C12 H20 Cl N O -","- C96 H160 Cl8 N8 O8 -","8","1","","Stepanovs, Dmitrijs; Posevins, Daniels; Turks, Maris","Crystal structures of two (±)-exo-N-isobornylacetamides","Acta Crystallographica Section E Crystallographic Communications","2015","71","10","1117","","10.1107/S2056989015015984","","","0.71073","MoKα","","0.1575","0.0726","","","0.1335","0.1596","","","","","","1.021","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"2020282","11.0317","0.001","11.8701","0.001","11.122","0.0009","90","","118.675","0.002","90","","1277.78","0.19","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(5-Chloro-2-hydroxyphenyl)(3-methylisoxazolo[5,4-<i>b</i>]pyridin-5-yl)methanone","","- C14 H9 Cl N2 O3 -","- C14 H9 Cl N2 O3 -","- C56 H36 Cl4 N8 O12 -","4","1","SU5220","Raja, Rajamani; Poomathi, Nataraj; Perumal, Paramasivam T.; SubbiahPandi, A.","Crystal structure of (5-chloro-2-hydroxyphenyl)(3-methylisoxazolo[5,4-b]pyridin-5-yl)methanone","Acta Crystallographica Section E Crystallographic Communications","2015","71","11","o875","","10.1107/S2056989015019635","","","0.71073","MoKα","","0.0669","0.0477","","","0.0905","0.1103","","","","","","1.131","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"2020285","11.6622","0.0009","14.0738","0.0011","15.6906","0.001","82.472","0.006","84.831","0.006","75.009","0.007","2462","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1,1',6,6'-Tetrahydroxy-5,5'-diisopropyl-8,8'-bis{[(4-methoxyphenyl)iminiumyl]methyl}-3,3'-dimethyl-2,2'-binaphthalene-7,7'-diolate","","- C44 H44 N2 O8 -","- C44 H44 N2 O8 -","- C88 H88 N4 O16 -","2","1","HB7516","Honkeldieva, Muhabbat T.; Talipov, Samat A.; Kunafiev, Rishad; Ibragimov, Bakhtiyar T.","Crystal structure of bis-p-anizidinegossypol with an unknown solvate","Acta Crystallographica Section E Crystallographic Communications","2015","71","12","1421","","10.1107/S2056989015020393","","","1.54184","CuKα","","0.1381","0.0507","","","0.1081","0.1243","","","","","","0.649","","","","has coordinates,has Fobs","170174","2020-10-21","18:00:00",""
"2020308","15.1305","0.0007","14.2921","0.0006","11.6939","0.0005","90","","117.37","0.002","90","","2245.69","0.17","100","","100","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylguanidinium [(chloridocadmate)-di-μ-chlorido]]","","- C5 H14 Cd Cl3 N3 -","- C5 H14 Cd Cl3 N3 -","- C40 H112 Cd8 Cl24 N24 -","8","1","WM5207","Ndiaye, Mamadou; Samb, Abdoulaye; Diop, Libasse; Maris, Thierry","Crystal structure of <i>catena</i>-poly[<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylguanidinium [(chloridocadmate)-di-μ-chlorido]]","Acta Crystallographica Section E","2016","72","1","1","3","10.1107/S2056989015020836","","","1.34139","GaKα","","0.0165","0.0164","","","0.0396","0.0397","","","","","","1.129","","","","has coordinates,has Fobs","176644","2020-10-21","18:00:00",""
"2020316","7.827","0.003","15.534","0.005","15.886","0.006","88.82","0.02","89.093","0.018","77.266","0.018","1883.5","1.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","pyrazoxyfen","2-{[4-(2,4-Dichlorobenzoyl)-1,3-dimethyl-1<i>H</i>-pyrazol-5-yl]oxy}-1-phenylethan-1-one","","- C20 H16 Cl2 N2 O3 -","- C20 H16 Cl2 N2 O3 -","- C80 H64 Cl8 N8 O12 -","4","2","HG5466","Kwon, Eunjin; Kim, Jineun; Kang, Gihaeng; Kim, Tae Ho","Crystal structure of pyrazoxyfen","Acta Crystallographica Section E Crystallographic Communications","2015","71","12","o1033","","10.1107/S2056989015023233","","","0.71073","MoKα","","0.099","0.0486","","","0.0949","0.1087","","","","","","0.989","","","","has coordinates,has Fobs","171470","2020-10-21","18:00:00",""
"2020387","12.0962","0.0003","7.87839","0.00017","20.4041","0.0004","90","","94.829","0.002","90","","1937.58","0.07","294","","294","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aqua(nitrato-κ<i>O</i>)dioxido{2-[3-(pyridin-2-yl-κ<i>N</i>)-1<i>H</i>-1,2,4-triazol-5-yl-κ<i>N</i>^4^]phenolato-κ<i>O</i>}uranium(VI) acetonitrile monosolvate monohydrate","","- C15 H16 N6 O8 U -","- C15 H16 N6 O8 U -","- C60 H64 N24 O32 U4 -","4","1","","Vashchenko, Oleksandr; Raspertova, Ilona; Dyakonenko, Viktoriya; Shishkina, Svitlana; Khomenko, Dmytro; Doroschuk, Roman; Lampeka, Rostislav","Crystal structure of aqua(nitrato-κ<i>O</i>)dioxido{2-[3-(pyridin-2-yl-κ<i>N</i>)-1<i>H</i>-1,2,4-triazol-5-yl-κ<i>N</i>^4^]phenolato-κ<i>O</i>}uranium(VI) acetonitrile monosolvate monohydrate","Acta Crystallographica Section E","2016","72","2","111","113","10.1107/S205698901502438X","","","0.71073","MoKα","","0.0353","0.0287","","","0.0611","0.0635","","","","","","1.045","","","","has coordinates,has Fobs","177479","2020-10-21","18:00:00",""
"2020412","6.5063","0.0002","10.5966","0.0003","13.2066","0.0004","105.951","0.001","92.065","0.001","96.55","0.001","867.59","0.05","100","","100","","","","","","","","","5","P -1","-P 1","2","","Bis(1,4-diazabicyclo[2.2.2]octan-1-ium) thiosulfate dihydrate","","- C12 H30 N4 O5 S2 -","- C12 H30 N4 O5 S2 -","- C24 H60 N8 O10 S4 -","2","1","WM5264","Seck, Gorgui Awa; Sene, Aboubacary; Diop, Libasse; Maris, Thierry","Crystal structure of bis(1,4-diazabicyclo[2.2.2]octan-1-ium) thiosulfate dihydrate","Acta Crystallographica Section E","2016","72","3","273","275","10.1107/S2056989016001535","","","1.34139","GaKα","","0.03","0.0294","","","0.0783","0.0791","","","","","","1.066","","","","has coordinates,has Fobs","181476","2020-10-21","18:00:00",""
"2020428","21.4036","0.0008","5.7673","0.0002","19.5525","0.0007","90","","92.135","0.001","90","","2411.9","0.15","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","<i>N</i>-(3-Fluorobenzoyl)benzenesulfonamide","","- C13 H10 F N O3 S -","- C13 H10 F N O3 S -","- C104 H80 F8 N8 O24 S8 -","8","1","HB7565","Suchetan, P. A.; Naveen, S.; Lokanath, N. K.; Lakshmikantha, H. N.; Srivishnu, K. S.; Supriya, G. M.","Crystal structures of <i>N</i>-(3-fluorobenzoyl)benzenesulfonamide and <i>N</i>-(3-fluorobenzoyl)-4-methylbenzenesulfonamide","Acta Crystallographica Section E","2016","72","4","428","431","10.1107/S2056989016003248","","","1.54178","CuKα","","0.044","0.0419","","","0.1289","0.1332","","","","","","0.98","","","","has coordinates,has Fobs","182547","2020-10-21","18:00:00",""
"2020429","9.0376","0.0004","12.2912","0.0005","12.1377","0.0005","90","","105.107","0.002","90","","1301.7","0.1","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(3-Fluorobenzoyl)-4-methylbenzenesulfonamide","","- C14 H12 F N O3 S -","- C14 H12 F N O3 S -","- C56 H48 F4 N4 O12 S4 -","4","1","HB7565","Suchetan, P. A.; Naveen, S.; Lokanath, N. K.; Lakshmikantha, H. N.; Srivishnu, K. S.; Supriya, G. M.","Crystal structures of <i>N</i>-(3-fluorobenzoyl)benzenesulfonamide and <i>N</i>-(3-fluorobenzoyl)-4-methylbenzenesulfonamide","Acta Crystallographica Section E","2016","72","4","428","431","10.1107/S2056989016003248","","","1.54178","CuKα","","0.0575","0.0499","","","0.1459","0.1517","","","","","","1.052","","","","has coordinates,has Fobs","182547","2020-10-21","18:00:00",""
"2020453","14.9328","0.0002","6.01143","0.0001","33.9985","0.0007","90","","102.601","0.0017","90","","2978.45","0.09","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(<i>S</i>)-(+)-2-{[(1-Phenylethyl)imino]methyl}naphthalene","","- C19 H17 N -","- C19 H17 N -","- C152 H136 N8 -","8","4","HB7571","Hernández-Téllez, Guadalupe; Moreno, Gloria E.; Bernès, Sylvain; Mendoza, Angel; Portillo, Oscar; Sharma, Pankaj; Gutiérrez, René","Crystal structures of ten enantiopure Schiff bases bearing a naphthyl group","Acta Crystallographica Section E Crystallographic Communications","2016","72","4","583","","10.1107/S2056989016004692","","","1.54184","CuKα","","0.0543","0.0392","","","0.0829","0.092","","","","","","1.036","","","","has coordinates,has Fobs","180667","2020-10-21","18:00:00",""
"2020454","6.0946","0.0005","7.5732","0.0005","34.046","0.003","90","","90","","90","","1571.4","0.2","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(<i>S</i>)-(+)-2-({[(4-Methylphenyl)ethyl]imino}methyl)naphthalene","","- C20 H19 N -","- C20 H19 N -","- C80 H76 N4 -","4","1","HB7571","Hernández-Téllez, Guadalupe; Moreno, Gloria E.; Bernès, Sylvain; Mendoza, Angel; Portillo, Oscar; Sharma, Pankaj; Gutiérrez, René","Crystal structures of ten enantiopure Schiff bases bearing a naphthyl group","Acta Crystallographica Section E Crystallographic Communications","2016","72","4","583","","10.1107/S2056989016004692","","","1.54184","CuKα","","0.068","0.0443","","","0.1002","0.1117","","","","","","1.076","","","","has coordinates,has Fobs","180667","2020-10-21","18:00:00",""
"2020455","6.1094","0.0005","7.7266","0.0007","34.225","0.004","90","","90","","90","","1615.6","0.3","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(<i>R</i>)-(‒)-2-({[(4-Methoxylphenyl)ethyl]imino}methyl)naphthalene","","- C20 H19 N O -","- C20 H19 N O -","- C80 H76 N4 O4 -","4","1","HB7571","Hernández-Téllez, Guadalupe; Moreno, Gloria E.; Bernès, Sylvain; Mendoza, Angel; Portillo, Oscar; Sharma, Pankaj; Gutiérrez, René","Crystal structures of ten enantiopure Schiff bases bearing a naphthyl group","Acta Crystallographica Section E Crystallographic Communications","2016","72","4","583","","10.1107/S2056989016004692","","","1.54184","CuKα","","0.132","0.0628","","","0.1222","0.1546","","","","","","1.081","","","","has coordinates,has Fobs","180667","2020-10-21","18:00:00",""
"2020456","7.595","0.0011","5.8997","0.0009","16.996","0.003","90","","99.42","0.015","90","","751.3","0.2","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(<i>R</i>)-(‒)-2-({[(4-Fluorophenyl)ethyl]imino}methyl)naphthalene","","- C19 H16 F N -","- C19 H16 F N -","- C38 H32 F2 N2 -","2","1","HB7571","Hernández-Téllez, Guadalupe; Moreno, Gloria E.; Bernès, Sylvain; Mendoza, Angel; Portillo, Oscar; Sharma, Pankaj; Gutiérrez, René","Crystal structures of ten enantiopure Schiff bases bearing a naphthyl group","Acta Crystallographica Section E Crystallographic Communications","2016","72","4","583","","10.1107/S2056989016004692","","","0.71073","MoKα","","0.1136","0.0655","","","0.1352","0.153","","","","","","1.252","","","","has coordinates,has Fobs","180667","2020-10-21","18:00:00",""
"2020457","6.0567","0.0005","7.6139","0.0005","33.853","0.003","90","","90","","90","","1561.1","0.2","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(<i>S</i>)-(+)-2-({[(4-Chlorophenyl)ethyl]imino}methyl)naphthalene","","- C19 H16 Cl N -","- C19 H16 Cl N -","- C76 H64 Cl4 N4 -","4","1","HB7571","Hernández-Téllez, Guadalupe; Moreno, Gloria E.; Bernès, Sylvain; Mendoza, Angel; Portillo, Oscar; Sharma, Pankaj; Gutiérrez, René","Crystal structures of ten enantiopure Schiff bases bearing a naphthyl group","Acta Crystallographica Section E Crystallographic Communications","2016","72","4","583","","10.1107/S2056989016004692","","","0.71073","MoKα","","0.0811","0.0567","","","0.1246","0.1386","","","","","","1.068","","","","has coordinates,has Fobs","180667","2020-10-21","18:00:00",""
"2020458","6.0526","0.0002","7.6671","0.0004","33.9712","0.0019","90","","90","","90","","1576.46","0.13","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(<i>S</i>)-(+)-2-({[(4-Bromophenyl)ethyl]imino}methyl)naphthalene","","- C19 H16 Br N -","- C19 H16 Br N -","- C76 H64 Br4 N4 -","4","1","HB7571","Hernández-Téllez, Guadalupe; Moreno, Gloria E.; Bernès, Sylvain; Mendoza, Angel; Portillo, Oscar; Sharma, Pankaj; Gutiérrez, René","Crystal structures of ten enantiopure Schiff bases bearing a naphthyl group","Acta Crystallographica Section E Crystallographic Communications","2016","72","4","583","","10.1107/S2056989016004692","","","0.71073","MoKα","","0.0837","0.044","","","0.0832","0.0979","","","","","","1.02","","","","has coordinates,has Fobs","180667","2020-10-21","18:00:00",""
"2020459","7.8555","0.0005","7.8724","0.0004","14.0494","0.0009","90","","99.859","0.006","90","","856.01","0.09","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(<i>S</i>)-(+)-2-({[1-(Naphthalen-1-yl)ethyl]imino}methyl)naphthalene","","- C23 H19 N -","- C23 H19 N -","- C46 H38 N2 -","2","1","HB7571","Hernández-Téllez, Guadalupe; Moreno, Gloria E.; Bernès, Sylvain; Mendoza, Angel; Portillo, Oscar; Sharma, Pankaj; Gutiérrez, René","Crystal structures of ten enantiopure Schiff bases bearing a naphthyl group","Acta Crystallographica Section E Crystallographic Communications","2016","72","4","583","","10.1107/S2056989016004692","","","0.71073","MoKα","","0.098","0.0481","","","0.0958","0.1185","","","","","","1.013","","","","has coordinates,has Fobs","180667","2020-10-21","18:00:00",""
"2020460","15.406","0.003","5.9722","0.0007","36.002","0.007","90","","102.058","0.018","90","","3239.4","1","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(<i>S</i>)-(+)-2-{[(1-Cyclohexylethyl)imino]methyl}naphthalene","","- C19 H23 N -","- C19 H23 N -","- C152 H184 N8 -","8","4","HB7571","Hernández-Téllez, Guadalupe; Moreno, Gloria E.; Bernès, Sylvain; Mendoza, Angel; Portillo, Oscar; Sharma, Pankaj; Gutiérrez, René","Crystal structures of ten enantiopure Schiff bases bearing a naphthyl group","Acta Crystallographica Section E Crystallographic Communications","2016","72","4","583","","10.1107/S2056989016004692","","","0.71073","MoKα","","0.1929","0.0782","","","0.1573","0.2306","","","","","","0.993","","","","has coordinates,has Fobs","180667","2020-10-21","18:00:00",""
"2020461","7.7571","0.0013","5.9246","0.001","17.82","0.004","90","","92.682","0.016","90","","818.1","0.3","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(<i>S</i>)-(‒)-2-{[(1,2,3,4-Tetrahydronaphthalen-1-yl)imino]methyl}naphthalene","","- C21 H19 N -","- C21 H19 N -","- C42 H38 N2 -","2","1","HB7571","Hernández-Téllez, Guadalupe; Moreno, Gloria E.; Bernès, Sylvain; Mendoza, Angel; Portillo, Oscar; Sharma, Pankaj; Gutiérrez, René","Crystal structures of ten enantiopure Schiff bases bearing a naphthyl group","Acta Crystallographica Section E Crystallographic Communications","2016","72","4","583","","10.1107/S2056989016004692","","","0.7107","MoKα","","0.108","0.0691","","","0.1566","0.1751","","","","","","1.442","","","","has coordinates,has Fobs","180667","2020-10-21","18:00:00",""
"2020462","6.32427","0.00018","14.4559","0.0003","18.5421","0.0005","90","","90","","90","","1695.17","0.08","150","1","150","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(+)-2-({[(1<i>S</i>,2<i>S</i>,3<i>S</i>,5<i>R</i>)-2,6,6-Trimethylbicyclo[3.1.1]hept-3-yl]imino}methyl}naphthalene","","- C21 H25 N -","- C21 H25 N -","- C84 H100 N4 -","4","1","HB7571","Hernández-Téllez, Guadalupe; Moreno, Gloria E.; Bernès, Sylvain; Mendoza, Angel; Portillo, Oscar; Sharma, Pankaj; Gutiérrez, René","Crystal structures of ten enantiopure Schiff bases bearing a naphthyl group","Acta Crystallographica Section E Crystallographic Communications","2016","72","4","583","","10.1107/S2056989016004692","","","1.54184","CuKα","","0.0526","0.0407","","","0.0956","0.1032","","","","","","1.034","","","","has coordinates,has Fobs","180667","2020-10-21","18:00:00",""
"2020463","6.307","0.0007","14.9614","0.0018","8.9198","0.0011","90","","93.457","0.001","90","","840.15","0.17","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Amino-4-hydroxy-6-oxocyclohexa-2,4-dien-1-iminium chloride monohydrate","","- C6 H9 Cl N2 O3 -","- C6 H9 Cl N2 O3 -","- C24 H36 Cl4 N8 O12 -","4","1","SJ5497","Plater, M. John; Harrison, William T. A.","A purple odyssey: synthesis and structure of 3-amino-4-hydroxy-6-oxocyclohexa-2,4-dien-1-iminium chloride monohydrate","Acta Crystallographica Section E","2016","72","5","604","607","10.1107/S2056989016005107","","","0.71073","MoKα","","0.082","0.0721","","","0.1546","0.1586","","","","","","1.222","","","","has coordinates,has Fobs","183646","2020-10-21","18:00:00",""
"2020500","9.3079","0.0017","9.4339","0.0017","15.195","0.003","90","","107.835","0.002","90","","1270.1","0.4","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-Methyl-1<i>H</i>imidazol-3-ium picrate","4-Methyl-1<i>H</i>-imidazol-3-ium 2,4,6-trinitrophenolate","","- C10 H9 N5 O7 -","- C10 H9 N5 O7 -","- C40 H36 N20 O28 -","4","1","LH5809","Song, Xue-gang; Su, Ping; Xu, Xing-man","Hydrogen-bonded network in the salt 4-methyl-1H-imidazol-3-ium picrate","Acta Crystallographica Section E Crystallographic Communications","2016","72","6","772","","10.1107/S205698901600712X","","","0.71073","MoKα","","0.0866","0.0524","","","0.1022","0.1103","","","","","","1.035","","","","has coordinates,has Fobs","182568","2020-10-21","18:00:00",""
"2020523","12.8263","0.0009","7.1879","0.0003","12.2478","0.0009","90","","98.936","0.006","90","","1115.47","0.12","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Di-μ-thiocyanato-bis[diamminesilver(I)]","","- C2 H12 Ag2 N6 S2 -","- C2 H12 Ag2 N6 S2 -","- C8 H48 Ag8 N24 S8 -","4","0.5","WM5294","Müller, Thomas G.; Kraus, Florian","Crystal structure of Ag~2~(μ-SCN)~2~(NH~3~)~4~","Acta Crystallographica Section E","2016","72","7","881","883","10.1107/S2056989016008823","","","0.71073","MoKα","","0.0315","0.0289","","","0.0598","0.061","","","","","","1.107","","","","has coordinates,has Fobs","185024","2020-10-21","18:00:00",""
"2020548","12.7038","0.0001","16.5265","0.0002","16.683","0.0002","90","","109.774","0.001","90","","3296.05","0.07","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Diaquahexakis(μ-4-chloropyrazolato-κ^2^<i>N</i>:<i>N</i>')bis(<i>N</i>,<i>N</i>-dimethylformamide)di-μ~3~-hydroxido-bis(μ~4~-sulfato-κ^4^<i>O</i>:<i>O</i>':<i>O</i>'':<i>O</i>'')hexacopper(II) <i>N</i>,<i>N</i>-dimethylformamide tetrasolvate dihydrate","","- C36 H64 Cl6 Cu6 N18 O20 S2 -","- C36 H64 Cl6 Cu6 N18 O20 S2 -","- C72 H128 Cl12 Cu12 N36 O40 S4 -","2","0.5","GK2663","Mezei, Gellert","Sulfate-bridged dimeric trinuclear copper(II)‒pyrazolate complex with three different terminal ligands","Acta Crystallographica Section E Crystallographic Communications","2016","72","8","1064","","10.1107/S2056989016010719","","","0.71073","MoKα","","0.0595","0.0351","","","0.0672","0.0751","","","","","","1.014","","","","has coordinates,has Fobs","184289","2020-10-21","18:00:00",""
"2020595","16.6906","0.0014","9.1942","0.0008","21.0159","0.0017","90","","95.501","0.002","90","","3210.2","0.5","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[[[dichloridomercury(II)]-μ-<i>N</i>- (pyridin-4-ylmethyl)pyridin-3-amine-κ^2^<i>N</i>:<i>N</i>'] chloroform hemisolvate]","","- C11.5 H11.5 Cl3.5 Hg N3 -","- C11.5 H11.5 Cl3.5 Hg N3 -","- C92 H92 Cl28 Hg8 N24 -","8","1","","Moon, Suk-Hee; Kang, Donghyun; Park, Ki-Min","Crystal structure of an Hg^II^ coordination polymer with an unsymmetrical dipyridyl ligand: <i>catena</i>-poly[[[dichloridomercury(II)]-μ-<i>N</i>-(pyridin-4-ylmethyl)pyridin-3-amine-κ^2^<i>N</i>:<i>N</i>'] chloroform hemisolvate]","Acta Crystallographica Section E","2016","72","11","1513","1516","10.1107/S2056989016015310","","","0.71073","MoKα","","0.0626","0.0328","","","0.0658","0.0735","","","","","","0.987","","","","has coordinates,has disorder,has Fobs","188958","2020-10-21","18:00:00",""
"2020650","7.3989","0.0005","24.491","0.0017","7.7126","0.0005","90","","96.022","0.002","90","","1389.86","0.16","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-<i>N</i>-Methyl-<i>N</i>'-(2-nitrobenzylidene)-2-(thiophen-2-yl)acetohydrazide","","- C14 H13 N3 O3 S -","- C14 H13 N3 O3 S -","- C56 H52 N12 O12 S4 -","4","1","HG5478","Cardoso, Laura N. F.; Noguiera, Thais C. M.; Kaiser, Carlos R.; Wardell, James L.; de Souza, Marcus V. N.; Lancaster, Shaun T.; Harrison, William T. A.","Different weak interactions in the crystals of three isomeric (<i>E</i>)-<i>N</i>-methyl-<i>N</i>'-(nitrobenzylidene)-2-(thiophen-2-yl)acetohydrazides","Acta Crystallographica Section E","2016","72","12","1677","1682","10.1107/S2056989016016856","","","0.71073","MoKα","","0.0569","0.0406","","","0.0987","0.1056","","","","","","1.052","","","","has coordinates,has disorder,has Fobs","189974","2020-10-21","18:00:00",""
"2020651","5.6629","0.0004","15.6864","0.0011","15.2842","0.0011","90","","93.38","0.0018","90","","1355.34","0.17","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(<i>E</i>)-<i>N</i>-Methyl-<i>N</i>'-(3-nitrobenzylidene)-2-(thiophen-2-yl)acetohydrazide","","- C14 H13 N3 O3 S -","- C14 H13 N3 O3 S -","- C56 H52 N12 O12 S4 -","4","1","HG5478","Cardoso, Laura N. F.; Noguiera, Thais C. M.; Kaiser, Carlos R.; Wardell, James L.; de Souza, Marcus V. N.; Lancaster, Shaun T.; Harrison, William T. A.","Different weak interactions in the crystals of three isomeric (<i>E</i>)-<i>N</i>-methyl-<i>N</i>'-(nitrobenzylidene)-2-(thiophen-2-yl)acetohydrazides","Acta Crystallographica Section E","2016","72","12","1677","1682","10.1107/S2056989016016856","","","0.71073","MoKα","","0.0374","0.0335","","","0.0931","0.0955","","","","","","1.08","","","","has coordinates,has Fobs","189974","2020-10-21","18:00:00",""
"2020652","6.1893","0.0004","12.9177","0.0009","17.3828","0.0012","93.995","0.007","90.386","0.006","95.963","0.007","1378.77","0.16","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","(<i>E</i>)-<i>N</i>-Methyl-<i>N</i>'-(4-nitrobenzylidene)-2-(thiophen-2-yl)acetohydrazide","","- C14 H13 N3 O3 S -","- C14 H13 N3 O3 S -","- C56 H52 N12 O12 S4 -","4","2","HG5478","Cardoso, Laura N. F.; Noguiera, Thais C. M.; Kaiser, Carlos R.; Wardell, James L.; de Souza, Marcus V. N.; Lancaster, Shaun T.; Harrison, William T. A.","Different weak interactions in the crystals of three isomeric (<i>E</i>)-<i>N</i>-methyl-<i>N</i>'-(nitrobenzylidene)-2-(thiophen-2-yl)acetohydrazides","Acta Crystallographica Section E","2016","72","12","1677","1682","10.1107/S2056989016016856","","","0.71073","MoKα","","0.0724","0.0575","","","0.1517","0.1657","","","","","","1.099","","","","has coordinates,has disorder,has Fobs","189974","2020-10-21","18:00:00",""
"2020683","9.6931","0.0019","15.699","0.003","14.614","0.003","90","","108.99","0.03","90","","2102.8","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(7-Dibromomethyl-5-methyl-1,8-naphthyridin-2-yl)benzamide‒pyrrolidine-2,5-dione (1/1)","","- C21 H18 Br2 N4 O3 -","- C21 H18 Br2 N4 O3 -","- C84 H72 Br8 N16 O12 -","4","1","WM5334","Wang, Bang Zhong; Zhou, Jun Ping; Zhou, Yong; Luo, Jian Song; Yang, Jun Jie; Chi, Shao M.ing","Crystal structure of <i>N</i>-(7-dibromomethyl-5-methyl-1,8-naphthyridin-2-yl)benzamide‒pyrrolidine-2,5-dione (1/1)","Acta Crystallographica Section E","2017","73","1","1","3","10.1107/S2056989016019034","","","0.71073","MoKα","","0.1538","0.0616","","","0.1193","0.1477","","","","","","0.978","","","","has coordinates,has Fobs","191425","2020-10-21","18:00:00",""
"2020703","18.7651","0.001","6.9193","0.0004","17.259","0.001","90","","90","","90","","2240.9","0.2","296","2","296","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","(<i>E</i>)-2,6-Di-<i>tert</i>-butyl-4-{[2-(2,4-dinitrophenyl)hydrazinylidene]methyl}phenol","","- C21 H26 N4 O5 -","- C21 H26 N4 O5 -","- C84 H104 N16 O20 -","4","0.5","","Faizi, Md. Serajul Haque; Dege, Necmi; Haque, Ashanul; Kalibabchuk, Valentina A.; Cemberci, Mustafa","Crystal structure of (E)-2,6-di-tert-butyl-4-{[2-(2,4-dinitrophenyl)hydrazinylidene]methyl}phenol","Acta Crystallographica Section E Crystallographic Communications","2017","73","2","96","","10.1107/S2056989016020107","","","0.71073","MoKα","","0.1842","0.0712","","","0.1633","0.2146","","","","","","0.963","","","","has coordinates,has Fobs","189993","2020-10-21","18:00:00",""
"2020739","8.5376","0.0004","15.22","0.001","12.1214","0.0006","90","","96.195","0.006","90","","1565.88","0.15","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Diaquabis(4-cyanopyridine-κ<i>N</i>)bis(thiocyanato-κ<i>N</i>)iron(II) 4-cyanopyridine disolvate","","- C26 H20 Fe N10 O2 S2 -","- C26 H20 Fe N10 O2 S2 -","- C52 H40 Fe2 N20 O4 S4 -","2","0.5","WM5371","Jochim, Aleksej; Jess, Inke; Näther, Christian","Crystal structure of diaquabis(4-cyanopyridine-κN)bis(thiocyanato-κN)iron(II) 4-cyanopyridine disolvate","Acta Crystallographica Section E Crystallographic Communications","2017","73","4","463","","10.1107/S205698901700322X","","","0.71073","MoKα","","0.0511","0.0373","","","0.088","0.0936","","","","","","1.034","","","","has coordinates,has Fobs","194089","2020-10-21","18:00:00",""
"2020828","4.3677","0.0006","14.0232","0.0012","15.1816","0.0018","90","","96.153","0.016","90","","924.5","0.19","153","2","153","2","","","","","","","","4","P 1 c 1","P -2yc","7","","<i>N</i>^2^,<i>N</i>^3^-Bis(pyridin-4-ylmethyl)pyrazine-2,3-dicarboxamide","","- C18 H20 N6 O4 -","- C18 H20 N6 O4 -","- C36 H40 N12 O8 -","2","1","","Cati, Dilovan S.; Stoeckli-Evans, Helen","Crystal structure of a pyrazine-2,3-dicarboxamide ligand and of its silver(I) nitrate complex, a three-dimensional coordination polymer","Acta Crystallographica Section E Crystallographic Communications","2017","73","6","798","","10.1107/S2056989017006387","","","0.71073","MoKα","","0.1135","0.0506","","","0.1076","0.1224","","","","","","0.767","","","","has coordinates,has Fobs","199112","2020-10-21","18:00:00",""
"2020829","14.9776","0.0016","17.3228","0.0012","29.57","0.004","90","","90","","90","","7672.1","1.4","153","2","153","2","","","","","","","","5","F d d d","-F 2uv 2vw","70","","Poly[[[μ~4~-<i>N</i>^2^,<i>N</i>^3^-bis(pyridin-4-ylmethyl)pyrazine-2,3-dicarboxamide]silver(I)] nitrate]","","- C18 H16 Ag N7 O5 -","- C18 H16 Ag N7 O5 -","- C288 H256 Ag16 N112 O80 -","16","","","Cati, Dilovan S.; Stoeckli-Evans, Helen","Crystal structure of a pyrazine-2,3-dicarboxamide ligand and of its silver(I) nitrate complex, a three-dimensional coordination polymer","Acta Crystallographica Section E Crystallographic Communications","2017","73","6","798","","10.1107/S2056989017006387","","","0.71073","MoKα","","0.089","0.0454","","","0.0977","0.1069","","","","","","0.903","","","","has coordinates,has disorder,has Fobs","199112","2020-10-21","18:00:00",""
"2020830","8.0209","0.0003","14.5364","0.0005","25.0008","0.0008","90","","98.499","0.001","90","","2882.96","0.17","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","4-Bromo-<i>N</i>-[(2-nitrophenyl)sulfonyl]benzamide","","- C13 H9 Br N2 O5 S -","- C13 H9 Br N2 O5 S -","- C104 H72 Br8 N16 O40 S8 -","8","2","","Naveen, S.; Sudha, A. G.; Suresha, E.; Lokanath, N. K.; Suchetan, P. A.; Abdoh, M.","Crystal structures of isomeric 4-bromo-N-[(2-nitrophenyl)sulfonyl]benzamide and 4-bromo-N-[(4-nitrophenyl)sulfonyl]benzamide","Acta Crystallographica Section E Crystallographic Communications","2017","73","3","314","","10.1107/S2056989017001578","","","1.54178","CuKα","","0.0498","0.0488","","","0.1376","0.1389","","","","","","1.106","","","","has coordinates,has disorder,has Fobs","199121","2020-10-21","18:00:00",""
"2020831","9.6085","0.0004","10.3246","0.0005","27.7296","0.0013","90","","90","","90","","2750.9","0.2","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","4-Bromo-<i>N</i>-[(4-nitrophenyl)sulfonyl]benzamide","","- C13 H9 Br N2 O5 S -","- C13 H9 Br N2 O5 S -","- C104 H72 Br8 N16 O40 S8 -","8","1","","Naveen, S.; Sudha, A. G.; Suresha, E.; Lokanath, N. K.; Suchetan, P. A.; Abdoh, M.","Crystal structures of isomeric 4-bromo-N-[(2-nitrophenyl)sulfonyl]benzamide and 4-bromo-N-[(4-nitrophenyl)sulfonyl]benzamide","Acta Crystallographica Section E Crystallographic Communications","2017","73","3","314","","10.1107/S2056989017001578","","","1.54178","CuKα","","0.0504","0.0499","","","0.1374","0.138","","","","","","1.124","","","","has coordinates,has Fobs","199121","2020-10-21","18:00:00",""
"2020839","5.9124","0.0002","17.6155","0.0005","20.3351","0.0006","90","","96.563","0.003","90","","2104.02","0.11","295","2","295","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[(1-{4-[2-(2,4-Dihydroxyphenyl)diazen-1-yl]phenyl}ethylidene)amino]thiourea 1,1,2,2-tetrachloroethane monosolvate","","- C17 H17 Cl4 N5 O2 S -","- C17 H17 Cl4 N5 O2 S -","- C68 H68 Cl16 N20 O8 S4 -","4","1","HB7686","Riyadh, Sayed; Hughes, David L.; Said, Musa A.","Crystal structure of a 1,1,2,2-tetrachloroethane-solvated hydrazinecarbothioamide compound","Acta Crystallographica Section E Crystallographic Communications","2017","73","9","1271","","10.1107/S2056989017010830","","","0.71073","Mo-Kα","","0.0865","0.0764","","","0.1967","0.2035","","","","","","1.087","","","","has coordinates,has Fobs","199460","2020-10-21","18:00:00",""
"2020877","7.3257","0.0015","9.0188","0.0018","15.578","0.003","81.7","0.03","77.64","0.03","68.9","0.03","935.4","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Poly[bis{μ~2~-4,4'-bis[(1,2,4-triazol-1-yl)methyl]biphenyl-κ^2^<i>N</i>^4^:<i>N</i>^4'^}bis(nitrato-κ<i>O</i>)zinc(II)]","","- C36 H32 N14 O6 Zn -","- C36 H32 N14 O6 Zn -","- C36 H32 N14 O6 Zn -","1","0.5","VN2130","Liu, Fuhong; Ding, Yan; Li, Qiuyu; Zhang, Liping","A two-dimensional Zn coordination polymer with a three-dimensional supramolecular architecture","Acta Crystallographica Section E Crystallographic Communications","2017","73","10","1402","","10.1107/S2056989017012452","","","0.71073","MoKα","","0.0664","0.0509","","","0.1295","0.1434","","","","","","1.046","","","","has coordinates,has disorder,has Fobs","200207","2020-10-21","18:00:00",""
"2020896","7.7103","0.0007","12.7416","0.0011","14.2187","0.0012","75.1572","0.0011","77.8324","0.0011","73.4904","0.0011","1280.16","0.19","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","Tribenzylbis(tetrahydrofuran-κ<i>O</i>)lutetium(III)","","- C29 H37 Lu O2 -","- C29 H37 Lu O2 -","- C58 H74 Lu2 O4 -","2","1","","Saliu, Kuburat O.; Takats, Josef; McDonald, Robert","Crystal structure of tribenzylbis(tetrahydrofuran-κO)lutetium(III)","Acta Crystallographica Section E Crystallographic Communications","2018","74","2","88","","10.1107/S2056989017018254","","","0.71073","MoKα","","0.025","0.0213","","","0.0494","0.0506","","","","","","1.071","","","","has coordinates,has Fobs","205167","2020-10-21","18:00:00",""
"2020997","7.3991","0.0015","10.637","0.002","11.931","0.002","93.65","0.03","107.37","0.03","108.11","0.03","839","0.4","293","2","293","2","","","","","","","","4","P 1","P 1","1","","8-(4-Methylphenyl)-2'-deoxyadenosine hemihydrate","","- C17 H20 N5 O3.5 -","- C17 H20 N5 O3.5 -","- C34 H40 N10 O7 -","2","2","ZP2024","Ardhapure, Ajaykumar V.; Sanghvi, Yogesh S.; Borozdina, Yulia; Kapdi, Anant Ramakant; Schulzke, Carola","Crystal structure of 8-(4-methylphenyl)-2'-deoxyadenosine hemihydrate","Acta Crystallographica Section E","2018","74","1","1","5","10.1107/S2056989017017212","","","0.71073","MoKα","","0.0673","0.0413","","","0.095","0.1098","","","","","","0.996","","","","has coordinates,has Fobs","218075","2020-10-21","18:00:00",""
"2021001","4.7089","0.0002","9.676","0.0004","12.1952","0.0005","93.387","0.003","92.165","0.002","103.18","0.002","539.32","0.04","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","<i>N</i>,<i>N</i>'-dibenzyl-3,3'-dimethoxy-1,1'-biphenyl-4,4'-diamine","","- C28 H28 N2 O2 -","- C28 H28 N2 O2 -","- C28 H28 N2 O2 -","1","0.5","","Im, Hansu; Kim, Jineun; Sim, Changeun; Kim, Tae Ho","Crystal structure of N,N′-dibenzyl-3,3′-dimethoxybenzidine","Acta Crystallographica Section E Crystallographic Communications","2018","74","3","271","","10.1107/S2056989018001688","","","0.71073","MoKα","","0.0526","0.0483","","","0.1414","0.1451","","","","","","1.095","","","","has coordinates,has disorder,has Fobs","206075","2020-10-21","18:00:00",""
"2021116","8.425","0.001","8.425","0.001","54.749","0.011","90","","90","","120","","3365.5","0.9","293","2","293","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","rubidium iron bis(hydrogen arsenate)","Rubidium iron bis[hydrogen arsenate(V)]","","- As2 Fe H2 O8 Rb -","- As2 Fe H2 O8 Rb -","- As36 Fe18 H36 O144 Rb18 -","18","0.5","PJ2051","Schwendtner, Karolina; Kolitsch, Uwe","RbFe(HAsO4)2 and TlFe(HAsO4)2, two new hydrogenarsenates adopting two closely related structure types","Acta Crystallographica Section E Crystallographic Communications","2018","74","6","766","","10.1107/S2056989018006473","","","0.71073","MoKα","","0.0246","0.0206","","","0.0506","0.0519","","","","","","1.115","","","","has coordinates,has Fobs","207602","2020-10-21","18:00:00",""
"2021117","7.346","0.002","9.148","0.002","9.662","0.002","64.89","0.03","70.51","0.03","69.94","0.03","538.6","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","thallium iron bis(hydrogen arsenate)","Thallium iron bis[hydrogen arsenate(V)]","","- As2 Fe H2 O8 Tl -","- As2 Fe H2 O8 Tl0.999867 -","- As6 Fe3 H6 O24 Tl2.9996 -","3","1.5","","Schwendtner, Karolina; Kolitsch, Uwe","RbFe(HAsO4)2 and TlFe(HAsO4)2, two new hydrogenarsenates adopting two closely related structure types","Acta Crystallographica Section E Crystallographic Communications","2018","74","6","766","","10.1107/S2056989018006473","","","0.71073","MoKα","","0.0293","0.0224","","","0.0487","0.0508","","","","","","1.058","","","","has coordinates,has Fobs","207602","2020-10-21","18:00:00",""
"2021177","7.545","0.0015","23.19","0.005","8.337","0.0017","90","","103.32","0.03","90","","1419.5","0.5","220","2","220","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3,14-Dimethyl-2,6,13,17-tetraazoniatricyclo[16.4.0.0^7,12^]docosane tetrachloride tetrahydrate","","- C20 H52 Cl4 N4 O4 -","- C20 H52 Cl4 N4 O4 -","- C40 H104 Cl8 N8 O8 -","2","0.5","SJ5559","Moon, Dohyun; Choi, Jong-Ha","Crystal structure of 3,14-dimethyl-2,6,13,17-tetraazoniatricyclo[16.4.0.07,12]docosane tetrachloride tetrahydrate from synchrotron X-ray data","Acta Crystallographica Section E Crystallographic Communications","2018","74","8","1039","","10.1107/S2056989018009337","","","0.63","synchrotron","","0.048","0.0462","","","0.1397","0.1413","","","","","","1.139","","","","has coordinates,has Fobs","208940","2020-10-21","18:00:00",""
"2021207","8.944","0.002","10.797","0.003","20.52","0.005","90","","90","","90","","1981.6","0.9","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1,1'-Diformylruthenocene","","- C12 H10 O2 Ru -","- C12 H10 O2 Ru -","- C96 H80 O16 Ru8 -","8","2","ZP2025","Anzaldo, Bertin; Sharma, Pankaj; Lara Ochoa, Francisco; Villamizar C., Claudia P.; Gutiérrez Pérez, René","X-ray structure analysis of symmetrically substituted 1,1′-diformylruthenocene","Acta Crystallographica Section E Crystallographic Communications","2018","74","9","1186","","10.1107/S2056989018010642","","","0.71073","MoKα","","0.0668","0.0528","","","0.1111","0.1233","","","","","","1.025","","","","has coordinates,has Fobs","209711","2020-10-21","18:00:00",""
"2021225","7.3066","0.0006","11.5182","0.0009","20.2701","0.0017","90","","93.673","0.002","90","","1702.4","0.2","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Diethyl 2-[4-(4-fluorophenyl)-2-methyl-4-oxobutan-2-yl]malonate","Diethyl 2-[4-(4-fluorophenyl)-2-methyl-4-oxobutan-2-yl]propanedioate","","- C18 H23 F O5 -","- C18 H23 F O5 -","- C72 H92 F4 O20 -","4","1","YK2116","Chandrashekharappa, Sandeep; Bairagi, Keshab M.; Mohan, Mahendra K.; Venugopala, Katharigatta N.; Nayak, Susanta K.","Crystal structure and Hirshfeld surface analysis of diethyl 2-[4-(4-fluorophenyl)-2-methyl-4-oxobutan-2-yl]malonate","Acta Crystallographica Section E","2018","74","10","1388","1391","10.1107/S2056989018012094","","","0.71073","MoKα","","0.0706","0.0422","","","0.091","0.1043","","","","","","1.025","","","","has coordinates,has Fobs","211792","2020-10-21","18:00:00",""
"2021246","9.4036","0.0002","21.1588","0.0004","15.0319","0.0003","90","","102.221","0.002","90","","2923.1","0.1","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Dichloridobis{μ-2-methoxy-6-[(methylimino)methyl]phenolato}{2-methoxy-6-[(methylimino)methyl]phenolato}cadmium(II)cobalt(III) monohydrate","","- C27 H32 Cd Cl2 Co N3 O7 -","- C27 H32 Cd Cl2 Co N3 O7 -","- C108 H128 Cd4 Cl8 Co4 N12 O28 -","4","1","LH5882","Vassilyeva, Olga Yu.; Kasyanova, Katerina V.; Kokozay, Vladimir N.; Skelton, Brian W.","Crystal structure of dichloridobis{μ-2-methoxy-6-[(methylimino)methyl]phenolato}{2-methoxy-6-[(methylimino)methyl]phenolato}cadmium(II)cobalt(III) monohydrate","Acta Crystallographica Section E Crystallographic Communications","2018","74","11","1532","","10.1107/S2056989018013610","","x-ray","1.54178","CuKα","","0.0574","0.046","","","0.1095","0.1173","","","","","","1.02","","","","has coordinates,has Fobs","211296","2020-10-21","18:00:00",""
"2021414","8.2311","0.0001","13.322","0.0002","22.7038","0.0003","90","","95.864","0.002","90","","2476.55","0.06","100","0.1","100","0.1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,2'-Dithiodibenzoic acid‒benzoic acid (1/2)","","- C28 H22 O8 S2 -","- C28 H22 O8 S2 -","- C112 H88 O32 S8 -","4","0.5","HB7790","Tan, Sang Loon; Tiekink, Edward R. T.","A 1:2 co-crystal of 2,2′-dithiodibenzoic acid and benzoic acid: crystal structure, Hirshfeld surface analysis and computational study","Acta Crystallographica Section E Crystallographic Communications","2019","75","1","1","","10.1107/S2056989018017097","","x-ray","1.54184","CuKα","","0.0401","0.0392","","","0.1082","0.1091","","","","","","1.082","","","","has coordinates,has Fobs","212550","2020-10-21","18:00:00",""
"2021424","18.3264","0.0003","13.6459","0.0002","19.301","0.0004","90","","101.803","0.001","90","","4724.74","0.14","233","2","233","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Chloridocyanidohydrido(1,1,3,3,5,5,7,7-octaphenyl-1,3λ^5^,5λ^4^,7-tetraphospha-κ^2^<i>P</i>^1^,<i>P</i>^7^-hept-3-en-4-yl)iridium(III) acetonitrile monosolvate","","- C54 H48 Cl Ir N2 P4 -","- C54 H48 Cl Ir N2 P4 -","- C216 H192 Cl4 Ir4 N8 P16 -","4","1","SU5464","Partl, Gabriel Julian; Nussbaumer, Felix; Schuh, Walter; Kopacka, Holger; Wurst, Klaus; Peringer, Paul","Crystal structures of two PCN pincer iridium complexes and one PCP pincer carbodiphosphorane iridium intermediate: substitution of one phosphine moiety of a carbodiphosphorane by an organic azide","Acta Crystallographica Section E Crystallographic Communications","2019","75","1","75","","10.1107/S2056989018017644","","","0.71073","MoKα","","0.0671","0.0399","","","0.0643","0.069","","","","","","1.028","","","","has coordinates,has Fobs","212654","2020-10-21","18:00:00",""
"2021425","28.1283","0.0003","19.0989","0.0002","23.6339","0.0002","90","","90","","90","","12696.6","0.2","233","2","233","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","[7-(4-Chlorophenyl)-1,1,3,3-tetraphenyl-5,6,7-triaza-κ<i>N</i>^7^-1,3λ^4^-diphospha-κ<i>P</i>^1^-hepta-4,6-dien-4-yl][methylenebis(diphenylphosphine)-κ^2^<i>P</i>,<i>P</i>']iridium(I) chloride‒dichloromethane‒toluene (2/3/1)","","- C62 H55 Cl5 Ir N3 P4 -","- C62 H55 Cl5 Ir N3 P4 -","- C496 H440 Cl40 Ir8 N24 P32 -","8","1","SU5464","Partl, Gabriel Julian; Nussbaumer, Felix; Schuh, Walter; Kopacka, Holger; Wurst, Klaus; Peringer, Paul","Crystal structures of two PCN pincer iridium complexes and one PCP pincer carbodiphosphorane iridium intermediate: substitution of one phosphine moiety of a carbodiphosphorane by an organic azide","Acta Crystallographica Section E Crystallographic Communications","2019","75","1","75","","10.1107/S2056989018017644","","","0.71073","MoKα","","0.0561","0.0423","","","0.1169","0.1264","","","","","","1.052","","","","has coordinates,has disorder,has Fobs","212654","2020-10-21","18:00:00",""
"2021426","11.1683","0.0001","12.7805","0.0002","20.0591","0.0003","98.475","0.001","93.122","0.001","109.336","0.001","2655.76","0.07","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","{4-[3-(4-Chlorophenyl)triazenido-κ<i>N</i>^3^]-1,1,3,3-tetraphenyl-1,3λ^5^-diphospha-κ<i>P</i>^1^-but-2-en-4-yl}cyanido[methylenebis(diphenylphosphine)-κ^2^<i>P</i>,<i>P</i>']iridium(III) methanol disolvate","","- C60 H56 Cl Ir N4 O2 P4 -","- C60 H56 Cl Ir N4 O2 P4 -","- C120 H112 Cl2 Ir2 N8 O4 P8 -","2","1","SU5464","Partl, Gabriel Julian; Nussbaumer, Felix; Schuh, Walter; Kopacka, Holger; Wurst, Klaus; Peringer, Paul","Crystal structures of two PCN pincer iridium complexes and one PCP pincer carbodiphosphorane iridium intermediate: substitution of one phosphine moiety of a carbodiphosphorane by an organic azide","Acta Crystallographica Section E Crystallographic Communications","2019","75","1","75","","10.1107/S2056989018017644","","","0.71073","MoKα","","0.025","0.0228","","","0.0546","0.0556","","","","","","1.054","","","","has coordinates,has Fobs","212654","2020-10-21","18:00:00",""
"2021433","19.173","0.001","20.756","0.001","21.771","0.002","90","","110.718","0.002","90","","8103.6","0.9","190","2","190","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,8,14,20-Tetrahexyl-4,24:6,10:12,16:18,22-<i>O</i>,<i>O</i>'-tetrakis[2,3-dihydro-[1,4]dioxino[2,3-<i>g</i>]quinoxalin-7,8-diyl]resorcin[4]arene benzene monosolvate","","- C98 H94 N8 O16 -","- C98 H94 N8 O16 -","- C392 H376 N32 O64 -","4","0.5","HB7791","Pinalli, Roberta; Trzciński, Jakub W.; Dalcanale, Enrico; Massera, Chiara","A new, deep quinoxaline-based cavitand receptor for the complexation of benzene","Acta Crystallographica Section E Crystallographic Communications","2019","75","2","103","","10.1107/S2056989018017784","","","0.71073","MoKα","","0.069","0.0463","","","0.1075","0.1191","","","","","","1.016","","","","has coordinates,has disorder,has Fobs","213111","2020-10-21","18:00:00",""
"2021536","9.8778","0.0011","12.872","0.0016","14.8025","0.0018","69.092","0.004","74.786","0.004","70.324","0.004","1633.7","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","(μ-Oxalato)bis{[<i>N</i>,<i>N</i>'-bis(2-oxidobenzyl-κ<i>O</i>)-<i>N</i>,<i>N</i>'-bis(pyridin-2-ylmethyl-κ<i>N</i>)ethylenediamine-κ^2^<i>N</i>,<i>N</i>']gadolinium(III)}‒methanol‒water (1/4/4)","","- C62 H80 Gd2 N8 O16 -","- C60 H68 Gd2 N8 O12 -","- C60 H68 Gd2 N8 O12 -","1","0.5","WM5489","Barbosa, Guilherme Augusto; Santana, Francielli Sousa; Nunes, Giovana Gioppo; Soares, Jaísa Fernandes","Crystal structures of binuclear complexes of gadolinium(III) and dysprosium(III) with oxalate bridges and chelating N,N′-bis(2-oxidobenzyl)-N,N′-bis(pyridin-2-ylmethyl)ethylenediamine (bbpen2−)","Acta Crystallographica Section E Crystallographic Communications","2019","75","4","418","","10.1107/S2056989019002998","","","0.71073","MoKα","","0.0252","0.0199","","","0.0449","0.0464","","","","","","1.073","","","","has coordinates,has Fobs","214086","2020-10-21","18:00:00",""
"2021537","9.883","0.002","12.838","0.003","14.832","0.004","68.213","0.009","74.653","0.008","70.552","0.008","1626.2","0.7","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","(μ-Oxalato)bis{[<i>N</i>,<i>N</i>'-bis(2-oxidobenzyl-κ<i>O</i>)-<i>N</i>,<i>N</i>'-bis(pyridin-2-ylmethyl-κ<i>N</i>)ethylenediamine-κ^2^<i>N</i>,<i>N</i>']dysprosium(III)}‒methanol‒water (1/4/4)","","- C62 H80 Dy2 N8 O16 -","- C60 H68 Dy2 N8 O12 -","- C60 H68 Dy2 N8 O12 -","1","0.5","","Barbosa, Guilherme Augusto; Santana, Francielli Sousa; Nunes, Giovana Gioppo; Soares, Jaísa Fernandes","Crystal structures of binuclear complexes of gadolinium(III) and dysprosium(III) with oxalate bridges and chelating N,N′-bis(2-oxidobenzyl)-N,N′-bis(pyridin-2-ylmethyl)ethylenediamine (bbpen2−)","Acta Crystallographica Section E Crystallographic Communications","2019","75","4","418","","10.1107/S2056989019002998","","","0.71073","MoKα","","0.0313","0.0246","","","0.0577","0.0596","","","","","","1.06","","","","has coordinates,has Fobs","214086","2020-10-21","18:00:00",""
"2021560","6.3503","0.0004","14.9583","0.0009","12.3127","0.0009","90","","97.149","0.003","90","","1160.49","0.13","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Pentacarbonyl(2,2-difluoropropanethioato-κ<i>S</i>)manganese(I)","","- C8 H3 F2 Mn O6 S -","- C8 H3 F2 Mn O6 S -","- C32 H12 F8 Mn4 O24 S4 -","4","1","SU5491","Daran, Jean-Claude; Morales-Cerrada, Roberto; Fliedel, Christophe; Gayet, Florence; Ladmiral, Vincent; Ameduri, Bruno; Poli, Rinaldo","Crystal structure of pentacarbonyl(2,2-difluoropropanethioato-κS)manganese(I)","Acta Crystallographica Section E Crystallographic Communications","2019","75","5","529","","10.1107/S2056989019004134","","","0.71073","MoKα","","0.0291","0.0232","","","0.0587","0.0619","","","","","","1.041","","","","has coordinates,has disorder","214469","2020-10-21","18:00:00",""
"2021615","14.358","0.006","17.333","0.007","38.902","0.019","90","","90","","90","","9681","7","296","2","296.15","","","","","","","","","4","F d d d","-F 2uv 2vw","70","","Dibutyl 5,5'-(pentane-3,3-diyl)bis(1<i>H</i>-pyrrole-5-carboxylate)","","- C23 H34 N2 O4 -","- C23 H34 N2 O4 -","- C368 H544 N32 O64 -","16","","FF2158","Wang, Haijing; Yin, Zhenming","Crystal structure and Hirshfeld surface analysis of dibutyl 5,5′-(pentane-3,3-diyl)bis(1H-pyrrole-5-carboxylate)","Acta Crystallographica Section E Crystallographic Communications","2019","75","6","711","","10.1107/S205698901900567X","","","0.71073","MoKα","","0.1056","0.0806","","","0.2339","0.2782","","","","","","1.048","","","","has coordinates,has Fobs","214937","2020-10-21","18:00:00",""
"2021657","8.317","0.002","12.657","0.002","16.763","0.003","90","","90","","90","","1764.6","0.6","294","","294","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","<i>N</i>-(Diphenylphosphoryl)-2-methoxybenzamide","","- C20 H18 N O3 P -","- C20 H18 N O3 P -","- C80 H72 N4 O12 P4 -","4","1","LH5904","Trush, Victor A.; Kariaka, Nataliia S.; Dyakonenko, Viktoriya V.; Shishkina, Svitlana V.; Amirkhanov, Vladimir M.","Crystal structure of N-(diphenylphosphoryl)-2-methoxybenzamide","Acta Crystallographica Section E Crystallographic Communications","2019","75","7","939","","10.1107/S205698901900762X","","x-ray","0.71073","MoKα","","0.0614","0.0434","","","0.1046","0.1129","","","","","","1.11","","","","has coordinates,has Fobs","215710","2020-10-21","18:00:00",""
"2021694","15.737","0.008","8.526","0.004","7.761","0.004","90","","100.45","0.02","90","","1024","0.9","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","2-Amino-6-(trifluoromethoxy)-1,3-benzothiazol-3-ium chloride","","- C8 H6 Cl F3 N2 O S -","- C8 H6 Cl F3 N2 O S -","- C32 H24 Cl4 F12 N8 O4 S4 -","4","1","XI2017","Mondal, Pradip Kumar; T, Athulbabu; Rao, Varun; Chopra, Deepak","Crystal structure analysis of the biologically active drug molecule riluzole and riluzolium chloride","Acta Crystallographica Section E Crystallographic Communications","2019","75","8","1084","","10.1107/S2056989019009022","","","0.71073","MoKα","","0.1174","0.0623","","","0.1307","0.1568","","","","","","1.075","","","","has coordinates,has Fobs","216703","2020-10-21","18:00:00",""
"2021695","8.0824","0.0019","11.788","0.003","19.745","0.005","78.449","0.009","84.378","0.008","89.318","0.009","1834.2","0.8","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","6-(Trifluoromethoxy)-1,3-benzothiazol-2-amine","","- C8 H5 F3 N2 O S -","- C8 H5 F3 N2 O S -","- C64 H40 F24 N16 O8 S8 -","8","4","","Mondal, Pradip Kumar; T, Athulbabu; Rao, Varun; Chopra, Deepak","Crystal structure analysis of the biologically active drug molecule riluzole and riluzolium chloride","Acta Crystallographica Section E Crystallographic Communications","2019","75","8","1084","","10.1107/S2056989019009022","","","0.71073","MoKα","","0.1022","0.0564","","","0.113","0.1299","","","","","","1.025","","","","has coordinates,has Fobs","216703","2020-10-21","18:00:00",""
"2021760","7.3009","0.0008","11.0552","0.0011","30.006","0.003","90","","90","","90","","2421.9","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1<i>S</i>,2<i>R</i>)-2-[(3<i>R</i>,4<i>S</i>)-3-Methyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-2-yl]-1,2-diphenylethanol","","- C30 H29 N O -","- C30 H29 N O -","- C120 H116 N4 O4 -","4","1","FF2162","Ben Ali, Karim; Retailleau, Pascal","Crystal structure of (1S,2R)-2-[(3R,4S)-3-methyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-2-yl]-1,2-diphenylethanol","Acta Crystallographica Section E Crystallographic Communications","2019","75","10","1399","","10.1107/S2056989019011964","","","0.71073","MoKα","","0.0443","0.0379","","","0.0791","0.0828","","","","","","1.072","","","","has coordinates,has Fobs","217959","2020-10-21","18:00:00",""
"2021794","9.9966","0.0012","9.9966","0.0012","7.9461","0.001","90","","90","","120","","687.68","0.15","120","2","120","2","","","","","","","","3","P 63 c m","P 6c -2","185","","2,4,6-Tricyclobutyl-1,3,5-trioxane","","- C15 H24 O3 -","- C15 H24 O3 -","- C30 H48 O6 -","2","0.166667","KQ2025","Shorunov, Sergey V.; Bermeshev, Maxim V.; Demchuk, Dmitry V.; Nelyubina, Yulia V.","Synthesis and structure of 2,4,6-tricyclobutyl-1,3,5-trioxane","Acta Crystallographica Section E Crystallographic Communications","2019","75","11","1578","","10.1107/S205698901900896X","","","0.71073","MoKα","","0.0417","0.0406","","","0.107","0.1083","","","","","","1.026","","","","has coordinates","219178","2020-10-21","18:00:00",""
"2021971","6.1728","0.0003","12.3721","0.0006","13.6788","0.0007","84.302","0.002","80.846","0.002","80.909","0.002","1015.45","0.09","100","2","100","2","","","","","","","","3","P 1","P 1","1","Sclareol methanol monosolvate","(3<i>S</i>)-4-[(<i>S</i>)-3-Hydroxy-3-methylpent-4-en-1-yl]-3,4a,8,8-tetramethyldecahydronaphthalen-3-ol methanol monosolvate","","- C21 H40 O3 -","- C21 H40 O3 -","- C42 H80 O6 -","2","2","HB7890","Bibi, Memoona; Choudhary, M. Iqbal; Yousuf, Sammer","Crystal structure and Hirshfeld surface analysis of the methanol solvate of sclareol, a labdane-type diterpenoid","Acta Crystallographica Section E Crystallographic Communications","2020","76","3","294","","10.1107/S2056989020001474","","","1.54178","CuKα","","0.0375","0.0373","","","0.11","0.1102","","","","","","1.014","","","","has coordinates,has Fobs","247943","2020-10-21","18:00:00",""
"2021993","8.4959","0.0002","9.6479","0.0002","8.7619","0.0002","90","","116.921","0.001","90","","640.36","0.03","299.16","","299.16","","","","","","","","","4","P 1 21 1","P 2yb","4","NA8","(<i>S</i>)-10-(Prop-2-yn-1-yl)pyrrolo[2,1-<i>c</i>][1,4]benzodiazepine-5,11-dione","","- C15 H14 N2 O2 -","- C15 H14 N2 O2 -","- C30 H28 N4 O4 -","2","1","LH5947","Jeroundi, Dounia; Mazzah, Ahmed; Hökelek, Tuncer; El Hadrami, El Mestafa; Renard, Catherine; Haoudi, Amal; Essassi, El Mokhtar","Crystal structure, Hirshfeld surface analysis and interaction energy and DFT studies of (S)-10-propargylpyrrolo[2,1-c][1,4]benzodiazepine-5,11-dione","Acta Crystallographica Section E Crystallographic Communications","2020","76","4","467","","10.1107/S2056989020002698","","","0.71073","MoKα","","0.0463","0.0389","","","0.0983","0.1032","","","","","","1.061","","","","has coordinates,has Fobs","248727","2020-10-21","18:00:00",""
"2022002","10.7997","0.0003","11.2319","0.0002","12.0225","0.0003","90","","95.184","0.002","90","","1452.38","0.06","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","<i>catena</i>-Poly[[[tetraaquanickel(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] bis(6-chloronicotinate) tetrahydrate]","","- C22 H30 Cl2 N4 Ni O12 -","- C22 H30 Cl2 N4 Ni O12 -","- C44 H60 Cl4 N8 Ni2 O24 -","2","0.5","HB7900","Politeo, Nives; Pisačić, Mateja; Đaković, Marijana; Sokol, Vesna; Kukovec, Boris-Marko","Synthesis and crystal structure of a 6-chloronicotinate salt of a one-dimensional cationic nickel(II) coordination polymer with 4,4′-bipyridine","Acta Crystallographica Section E Crystallographic Communications","2020","76","5","599","","10.1107/S2056989020004193","","","0.71073","MoKα","","0.0376","0.0285","","","0.0695","0.0738","","","","","","1.069","","","","has coordinates,has Fobs","250124","2020-10-21","18:00:00",""
"2022132","10.5601","0.0007","11.0044","0.0012","11.8145","0.001","80.212","0.008","69.124","0.007","78.565","0.007","1249.9","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","<i>catena</i>-Poly[[[diaqua[1,2-bis(pyridin-4-yl)ethene]{4-[2-(pyridin-4-yl)ethenyl]pyridinium}gold(I)iron(II)]-di-μ-cyanido] bis[dicyanidogold(I)] 1,2-bis(pyridin-4-yl)ethene dihydrate]","","- C42 H39 Au3 Fe N12 O4 -","- C42 H39 Au3 Fe N12 O4 -","- C42 H39 Au3 Fe N12 O4 -","1","0.5","TX2022","Partsevska, Sofiia V.; Naumova, Dina D.; Matushko, Igor P.; Shova, Sergiu; Gural'skiy, Il'ya A.","Crystal structure of catena-poly[[[diaqua[1,2-bis(pyridin-4-yl)ethene]{4-[2-(pyridin-4-yl)ethenyl]pyridinium}gold(I)iron(II)]-di-μ-cyanido] bis[dicyanidogold(I)] 1,2-bis(pyridin-4-yl)ethene dihydrate]","Acta Crystallographica Section E Crystallographic Communications","2020","76","6","944","","10.1107/S2056989020006738","","","0.71073","MoKα","","0.0645","0.0501","","","0.1426","0.1555","","","","","","1.035","","","","has coordinates,has disorder,has Fobs","252481","2020-10-21","18:00:00",""
"2022163","9.4078","0.0007","9.2511","0.0007","11.6953","0.0008","90","","105.722","0.008","90","","979.79","0.13","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,5,8,11,14,17-Hexathia-[9.9](2,6,3,5)-pyrazinophane","","- C16 H24 N2 S6 -","- C16 H24 N2 S6 -","- C32 H48 N4 S12 -","2","0.5","","Assoumatine, Tokouré; Stoeckli-Evans, Helen","The crystal structures, Hirshfeld surface analyses and energy frameworks of two hexathiapyrazinophane regioisomers; 2,5,8,11,14,17-hexathia-[9.9](2,6,3,5)-pyrazinophane and 2,5,8,11,14,17-hexathia-[9.9](2,5,3,6)-pyrazinophane","Acta Crystallographica Section E Crystallographic Communications","2020","76","7","977","","10.1107/S2056989020007057","","","0.71073","MoKα","","0.053","0.0424","","","0.1046","0.1084","","","","","","1.029","","","","has coordinates,has disorder,has Fobs","252983","2020-10-21","18:00:00",""
"2022164","12.2613","0.0008","9.9564","0.0006","16.2828","0.0012","90","","90","","90","","1987.8","0.2","223","2","223","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","2,5,8,11,14,17-Hexathia-[9.9](2,5,3,6)-pyrazinophane","","- C16 H24 N2 S6 -","- C16 H24 N2 S6 -","- C64 H96 N8 S24 -","4","0.5","","Assoumatine, Tokouré; Stoeckli-Evans, Helen","The crystal structures, Hirshfeld surface analyses and energy frameworks of two hexathiapyrazinophane regioisomers; 2,5,8,11,14,17-hexathia-[9.9](2,6,3,5)-pyrazinophane and 2,5,8,11,14,17-hexathia-[9.9](2,5,3,6)-pyrazinophane","Acta Crystallographica Section E Crystallographic Communications","2020","76","7","977","","10.1107/S2056989020007057","","","0.71073","MoKα","","0.0347","0.0245","","","0.0613","0.0635","","","","","","0.971","","","","has coordinates,has Fobs","252983","2020-10-21","18:00:00",""
"2022178","7.1138","0.0004","12.6827","0.0006","15.1613","0.0008","90","","100.571","0.002","90","","1344.67","0.12","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(<i>E</i>)-1-(2,6-Dichlorophenyl)-2-(2-nitrobenzylidene)hydrazine","","- C13 H9 Cl2 N3 O2 -","- C13 H9 Cl2 N3 O2 -","- C52 H36 Cl8 N12 O8 -","4","1","VM2235","Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Suleymanova, Gulnar T.; Babayeva, Gulnare V.; Gurbanova, Nurana V.; Mammadova, Gunay Z.; Bhattarai, Ajaya","Crystal structure and Hirshfeld surface analysis of (E)-1-(2,6-dichlorophenyl)-2-(2-nitrobenzylidene)hydrazine","Acta Crystallographica Section E Crystallographic Communications","2020","76","8","1173","","10.1107/S2056989020008567","","","0.71073","MoKα","","0.0609","0.0517","","","0.1125","0.1182","","","","","","1.065","","","","has coordinates,has Fobs","253758","2020-10-21","18:00:00",""
"2022294","8.7897","0.0002","14.8937","0.0003","11.1294","0.0002","90","","101.742","0.002","90","","1426.47","0.05","100","","100.15","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","5-Bromourotropinium bromide","1-(5-Bromopentyl)-3,5,7-triaza-1-azoniatricyclo[3.3.1.1^3,7^]decane bromide","","- C11 H22 Br2 N4 -","- C11 H22 Br2 N4 -","- C44 H88 Br8 N16 -","4","1","HB7951","Mulrooney, David Z. T.; Müller-Bunz, Helge; Keene, Tony D.","Crystal structure and halogen‒hydrogen bonding of a Delépine reaction intermediate","Acta Crystallographica Section E Crystallographic Communications","2021","77","1","1","4","10.1107/S2056989020015601","","","1.54184","CuKα","","0.031","0.0254","","","0.0593","0.0625","","","","","","1.038","","","","has coordinates,has Fobs","259555","2020-12-05","05:32:58",""
"2022339","29.4665","0.0014","22.1299","0.0011","28.9371","0.0014","90","","97.3964","0.0014","90","","18712.6","1.6","100","2","100","2","","","","","","","","7","C 1 2 1","C 2y","5","","Poly[[tetra-μ~3~-chlorido-deca-μ~2~-chlorido-dichloridohexakis(μ~4~-<i>L</i>-cysteinato)hexadecacopper] polyhydrate]","","- C36 H74.68 Cl32 Cu32 N12 O25.97 S12 -","- C36 H74.68 Cl32 Cu32 N12 O25.97 S12 -","- C144 H298.72 Cl128 Cu128 N48 O103.88 S48 -","4","1","HB7953","Gizatullin, Amir; Becker, Jonathan; Islamov, Daut; Serov, Nikita; Schindler, Siegfried; Klimovitskii, Alexander; Shtyrlin, Valery","Synthesis and structure of a complex of copper(I) with L-cysteine and chloride ions containing Cu12S6 nanoclusters","Acta Crystallographica Section E Crystallographic Communications","2021","77","4","324","330","10.1107/S2056989021002012","","","0.71073","MoKα","","0.0584","0.0412","","","0.1062","0.1138","","","","","","1.085","","","","has coordinates,has disorder,has Fobs","262380","2021-03-03","07:11:01",""
"2022377","10.32882","0.00007","8.50126","0.00005","9.30814","0.00006","90","","98.5748","0.0005","90","","808.193","0.009","298","","298","","","","","","","","","4","C 1 2/m 1","-C 2y","12","magnesium zinc divanadium oxide","Magnesium zinc divanadate","","- Mg O7 V2 Zn -","- Mg O7 V2 Zn -","- Mg6 O42 V12 Zn6 -","6","0.75","WM5602","Hong, Stephanie J.; Li, Jun; Subramanian, Mas A.","Crystal structure refinement of magnesium zinc divanadate, MgZnV2O7, from powder X-ray diffraction data","Acta Crystallographica Section E Crystallographic Communications","2021","77","6","588","591","10.1107/S2056989021004503","powder diffraction","x-ray","1.5405","Cukα~1~","","","","","","","","","","1.81","","","","","","","has coordinates","265086","2021-05-11","04:49:48",""
"2022386","8.581","0.0002","9.2648","0.0003","11.4073","0.0004","90","","90","","90","","906.89","0.05","153","1","153","1","","","","","","","","5","P n a 21","P 2c -2n","33","","Potassium triiodidomercurate(II) monohydrate","","- H2 Hg I3 K O -","- H2 Hg I3 K O -","- H8 Hg4 I12 K4 O4 -","4","1","WM5609","Chocolatl Torres, Misael; Bernès, Sylvain; Salazar Kuri, Ulises","Refinement of K[HgI3]·H2O using non-spherical atomic form factors","Acta Crystallographica Section E Crystallographic Communications","2021","77","7","681","685","10.1107/S2056989021005582","","x-ray","0.56083","AgKα","","0.0363","0.0214","","","0.0353","0.0381","","","","","","0.8712","","","","has coordinates,has Fobs","265824","2021-06-05","05:26:11",""
"2022437","17.6783","0.0014","17.2647","0.0014","16.383","0.002","90","","121.867","0.003","90","","4246.6","0.7","100","2","100","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","Hexa-μ~2~-azido-di-μ~3~-chlorido-hexa-μ~2~-hydroxido-di-μ~3~-oxido-hexakis(pentamethylcyclopentadienyl)hexathorium‒diethyl ether‒tetrahydrofuran (1/0.56/1.44)","","- C68 H113.12 Cl2 N18 O10 Th6 -","- C67.28 H111.12 Cl2 N18 O9.28 Th6 -","- C134.56 H222.24 Cl4 N36 O18.56 Th12 -","2","0.25","ZL5025","Kelley, Steven P.; Rungthanaphatsophon, Pokpong; Walensky, Justin R.","Crystal structure of [Th3(Cp*)3(O)(OH)3]2Cl2(N3)6: a discrete molecular capsule built from multinuclear organothorium cluster cations","Acta Crystallographica Section E Crystallographic Communications","2021","77","10","","","10.1107/S2056989021008914","","","0.71073","MoKα","","0.0361","0.0266","","","0.0529","0.0563","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","269047","2021-09-08","02:07:08",""
"2022482","6.7605","0.0006","15.065","0.001","16.0849","0.0009","90","","90","","90","","1638.2","0.2","150","0.12","150.15","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(4-Methylphenyl)[1-(pentafluorophenyl)-5-(trifluoromethyl)-1<i>H</i>-1,2,3-triazol-4-yl]methanone","","- C17 H7 F8 N3 O -","- C17 H7 F8 N3 O -","- C68 H28 F32 N12 O4 -","4","1","HB7985","Pokhodylo, Nazariy T.; Slyvka, Yurii; Goreshnik, Evgeny; Lytvyn, Roman","Synthesis, crystal structure and Hirshfeld surface analysis of (4-methylphenyl)[1-(pentafluorophenyl)-5-(trifluoromethyl)-1H-1,2,3-triazol-4-yl]methanone","Acta Crystallographica Section E Crystallographic Communications","2021","77","11","","","10.1107/S2056989021010070","","","1.54184","CuKα","","0.0778","0.0469","","","0.092","0.1088","","","","","","1.032","","","","has coordinates,has Fobs","269597","2021-10-06","01:44:12",""
"2022483","10.4266","0.0004","6.0539","0.0002","14.2168","0.0007","90","","90.261","0.004","90","","897.38","0.06","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","(<i>R</i>)-2-(Benzylselanyl)-1-phenylethanaminium hydrogen sulfate monohydrate","","- C15 H21 N O5 S Se -","- C15 H21 N O5 S Se -","- C30 H42 N2 O10 S2 Se2 -","2","1","YY2003","Rajegowda, H. R.; Suchetan, P. A.; Butcher, R. J.; Raghavendra Kumar, P.","Synthesis and absolute structure of (R)-2-(benzylselanyl)-1-phenylethanaminium hydrogen sulfate monohydrate: crystal structure and Hirshfeld surface analyses","Acta Crystallographica Section E Crystallographic Communications","2021","77","11","","","10.1107/S2056989021010409","","","0.71073","MoKα","","0.0549","0.0441","","","0.1012","0.1128","","","","","","0.989","","","","has coordinates,has Fobs","270047","2021-10-20","02:24:38",""
"2022491","21.507","0.004","21.507","0.004","13.434","0.004","90","","90","","90","","6214","2","100","2","100","2","","","","","","","","5","P -4 b 2","P -4 -2ab","117","","2,2''-({[(1<i>E</i>,1'<i>E</i>)-(Diselanediyl)bis(2,1-phenylene)]bis(methaneylylidene)}bis(azaneylylidene))bis[3',6'-bis(diethylamino)-4a',9a'-dihydrospiro[isoindoline-1,9'-xanthen]-3-one]","","- C70 H70 N8 O4 Se2 -","- C70 H70 N8 O4 Se2 -","- C280 H280 N32 O16 Se8 -","4","0.5","ZL5020","Malla, Manzoor Ahmad; Bansal, Ravi; Butcher, Ray J.; Gupta, Sushil K.","Crystal structure, Hirshfeld surface analysis and DFT study of 2,2''-({[(1<i>E</i>,1'<i>E</i>)-(diselanediyl)bis(2,1-phenylene)]bis(methaneylylidene)}bis(azaneylylidene))bis[3',6'-bis(diethylamino)-4a',9a'-dihydrospiro[isoindoline-1,9'-xanthen]-3-one]","Acta Crystallographica Section E","2022","78","1","1","7","10.1107/S2056989021013189","","","0.71073","MoKα","","0.0924","0.0699","","","0.134","0.1416","","","","","","1.082","","","","has coordinates,has disorder,has Fobs","272813","2022-02-06","04:32:03",""
"2022514","23.5976","0.0006","11.8723","0.0003","22.2989","0.0006","90","","90","","90","","6247.2","0.3","100","2","100","2","","","","","","","","6","P n a 21","P 2c -2n","33","","<i>cyclo</i>-Tetrakis(μ-2-methoxy-6-{[2-(pyridin-2-yl)hydrazin-1-ylidene]methyl}phenolato)tetranickel(II) tetrakis(perchlorate) acetonitrile monosolvate dihydrate","","- C54 H55 Cl4 N13 Ni4 O26 -","- C54 H55 Cl4 N13 Ni4 O26 -","- C216 H220 Cl16 N52 Ni16 O104 -","4","1","YY2002","Patel, R. N.; Patel, S. K.; Patel, A. K.; Patel, N.; Butcher, Ray J.","A tetranuclear nickel(II) complex, [Ni4(L)4](ClO4)4·C2H3N·2H2O, with an asymmetric Ni4O4 open-cubane-like core","Acta Crystallographica Section E Crystallographic Communications","2022","78","2","","","10.1107/S2056989021012408","","","0.71073","MoKα","","0.0705","0.0476","","","0.1121","0.125","","","","","","1.058","","","","has coordinates,has disorder,has Fobs","272054","2022-01-15","02:38:02",""
"2022532","18.4889","0.0014","10.9722","0.0008","19.1517","0.0014","90","","94.035","0.002","90","","3875.6","0.5","105","2","105.32","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(6,6'-{[(Cyclohexane-1,2-diyl)bis(azanediyl)]bis(methylene)}bis(2,4-di-<i>tert</i>-butylphenolato))dioxidomolybdenum(VI) methanol disolvate","","- C38 H64 Mo N2 O6 -","- C38 H64 Mo N2 O6 -","- C152 H256 Mo4 N8 O24 -","4","1","TX2046","Trieu-Tran, Tristhan; Martinez, Stephenie N.; Brannon, Jacob P.; Stieber, S. Chantal E.; John, Alex","Crystal structures of two dioxomolybdenum complexes stabilized by salan ligands featuring phenyl and cyclohexyl backbones","Acta Crystallographica Section E Crystallographic Communications","2022","78","3","","","10.1107/S2056989022000524","","","0.71073","MoKα","","0.0311","0.0278","","","0.0683","0.0702","","","","","","1.066","","","","has coordinates,has Fobs","272410","2022-02-02","02:59:41",""
"2022533","9.601","","12.86","","21.428","","91.44","","91.49","","93.22","","2639.68","","100","2","99.97","","","","","","","","","5","P -1","-P 1","2","","Dioxido{2,2'-[l,2-phenylenebis(iminomethylene)]bis(phenolato)}molybdenum(VI) dimethylformamide disolvate","","- C26 H32 Mo N4 O6 -","- C26 H32 Mo N4 O6 -","- C104 H128 Mo4 N16 O24 -","4","2","","Trieu-Tran, Tristhan; Martinez, Stephenie N.; Brannon, Jacob P.; Stieber, S. Chantal E.; John, Alex","Crystal structures of two dioxomolybdenum complexes stabilized by salan ligands featuring phenyl and cyclohexyl backbones","Acta Crystallographica Section E Crystallographic Communications","2022","78","3","","","10.1107/S2056989022000524","","","0.71073","MoKα","","0.0533","0.0354","","","0.0618","0.0649","","","","","","1.058","","","","has coordinates","272410","2022-02-02","02:59:42",""
"2022579","4.6003","0.0005","6.2969","0.0005","30.726","0.004","90","","90.886","0.009","90","","889.95","0.17","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,3'-{[(1<i>E</i>,2<i>E</i>)-Ethane-1,2-diylidene]bis(azanylylidene)}bis(4-methylbenzoate)","","- C20 H20 N2 O4 -","- C20 H20 N2 O4 -","- C40 H40 N4 O8 -","2","0.5","ZN2013","Yeşilbağ, Semanur; Çınar, Emine Berrin; Dege, Necmi; Ağar, Erbil; Saif, Eiad","Crystal structure and Hirshfeld surface analysis of dimethyl 3,3′-{[(1E,2E)-ethane-1,2-diylidene]bis(azanylylidene)}bis(4-methylbenzoate)","Acta Crystallographica Section E Crystallographic Communications","2022","78","4","","","10.1107/S2056989022002092","","","0.71073","MoKα","","0.0567","0.0411","","","0.1166","0.1256","","","","","","1.061","","","","has coordinates,has Fobs","273205","2022-03-02","03:04:36",""
"2022598","9.3699","0.0002","15.3897","0.0004","16.0267","0.0004","92.6869","0.0009","105.154","0.0008","100.015","0.0007","2186.3","0.09","296","","296","","","","","","","","","8","P -1","-P 1","2","","<i>cis</i>-Aqua[2,6-bis(1,8-naphthyridin-2-yl)pyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>''](thiocyanato-κ<i>N</i>)(triphenylphosphine-κ<i>P</i>)ruthenium(II) hexafluoridophosphate–acetone–water (1/0.5/1)","","- C41.5 H35 F6 N6 O2.5 P2 Ru S -","- C41.5 H31 F6 N6 O2.5 P2 Ru S -","- C83 H62 F12 N12 O5 P4 Ru2 S2 -","2","1","WM5641","Takase, Tsugiko; Yamanaka, Takashi; Tamura, Chihiro; Oyama, Dai","Isolation and structural comparison of RuII-dnp complexes [dnp = 2,6-bis(1,8-naphthyridin-2-yl)pyridine] with axially or equatorially coordinating NCS ligands","Acta Crystallographica Section E Crystallographic Communications","2022","78","6","","","10.1107/S2056989022004443","","","0.71075","MoKα","","0.0596","0.05","","","0.1589","0.1689","","","","","","1.079","","","","has coordinates,has disorder,has Fobs","275187","2022-05-07","01:47:00",""
"2022599","12.6556","0.001","14.0986","0.0007","17.4421","0.0014","90","","108.535","0.003","90","","2950.7","0.4","93","","93","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>trans</i>-[2,6-Bis(1,8-naphthyridin-2-yl)pyridine-κ^3^'<i>N</i>,<i>N</i>',<i>N</i>'']bis(pyridine-κ<i>N</i>)(thiocyanato-κ<i>N</i>)ruthenium(II) thiocyanate","","- C33 H23 N9 Ru S2 -","- C33 H23 N9 Ru S2 -","- C132 H92 N36 Ru4 S8 -","4","1","WM5641","Takase, Tsugiko; Yamanaka, Takashi; Tamura, Chihiro; Oyama, Dai","Isolation and structural comparison of RuII-dnp complexes [dnp = 2,6-bis(1,8-naphthyridin-2-yl)pyridine] with axially or equatorially coordinating NCS ligands","Acta Crystallographica Section E Crystallographic Communications","2022","78","6","","","10.1107/S2056989022004443","","","0.71075","MoKα","","0.0414","0.036","","","0.0871","0.0907","","","","","","1.103","","","","has coordinates,has Fobs","275187","2022-05-07","01:47:03",""
"2022629","15.58979","0.00016","10.33883","0.0001","9.91195","0.00009","90","","90","","90","","1597.61","0.03","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","2-(4-Bromophenyl)-4-methyl-6-oxo-1-phenyl-1,6-dihydropyridine-3-carbonitrile","","- C19 H13 Br N2 O -","- C19 H13 Br N2 O -","- C76 H52 Br4 N8 O4 -","4","1","VM2267","Naghiyev, Farid N.; Khrustalev, Victor N.; Dobrokhotova, Ekaterina V.; Akkurt, Mehmet; Khalilov, Ali N.; Bhattarai, Ajaya; Mamedov, İbrahim G.","Crystal structure and Hirshfeld surface analysis of 2-(4-bromophenyl)-4-methyl-6-oxo-1-phenyl-1,6-dihydropyridine-3-carbonitrile","Acta Crystallographica Section E Crystallographic Communications","2022","78","8","","","10.1107/S2056989022006466","","","1.54178","CuKα","","0.0371","0.037","","","0.099","0.0991","","","","","","1.049","","","","has coordinates,has Fobs","276585","2022-07-06","01:50:45",""
"2022660","11.205","0.019","6.687","0.011","8.373","0.015","90","","90","","90","","627.4","1.9","100","2","100","2","","","","","","","","3","P n m a","-P 2ac 2n","62","Compound 1 (s20_07)","1,3,5-Trimethyl-1<i>H</i>-pyrazole","","- C6 H10 N2 -","- C6 H10 N2 -","- C24 H40 N8 -","4","0.5","DJ2050","van Terwingen, Steven; Englert, Ulli","Trimethylpyrazole: a simple heterocycle reflecting Kitaigorodskii's packing principle","Acta Crystallographica Section E Crystallographic Communications","2022","78","10","","","10.1107/S205698902200860X","","","0.71073","MoKα","","0.0907","0.0467","","","0.1095","0.1192","","","","","","0.873","","","","has coordinates,has Fobs","277611","2022-09-03","02:01:49",""
"2022678","9.935","0.0003","17.5133","0.0007","21.4662","0.0008","90","","90","","90","","3735","0.2","90","0.2","90","0.2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","<i>N</i>-{3-Cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(ethylsulfanyl)-1<i>H</i>-pyrazol-5-yl}-2,2,2-trifluoroacetamide","","- C15 H8 Cl2 F6 N4 O S -","- C15 H8 Cl2 F6 N4 O S -","- C120 H64 Cl16 F48 N32 O8 S8 -","8","1","TX2059","Priyanka, Prabhakar; Jayanna, Bidarur K.; Sunil Kumar, Yelekere C.; Shreenivas, Mellekatte T.; Srinivasa, Gejjelegere R.; Divakara, Thayamma R.; Yathirajan, Hemmige S.; Parkin, Sean","Synthesis, spectroscopic and crystal structure studies of N-{3-cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(ethylsulfanyl)-1H-pyrazol-5-yl}-2,2,2-trifluoroacetamide","Acta Crystallographica Section E Crystallographic Communications","2022","78","11","","","10.1107/S2056989022009653","","","0.71073","MoKα","","0.0292","0.0257","","","0.0626","0.0644","","","","","","1.043","","","","has coordinates,has Fobs","278354","2022-10-05","01:57:24",""
"2022691","14.7026","0.0004","8.5449","0.0002","16.9929","0.0004","90","","92.8","0.002","90","","2132.31","0.09","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,5-Dicarboxyanilinium nitrate monohydrate","","- C8 H10 N2 O8 -","- C8 H10 N2 O8 -","- C64 H80 N16 O64 -","8","2","ZV2018","Boutebdja, Mehdi; Benarous, Nesrine; Boulkedid, Ahlem Linda; Lehleh, Asma; Beghidja, Adel","A new (monohydrate) form of 3,5-dicarboxyanilinium nitrate: crystal structure and Hirshfeld surface analysis","Acta Crystallographica Section E Crystallographic Communications","2022","78","12","","","10.1107/S2056989022010167","","","0.71073","MoKα","","0.0667","0.0477","","","0.1279","0.1423","","","","","","1.018","","","","has coordinates,has Fobs","278897","2022-11-01","12:23:35",""
"2022692","13.0128","0.0002","27.1423","0.0004","13.9114","0.0003","90","","109.485","0.002","90","","4632.07","0.15","130","2","130","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>closo</i>-9-[4-(Dibenzylamino)phenyl]-1,2-dicarbadodecaborane(12)","","- C22 H29 B10 N -","- C22 H29 B10 N -","- C176 H232 B80 N8 -","8","2","JQ2023","Milewski, Max; Caminade, Anne-Marie; Hey-Hawkins, Evamarie; Lönnecke, Peter","Pitfalls of a structure determination: The structure of closo-9-[4-(dibenzylamino)phenyl]-1,2-dicarbadodecaborane(12)","Acta Crystallographica Section E Crystallographic Communications","2022","78","12","","","10.1107/S205698902201043X","","","0.71073","MoKα","","0.0968","0.0562","","","0.1358","0.1597","","","","","","1.018","","","","has coordinates,has Fobs","279133","2022-11-09","03:04:26",""
"2022733","10.0531","0.0002","17.3479","0.0004","34.3141","0.0005","90","","90","","90","","5984.4","0.2","200","2","200","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Bis(isoselenocyanato-κ<i>N</i>)tetrakis(4-methoxypyridine-κ<i>N</i>)cobalt(II)","","- C26 H28 Co N6 O4 Se2 -","- C26 H28 Co N6 O4 Se2 -","- C208 H224 Co8 N48 O32 Se16 -","8","1","PK2678","Näther, Christian; Jess, Inke","Synthesis, crystal structure and properties of bis(isoselenocyanato-κN)tetrakis(4-methoxypyridine-κN)cobalt(II)","Acta Crystallographica Section E Crystallographic Communications","2023","79","3","216","220","10.1107/S2056989023001391","","","0.71073","MoKα","","0.0452","0.0376","","","0.0834","0.0871","","","","","","1.073","","","","has coordinates,has Fobs","282431","2023-04-05","16:09:24",""
"2022749","8.94782","0.0001","9.03908","0.00009","14.87299","0.00018","90.9441","0.0009","104.12","0.001","111.745","0.001","1075.92","0.02","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","1,6-Diamino-2-oxo-4-(thiophen-2-yl)-1,2-dihydropyridine-3,5-dicarbonitrile","","- C11 H7 N5 O S -","- C11 H7 N5 O S -","- C44 H28 N20 O4 S4 -","4","2","TX2066","Naghiyev, Farid N.; Khrustalev, Victor N.; Akkurt, Mehmet; Khalilov, Ali N.; Bhattarai, Ajaya; Kerimli, Fuad Sh.; Mamedov, İbrahim G.","Crystal structure and Hirshfeld surface analysis of 1,6-diamino-2-oxo-4-(thiophen-2-yl)-1,2-dihydropyridine-3,5-dicarbonitrile","Acta Crystallographica Section E Crystallographic Communications","2023","79","5","494","498","10.1107/S2056989023003237","","","1.54184","CuKα","","0.0408","0.0404","","","0.1042","0.1045","","","","","","1.092","","","","has coordinates,has disorder,has Fobs","284372","2023-06-06","05:31:33",""
"2022778","10.4134","0.0002","6.9167","0.0002","20.4801","0.0005","90","","90.308","0.002","90","","1475.09","0.06","293","2","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","1-[4-(1-Hydroxycyclohexan-1-yl)buta-1,3-diyne-1-yl]cyclohexan-1-ol","1,1'-(Buta-1,3-diyne-1,4-diyl)bis(cyclohexan-1-ol)","","- C16 H22 O2 -","- C16 H22 O2 -","- C64 H88 O8 -","4","1","ZV2024","Tirkasheva, Sarvinoz I.; Ziyadullaev, Odiljon E.; Eshimbetov, Alisher G.; Ibragimov, Bakhtiyar T.; Ashurov, Jamshid M.","Synthesis, crystal structure, Hirshfeld surface analysis and DFT study of the 1,1′-(buta-1,3-diyne-1,4-diyl)bis(cyclohexan-1-ol)","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S2056989023004772","","x-ray","1.54184","CuKα","","0.0594","0.0444","","","0.1181","0.1291","","","","","","1.066","","","","has coordinates,has Fobs","284686","2023-06-29","15:39:29",""
"2022779","11.5094","0.0009","13.9839","0.0008","9.4247","0.0005","90","","90","","90","","1516.87","0.17","213","2","213","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","<i>catena</i>-Poly[[bis(diaqualithium)]-μ~4~-3,3',5,5'-tetranitro-4,4'-bipyrazole-1,1'-diido]","","- C6 H8 Li2 N8 O12 -","- C6 H8 Li2 N8 O12 -","- C24 H32 Li8 N32 O48 -","4","0.5","PK2688","Domasevitch, Kostiantyn V.; Senchyk, Ganna A.; Krautscheid, Harald","catena-Poly[[bis(diaqualithium)]-μ4-3,3′,5,5′-tetranitro-4,4′-bipyrazole-1,1′-diido]: a new moisture-insensitive alkali-metal energetic salt with a well-defined network structure","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S2056989023005339","","","0.71073","MoKα","","0.0468","0.0299","","","0.0697","0.0723","","","","","","0.88","","","","has coordinates,has Fobs","284687","2023-06-29","15:40:19",""
"2022780","10.2674","0.001","10.9688","0.001","17.157","0.0016","73.835","0.003","77.573","0.003","72.894","0.003","1754.9","0.3","100","","100","","","","","","","","","6","P -1","-P 1","2","","Trisodium tris(pyridine-2,6-dicarboxylato-κ^3^<i>O</i>^2^,<i>N</i>,<i>O</i>^6^)samarate(III) tetradecahydrate","","- C21 H37 N3 Na3 O26 Sm -","- C21 H37 N3 Na3 O26 Sm -","- C42 H74 N6 Na6 O52 Sm2 -","2","1","","Mortensen, Sabina Svava; Sørensen, Thomas Just","Crystal structures of two SmIII complexes with dipicolinate [DPA]2− ligands: comparison of luminescent properties of products obtained at different pH values","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S2056989023004814","","","0.71073","MoKα","","0.0259","0.023","","","0.057","0.0581","","","","","","1.11","","","","has coordinates,has Fobs","284688","2023-06-29","15:41:29",""
"2022781","13.9292","0.0008","11.1969","0.0007","12.8086","0.0007","90","","103.049","0.002","90","","1946.1","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[[diaqua(6-carboxypyridine-2-carboxylato-κ^3^<i>O</i>^2^,<i>N</i>,<i>O</i>^6^)samarium(III)]-μ-pyridine-2,6-dicarboxylato-κ^4^<i>O</i>^2^,<i>N</i>,<i>O</i>^6^:<i>O</i>^2^] tetrahydrate]","","- C14 H19 N2 O14 Sm -","- C14 H19 N2 O14 Sm -","- C56 H76 N8 O56 Sm4 -","4","1","","Mortensen, Sabina Svava; Sørensen, Thomas Just","Crystal structures of two SmIII complexes with dipicolinate [DPA]2− ligands: comparison of luminescent properties of products obtained at different pH values","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S2056989023004814","","","0.71073","MoKα","","0.0233","0.0181","","","0.0397","0.0415","","","","","","1.077","","","","has coordinates,has Fobs","284688","2023-06-29","15:41:29",""
"2022782","13.2004","0.0004","13.2004","0.0004","13.2004","0.0004","90","","90","","90","","2300.18","0.12","223","2","223","2","","","","","","","","4","P 41 3 2","P 4bd 2ab 3","213","","Trisilver Didysprosium nonanitrate","","- Ag3 Dy2 N9 O27 -","- Ag3 Dy2 N9 O27 -","- Ag12 Dy8 N36 O108 -","4","0.166667","PK2686","Klein, Wilhelm","Crystal structure of Ag3Dy2(NO3)9 and quantitative comparison to isotypic compounds","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S2056989023004747","","","0.71073","MoKα","","0.0482","0.0445","","","0.1187","0.122","","","","","","1.177","","","","has coordinates,has Fobs","284689","2023-06-29","15:42:36",""
"2022783","6.2384","0.00006","7.4355","0.0001","18.32032","0.00017","90","","91.4183","0.0008","90","","849.539","0.016","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","5-(β-<i>D</i>-Glucopyranosylthio)-<i>N</i>-(4-methylphenyl)-1,3,4-thiadiazol-2-amine","5-[(β-<i>D</i>-Glucopyranosyl)sulfanyl]-<i>N</i>-(4-methylphenyl)-1,3,4-thiadiazol-2-amine","","- C15 H19 N3 O5 S2 -","- C15 H19 N3 O5 S2 -","- C30 H38 N6 O10 S4 -","2","1","YZ2035","Abu-Zaied, Mamdouh A.; Hebishy, Ali M. S.; Elgemeie, Galal H.; Salama, Hagar T.; Jones, Peter G.","Crystal structure of 5-(β-D-glucopyranosylthio)-N-(4-methylphenyl)-1,3,4-thiadiazol-2-amine","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S2056989023005248","","x-ray","1.54184","CuKα","","0.0191","0.019","","","0.0496","0.0497","","","","","","1.031","","","","has coordinates,has Fobs","284690","2023-06-29","15:43:33",""
"2022784","16.7473","0.0003","12.1998","0.0002","20.9668","0.0004","90","","90","","90","","4283.8","0.13","100","0.1","100","0.1","","","","","","","","5","P c a 21","P 2c -2ac","29","","Tris(2,6-dimethylphenyl isocyanide)(η^4^-tetraphenylcyclopentadienone)iron","","- C56 H47 Fe N3 O -","- C56 H47 Fe N3 O -","- C224 H188 Fe4 N12 O4 -","4","1","MW2197","Bütikofer, André; Chen, Peter","Cyclopentadienone triisocyanide iron complexes: general synthesis and crystal structures of tris(2,6-dimethylphenyl isocyanide)(η4-tetraphenylcyclopentadienone)iron and tris(naphthalen-2-yl isocyanide)(η4-tetraphenylcyclopentadienone)iron acetone hemisolvate","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S205698902300498X","","x-ray","1.54184","CuKα","","0.0514","0.0422","","","0.1041","0.1093","","","","","","1.048","","","","has coordinates,has Fobs","284691","2023-06-29","15:44:42",""
"2022785","15.2471","0.0001","19.8604","0.0001","15.5785","0.0001","90","","99.378","0.001","90","","4654.33","0.05","100","0.1","100","0.1","","","","","","","","5","P 1 21 1","P 2yb","4","","Tris(naphthalen-2-yl isocyanide)(η^4^-tetraphenylcyclopentadienone)iron acetone hemisolvate","","- C127 H88 Fe2 N6 O3 -","- C127 H88 Fe2 N6 O3 -","- C254 H176 Fe4 N12 O6 -","2","1","","Bütikofer, André; Chen, Peter","Cyclopentadienone triisocyanide iron complexes: general synthesis and crystal structures of tris(2,6-dimethylphenyl isocyanide)(η4-tetraphenylcyclopentadienone)iron and tris(naphthalen-2-yl isocyanide)(η4-tetraphenylcyclopentadienone)iron acetone hemisolvate","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S205698902300498X","","x-ray","1.54184","CuKα","","0.0388","0.0363","","","0.0985","0.0999","","","","","","1.066","","","","has coordinates,has disorder,has Fobs","284691","2023-06-29","15:44:43",""
"2022786","10.793","0.0011","7.2019","0.0007","13.7605","0.0014","90","","100.47","0.0018","90","","1051.79","0.18","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[[quinazolin-4(3<i>H</i>)-one-κ<i>N</i>^3^]cadmium(II)]-di-μ-bromido]","","- C8 H6 Br2 Cd N2 O -","- C8 H6 Br2 Cd N2 O -","- C32 H24 Br8 Cd4 N8 O4 -","4","1","","Turgunov, Kambarali K.; Englert, Ulli","Metal halide coordination compounds with quinazolin-4(3H)-one","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S2056989023004802","","","0.71073","MoKα","","0.0557","0.0387","","","0.0693","0.0758","","","","","","1.037","","","","has coordinates,has Fobs","284692","2023-06-29","15:46:08",""
"2022787","6.8191","0.0008","7.0735","0.0008","10.4659","0.0012","85.718","0.002","80.7887","0.0019","89.152","0.002","496.92","0.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","<i>catena</i>-Poly[[[quinazolin-4(3<i>H</i>)-one-κ<i>N</i>^3^]mercury(II)]-di-μ-chlorido]","","- C8 H6 Cl2 Hg N2 O -","- C8 H6 Cl2 Hg N2 O -","- C16 H12 Cl4 Hg2 N4 O2 -","2","1","","Turgunov, Kambarali K.; Englert, Ulli","Metal halide coordination compounds with quinazolin-4(3H)-one","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S2056989023004802","","","0.71073","MoKα","","0.0393","0.0356","","","0.0734","0.0756","","","","","","1.077","","","","has coordinates,has Fobs","284692","2023-06-29","15:46:18",""
"2022788","22.242","0.003","6.845","0.0009","13.3702","0.0017","90","","118.822","0.0016","90","","1783.4","0.4","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Diiodidobis[quinazolin-4(3<i>H</i>)-one-κ<i>N</i>^3^]cadmium(II)","","- C16 H12 Cd I2 N4 O2 -","- C16 H12 Cd I2 N4 O2 -","- C64 H48 Cd4 I8 N16 O8 -","4","0.5","","Turgunov, Kambarali K.; Englert, Ulli","Metal halide coordination compounds with quinazolin-4(3H)-one","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S2056989023004802","","","0.71073","MoKα","","0.0283","0.0263","","","0.0621","0.0629","","","","","","1.123","","","","has coordinates,has disorder,has Fobs","284692","2023-06-29","15:46:34",""
"2022789","7.88","0.0002","8.1542","0.0002","10.5374","0.0003","95.784","0.002","91.525","0.002","112.472","0.001","620.92","0.03","296","2","296","2","","","","","","","","6","P -1","-P 1","2","Bis(caffeinium) hexachloridoplatinum(IV)","Bis(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1<i>H</i>-purin-9-ium) hexachloridoplatinum(IV)","","- C16 H22 Cl6 N8 O4 Pt -","- C16 H22 Cl6 N8 O4 Pt -","- C16 H22 Cl6 N8 O4 Pt -","1","0.5","ZV2027","Zagidullin, Karim A.; Novikov, Anton P.; Zelenina, Daria A.; Grigoriev, Mikhail S.; German, Konstantin E.","Synthesis, crystal structure and Hirshfeld surface analysis of bis(caffeinium) hexachloridoplatinum(IV) in comparison with some related compounds","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S2056989023005157","","","0.71073","MoKα","","0.0229","0.022","","","0.0412","0.0414","","","","","","1.036","","","","has coordinates,has Fobs","284693","2023-06-29","15:47:25",""
"2022790","31.7847","0.0008","6.0289","0.0001","23.722","0.0006","90","","132.669","0.004","90","","3342.4","0.3","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(<i>E</i>)-1-[1-(4-<i>tert</i>-Butylphenyl)-2,2-dichloroethenyl]-2-phenyldiazene","","- C18 H18 Cl2 N2 -","- C18 H18 Cl2 N2 -","- C144 H144 Cl16 N16 -","8","1","WM5684","Maharramov, Abel; Shikhaliyev, Namiq Q.; Qajar, Ayten; Atakishiyeva, Gulnar T.; Niyazova, Ayten; Khrustalev, Victor N.; Akkurt, Mehmet; Yıldırım, Sema Öztürk; Bhattarai, Ajaya","Crystal structures and Hirshfeld surface analyses of (E)-1-[1-(4-tert-butylphenyl)-2,2-dichloroethenyl]-2-phenyldiazene, (E)-1-[1-(4-tert-butylphenyl)-2,2-dichloroethenyl]-2-(4-methylphenyl)diazene, (E)-1-[1-(4-tert-butylphenyl)-2,2-dichloroethenyl]-2-(4-methoxyphenyl)diazene and (E)-1-[1-(4-tert-butylphenyl)-2,2-dichloroethenyl]-2-(3-methylphenyl)diazene","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S205698902300511X","","","1.54184","CuKα","","0.0406","0.0381","","","0.1021","0.105","","","","","","1.082","","","","has coordinates,has Fobs","284694","2023-06-29","15:48:54",""
"2022791","30.9062","0.0006","6.27248","0.00005","23.3475","0.0004","90","","127.223","0.003","90","","3604.08","0.17","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(<i>E</i>)-1-[1-(4-<i>tert</i>-Butylphenyl)-2,2-dichloroethenyl]-2-\ (4-methylphenyl)diazene","","- C19 H20 Cl2 N2 -","- C19 H20 Cl2 N2 -","- C152 H160 Cl16 N16 -","8","1","WM5684","Maharramov, Abel; Shikhaliyev, Namiq Q.; Qajar, Ayten; Atakishiyeva, Gulnar T.; Niyazova, Ayten; Khrustalev, Victor N.; Akkurt, Mehmet; Yıldırım, Sema Öztürk; Bhattarai, Ajaya","Crystal structures and Hirshfeld surface analyses of (E)-1-[1-(4-tert-butylphenyl)-2,2-dichloroethenyl]-2-phenyldiazene, (E)-1-[1-(4-tert-butylphenyl)-2,2-dichloroethenyl]-2-(4-methylphenyl)diazene, (E)-1-[1-(4-tert-butylphenyl)-2,2-dichloroethenyl]-2-(4-methoxyphenyl)diazene and (E)-1-[1-(4-tert-butylphenyl)-2,2-dichloroethenyl]-2-(3-methylphenyl)diazene","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S205698902300511X","","","1.54184","CuKα","","0.0335","0.0325","","","0.0894","0.0903","","","","","","1.097","","","","has coordinates,has Fobs","284694","2023-06-29","15:48:59",""
"2022792","13.8738","0.0002","12.5946","0.0002","11.3013","0.0001","90","","112.505","0.001","90","","1824.35","0.04","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-1-[1-(4-<i>tert</i>-Butylphenyl)-2,2-dichloroethenyl]-2-(4-methoxyphenyl)diazene","","- C19 H20 Cl2 N2 O -","- C19 H20 Cl2 N2 O -","- C76 H80 Cl8 N8 O4 -","4","1","WM5684","Maharramov, Abel; Shikhaliyev, Namiq Q.; Qajar, Ayten; Atakishiyeva, Gulnar T.; Niyazova, Ayten; Khrustalev, Victor N.; Akkurt, Mehmet; Yıldırım, Sema Öztürk; Bhattarai, Ajaya","Crystal structures and Hirshfeld surface analyses of (E)-1-[1-(4-tert-butylphenyl)-2,2-dichloroethenyl]-2-phenyldiazene, (E)-1-[1-(4-tert-butylphenyl)-2,2-dichloroethenyl]-2-(4-methylphenyl)diazene, (E)-1-[1-(4-tert-butylphenyl)-2,2-dichloroethenyl]-2-(4-methoxyphenyl)diazene and (E)-1-[1-(4-tert-butylphenyl)-2,2-dichloroethenyl]-2-(3-methylphenyl)diazene","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S205698902300511X","","","1.54184","CuKα","","0.0447","0.0429","","","0.1155","0.1179","","","","","","1.058","","","","has coordinates,has Fobs","284694","2023-06-29","15:49:11",""
"2022793","9.8352","0.0002","11.8401","0.0002","16.3964","0.0002","98.397","0.001","96.189","0.001","107.149","0.001","1781.78","0.05","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","(<i>E</i>)-1-[1-(4-<i>tert</i>-Butylphenyl)-2,2-dichloroethenyl]-2-\ (3-methylphenyl)δiazene","","- C19 H20 Cl2 N2 -","- C19 H20 Cl2 N2 -","- C76 H80 Cl8 N8 -","4","2","WM5684","Maharramov, Abel; Shikhaliyev, Namiq Q.; Qajar, Ayten; Atakishiyeva, Gulnar T.; Niyazova, Ayten; Khrustalev, Victor N.; Akkurt, Mehmet; Yıldırım, Sema Öztürk; Bhattarai, Ajaya","Crystal structures and Hirshfeld surface analyses of (E)-1-[1-(4-tert-butylphenyl)-2,2-dichloroethenyl]-2-phenyldiazene, (E)-1-[1-(4-tert-butylphenyl)-2,2-dichloroethenyl]-2-(4-methylphenyl)diazene, (E)-1-[1-(4-tert-butylphenyl)-2,2-dichloroethenyl]-2-(4-methoxyphenyl)diazene and (E)-1-[1-(4-tert-butylphenyl)-2,2-dichloroethenyl]-2-(3-methylphenyl)diazene","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S205698902300511X","","","1.54184","CuKα","","0.0598","0.0577","","","0.1679","0.1707","","","","","","1.041","","","","has coordinates,has Fobs","284694","2023-06-29","15:49:26",""
"2022794","17.1868","0.0013","7.1278","0.0005","11.4447","0.0008","90","","90","","90","","1402.02","0.17","297","2","297.15","","","","","","","","","6","P n m a","-P 2ac 2n","62","","Pentaaqua(3,5-dimethylpyridine-κ<i>N</i>)manganese(II) sulfate","","- C7 H19 Mn N O9 S -","- C7 H19 Mn N O9 S -","- C28 H76 Mn4 N4 O36 S4 -","4","0.5","ZV2026","Golen, James A.; Manke, David R.","3,5-Lutidine pentaaqua sulfate complexes of first-row transition metals: [M(3,5-lutidine)(H2O)5]SO4, with M = Mn, Co, Ni, and Zn","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S2056989023005261","","","0.71073","MoKα","","0.0403","0.0321","","","0.0764","0.0808","","","","","","1.113","","","","has coordinates,has disorder,has Fobs","284695","2023-06-29","15:51:18",""
"2022795","17.1238","0.001","7.1064","0.0004","11.2576","0.0006","90","","90","","90","","1369.92","0.13","297","2","297.15","","","","","","","","","6","P n m a","-P 2ac 2n","62","","Pentaaqua(3,5-dimethylpyridine-κ<i>N</i>)cobalt(II) sulfate","","- C7 H19 Co N O9 S -","- C7 H19 Co N O9 S -","- C28 H76 Co4 N4 O36 S4 -","4","0.5","","Golen, James A.; Manke, David R.","3,5-Lutidine pentaaqua sulfate complexes of first-row transition metals: [M(3,5-lutidine)(H2O)5]SO4, with M = Mn, Co, Ni, and Zn","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S2056989023005261","","","0.71073","MoKα","","0.0349","0.0275","","","0.0654","0.0694","","","","","","1.115","","","","has coordinates,has disorder,has Fobs","284695","2023-06-29","15:51:24",""
"2022796","17.1196","0.0008","7.0609","0.0003","11.2233","0.0005","90","","90","","90","","1356.67","0.1","297","2","297.15","","","","","","","","","6","P n m a","-P 2ac 2n","62","","Pentaaqua(3,5-dimethylpyridine-κ<i>N</i>)nickel(II) sulfate","","- C7 H19 N Ni O9 S -","- C7 H19 N Ni O9 S -","- C28 H76 N4 Ni4 O36 S4 -","4","0.5","","Golen, James A.; Manke, David R.","3,5-Lutidine pentaaqua sulfate complexes of first-row transition metals: [M(3,5-lutidine)(H2O)5]SO4, with M = Mn, Co, Ni, and Zn","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S2056989023005261","","","0.71073","MoKα","","0.0262","0.0228","","","0.0577","0.0595","","","","","","1.102","","","","has coordinates,has disorder,has Fobs","284695","2023-06-29","15:51:36",""
"2022797","17.1312","0.0008","7.0826","0.0003","11.2879","0.0005","90","","90","","90","","1369.6","0.11","297","2","297.15","","","","","","","","","6","P n m a","-P 2ac 2n","62","","Pentaaqua(3,5-dimethylpyridine-κ<i>N</i>)zinc(II) sulfate","","- C7 H19 N O9 S Zn -","- C7 H19 N O9 S Zn -","- C28 H76 N4 O36 S4 Zn4 -","4","0.5","","Golen, James A.; Manke, David R.","3,5-Lutidine pentaaqua sulfate complexes of first-row transition metals: [M(3,5-lutidine)(H2O)5]SO4, with M = Mn, Co, Ni, and Zn","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S2056989023005261","","","0.71073","MoKα","","0.0238","0.0214","","","0.0543","0.0556","","","","","","1.121","","","","has coordinates,has disorder,has Fobs","284695","2023-06-29","15:51:53",""
"2022798","5.5005","0.0002","12.1363","0.0005","26.147","0.001","90","","90","","90","","1745.46","0.12","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(1<i>H</i>-Imidazole-κ<i>N</i>^3^)[<i>N</i>-(2-oxidobenzylidene)tyrosinato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']copper(II)","","- C19 H17 Cu N3 O4 -","- C19 H17 Cu N3 O4 -","- C76 H68 Cu4 N12 O16 -","4","1","EX2071","Suzuki, Soma; Akiyama, Yukihito; Nakane, Daisuke; Akitsu, Takashiro","Crystal structure and Hirshfeld surface analysis of (1H-imidazole-κN 3)[N-(2-oxidobenzylidene)tyrosinato-κ3 O,N,O′]copper(II)","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S2056989023004735","","","0.71073","MoKα","","0.0255","0.025","","","0.0613","0.0617","","","","","","1.056","","","","has coordinates,has Fobs","284696","2023-06-29","15:53:07",""
"2022799","12.8264","0.0003","5.5423","0.0001","17.4082","0.0004","90","","109.522","0.001","90","","1166.37","0.04","90","0.2","90","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","2-Amino-5-chlorobenzophenone oxime","4-Chloro-2-[(hydroxyimino)(phenyl)methyl]aniline","","- C13 H11 Cl N2 O -","- C13 H11 Cl N2 O -","- C52 H44 Cl4 N8 O4 -","4","1","TX2069","Geetha, Doreswamy; Kavitha, Channappa N.; Divakara, Thayamma R.; Basavaraju, Yeriyur B.; Yathirajan, Hemmige S.; Parkin, Sean","Crystal structure and Hirshfeld-surface analysis of a monoclinic polymorph of 2-amino-5-chlorobenzophenone oxime at 90 K","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S2056989023004668","","","0.71073","MoKα","","0.0429","0.0333","","","0.0781","0.0827","","","","","","1.045","","","","has coordinates,has Fobs","284697","2023-06-29","15:54:01",""
"2022800","4.471","0.002","9.032","0.004","21.652","0.011","90","","92.252","0.008","90","","873.7","0.7","297","2","297","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(4-Bromophenyl)but-3-yn-1-one","","- C10 H7 Br O -","- C10 H7 Br O -","- C40 H28 Br4 O4 -","4","1","DX2053","Siddiqui, Shaziyaparveen K.; Ramana, C. V.; Gonnade, Rajesh G.","Crystal structure of 1-(4-bromophenyl)but-3-yn-1-one","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S205698902300508X","","","0.71073","MoKα","","0.0656","0.0482","","","0.1281","0.1401","","","","","","1.022","","","","has coordinates,has Fobs","284700","2023-06-29","15:54:54",""
"2022801","13.9764","0.0007","17.8228","0.0009","23.059","0.0011","90","","90","","90","","5744","0.5","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","(<i>R</i>,<i>R</i>)-4-Bromo-2-{4-[4-bromo-1-(4-toluenesulfonyl)-1<i>H</i>-pyrrol-2-yl]-1,3-dinitrobutan-2-yl}-1-(4-toluenesulfonyl)-1<i>H</i>-pyrrole","","- C26 H24 Br2 N4 O8 S2 -","- C26 H24 Br2 N4 O8 S2 -","- C208 H192 Br16 N32 O64 S16 -","8","1","VM2284","Sample, Harry C.; Twamley, Brendan; Senge, Mathias O.","Structure of (R,R)-4-bromo-2-{4-[4-bromo-1-(4-toluenesulfonyl)-1H-pyrrol-2-yl]-1,3-dinitrobutan-2-yl}-1-(4-toluenesulfonyl)-1H-pyrrole, another ostensible by-product in the synthesis of geminal-dimethyl hydrodipyrrins","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S2056989023004644","","x-ray","1.54178","CuKα","","0.0305","0.0304","","","0.0795","0.0795","","","","","","1.081","","","","has coordinates,has Fobs","284701","2023-06-29","15:55:47",""
"2022802","17.6062","0.0011","9.7588","0.0007","13.1509","0.0009","90","","95.905","0.002","90","","2247.5","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>tert</i>-Butyl 4-[4-(difluoromethoxy)phenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate","","- C24 H29 F2 N O4 -","- C24 H29 F2 N O4 -","- C96 H116 F8 N4 O16 -","4","1","ZN2030","Pehlivanlar, Ezgi; Yıldırım, Sema Öztürk; Şimşek, Rahime; Akkurt, Mehmet; Butcher, Ray J.; Bhattarai, Ajaya","Synthesis, crystal structure and Hirshfeld surface analysis of tert-butyl 4-[4-(difluoromethoxy)phenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","664","668","10.1107/S2056989023005455","","","0.71073","MoKα","","0.0821","0.0458","","","0.096","0.1102","","","","","","1.017","","","","has coordinates,has Fobs","284739","2023-07-01","01:49:18",""
"2022803","6.5394","0.0011","8.9611","0.0015","10.202","0.0015","67.965","0.005","79.666","0.006","70.349","0.006","520.92","0.15","296","2","296","2","","","","","","","","6","P -1","-P 1","2","Bis({<i>N</i>'-[(<i>Z</i>)-(furan-2-ylmethylidene)amino]carbamimidoyl}sulfanido)nickel(II) methanol disolvate","Bis{(<i>Z</i>)-<i>N</i>'-[(<i>E</i>)-(furan-2-yl)methylidene]carbamohydrazonothioato}nickel(II) methanol disolvate","","- C14 H20 N6 Ni O4 S2 -","- C14 H20 N6 Ni O4 S2 -","- C14 H20 N6 Ni O4 S2 -","1","0.5","JY2031","Azizova, Asmet N.; Mammadova, Gunay Z.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Bhattarai, Ajaya","Crystal structure and Hirshfeld surface analysis of bis{(Z)-N′-[(E)-(furan-2-yl)methylidene]carbamohydrazonothioato}nickel(II) methanol disolvate","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","669","673","10.1107/S2056989023005182","","","0.71073","MoKα","","0.0475","0.0318","","","0.0815","0.0875","","","","","","1.035","","","","has coordinates,has Fobs","284740","2023-07-01","01:49:36",""
"2022804","3.7749","0.0002","7.3711","0.0005","14.4524","0.0009","90","","91.096","0.002","90","","402.07","0.04","125","2","125","2","","","","","","","","4","P 1 21 1","P 2yb","4","","4-(1<i>H</i>-Imidazol-1-yl)benzaldehyde","","- C10 H8 N2 O -","- C10 H8 N2 O -","- C20 H16 N4 O2 -","2","1","JY2032","McClements, Isobelle F.; Wiesler, Clara R.; Tanski, Joseph M.","Crystallographic and spectroscopic characterization of two 1-phenyl-1H-imidazoles: 4-(1H-imidazol-1-yl)benzaldehyde and 1-(4-methoxyphenyl)-1H-imidazole","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","678","681","10.1107/S2056989023005480","","x-ray","1.54178","CuKα","","0.0273","0.0271","","","0.0788","0.079","","","","","","1.139","","","","has coordinates,has Fobs","284741","2023-07-01","01:50:09",""
"2022805","8.5663","0.0012","11.2143","0.0016","9.1635","0.0013","90","","94.448","0.002","90","","877.6","0.2","125","2","125","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-Methoxyphenyl)-1<i>H</i>-imidazole","","- C10 H10 N2 O -","- C10 H10 N2 O -","- C40 H40 N8 O4 -","4","1","JY2032","McClements, Isobelle F.; Wiesler, Clara R.; Tanski, Joseph M.","Crystallographic and spectroscopic characterization of two 1-phenyl-1H-imidazoles: 4-(1H-imidazol-1-yl)benzaldehyde and 1-(4-methoxyphenyl)-1H-imidazole","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","678","681","10.1107/S2056989023005480","","x-ray","0.71073","MoKα","","0.0459","0.0403","","","0.1119","0.1185","","","","","","1.037","","","","has coordinates,has Fobs","284741","2023-07-01","01:50:09",""
"2022806","5.8655","0.0005","14.3499","0.0017","16.4803","0.0019","90","","90","","90","","1387.1","0.3","200","2","200","2","","","","","","","","4","P n a 21","P 2c -2n","33","","(<i>E</i>)-3-(4-Chlorophenyl)-1-(2,3-dihydrobenzo[<i>b</i>][1,4]dioxin-6-yl)prop-2-en-1-one","","- C17 H13 Cl O3 -","- C17 H13 Cl O3 -","- C68 H52 Cl4 O12 -","4","1","VM2285","Vinaya,; Richard, Austin S.; Murthy, Subbiah M.; Basavaraju, Yeriyur B.; Yathirajan, Hemmige S.; Parkin, Sean","The synthesis, crystal structure and spectroscopic analysis of (E)-3-(4-chlorophenyl)-1-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)prop-2-en-1-one","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","674","677","10.1107/S2056989023005613","","","0.71073","MoKα","","0.0371","0.0334","","","0.0806","0.0827","","","","","","1.065","","","","has coordinates,has Fobs","284742","2023-07-01","01:50:38",""
"2022807","11.7044","0.0017","7.8531","0.001","38.253","0.005","90","","90","","90","","3516.1","0.8","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","<i>N</i>'-[(2-methylphenyl)methylidene]pyridine-4-carbohydrazide; benzoic acid","","- C20 H17 N3 O3 -","- C20 H17 N3 O3 -","- C160 H136 N24 O24 -","8","1","EX2072","Setshedi, Itumeleng B.; Lemmerer, Andreas; Smith, Mark G.","Co-crystallization of N′-benzylidenepyridine-4-carbohydrazide and benzoic acid via autoxidation of benzaldehyde","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","","","10.1107/S2056989023005698","","x-ray","0.71073","MoKα","","0.0584","0.0537","","","0.1102","0.1123","","","","","","1.177","","","","has coordinates,has Fobs","284812","2023-07-05","02:14:41",""
"2022808","9.5219","0.0002","10.101","0.0002","30.705","0.0008","90","","96.666","0.001","90","","2933.26","0.11","302","2","302","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Naphthalene-2,3-diyl bis(3-benzyloxy)benzoate","","- C38 H28 O6 -","- C38 H28 O6 -","- C152 H112 O24 -","4","1","HB8069","Anil Kumar, H.; Selvanandan, S.; Srinivasa, H. T.; Venkateshappa, G.; Palakshamurthy, B. S.","Synthesis, crystal structure and Hirshfeld surface analysis of naphthalene-2,3-diyl bis(3-benzyloxy)benzoate","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","","","10.1107/S2056989023005571","","","1.54178","CuKα","","0.0459","0.0418","","","0.1373","0.1419","","","","","","1.058","","","","has coordinates,has Fobs","284813","2023-07-05","02:15:18",""
"2022809","7.9009","0.0004","10.3466","0.0006","9.4948","0.0005","90","","107.703","0.002","90","","739.42","0.07","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>N</i>,<i>N</i>-Dimethylacetamide–1-(dimethyl-λ^4^-azanylidene)ethan-1-ol tribromide (1/1)","","- C8 H19 Br3 N2 O2 -","- C8 H19 Br3 N2 O2 -","- C16 H38 Br6 N4 O4 -","2","0.5","YZ2034","Mammadova, Gunay Z.; Mertsalov, Dmitriy F.; Shchevnikov, Dmitriy M.; Grigoriev, Mikhail S.; Akkurt, Mehmet; Yıldırım, Sema Öztürk; Bhattarai, Ajaya","Crystal structures and Hirshfeld surface analyses of N,N-dimethylacetamide–1-(dimethyl-λ4-azanylidene)ethan-1-ol tribromide (1/1), N,N-dimethylacetamide–1-(dimethyl-λ4-azanylidene)ethan-1-ol dibromidoiodate (1/1) and N,N-dimethylacetamide–1-(dimethyl-λ4-azanylidene)ethan-1-ol dichloridoiodate (1/1)","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","","","10.1107/S2056989023005509","","","0.71073","MoKα","","0.0429","0.0247","","","0.0511","0.0555","","","","","","1.013","","","","has coordinates,has Fobs","284814","2023-07-05","02:16:26",""
"2022810","7.2943","0.0003","7.9544","0.0004","13.6097","0.0007","90.645","0.002","103.651","0.002","93.656","0.002","765.51","0.06","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","<i>N</i>,<i>N</i>-Dimethylacetamide–1-(dimethyl-λ^4^-azanylidene)ethan-1-ol dibromidoiodate (1/1)","","- C8 H19 Br2 I N2 O2 -","- C8 H19 Br2 I N2 O2 -","- C16 H38 Br4 I2 N4 O4 -","2","1","YZ2034","Mammadova, Gunay Z.; Mertsalov, Dmitriy F.; Shchevnikov, Dmitriy M.; Grigoriev, Mikhail S.; Akkurt, Mehmet; Yıldırım, Sema Öztürk; Bhattarai, Ajaya","Crystal structures and Hirshfeld surface analyses of N,N-dimethylacetamide–1-(dimethyl-λ4-azanylidene)ethan-1-ol tribromide (1/1), N,N-dimethylacetamide–1-(dimethyl-λ4-azanylidene)ethan-1-ol dibromidoiodate (1/1) and N,N-dimethylacetamide–1-(dimethyl-λ4-azanylidene)ethan-1-ol dichloridoiodate (1/1)","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","","","10.1107/S2056989023005509","","","0.71073","MoKα","","0.0298","0.019","","","0.0351","0.0376","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","284814","2023-07-05","02:16:26",""
"2022811","10.5264","0.0003","6.7261","0.0002","10.8124","0.0003","90","","105.95","0.001","90","","736.06","0.04","100","2","100","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","<i>N</i>,<i>N</i>-Dimethylacetamide–1-(dimethyl-λ^4^-azanylidene)ethan-1-ol dichloridoiodate (1/1)","","- C8 H19 Cl2 I N2 O2 -","- C8 H19 Cl2 I N2 O2 -","- C16 H38 Cl4 I2 N4 O4 -","2","0.25","YZ2034","Mammadova, Gunay Z.; Mertsalov, Dmitriy F.; Shchevnikov, Dmitriy M.; Grigoriev, Mikhail S.; Akkurt, Mehmet; Yıldırım, Sema Öztürk; Bhattarai, Ajaya","Crystal structures and Hirshfeld surface analyses of N,N-dimethylacetamide–1-(dimethyl-λ4-azanylidene)ethan-1-ol tribromide (1/1), N,N-dimethylacetamide–1-(dimethyl-λ4-azanylidene)ethan-1-ol dibromidoiodate (1/1) and N,N-dimethylacetamide–1-(dimethyl-λ4-azanylidene)ethan-1-ol dichloridoiodate (1/1)","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","","","10.1107/S2056989023005509","","","0.71073","MoKα","","0.0078","0.0078","","","0.0216","0.0216","","","","","","1.064","","","","has coordinates,has Fobs","284814","2023-07-05","02:16:27",""
"2022812","11.7356","0.0014","9.2401","0.0008","11.397","0.0014","90","","113.148","0.014","90","","1136.4","0.2","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-[(Benzylamino)methylidene]pentane-2,4-dione","","- C13 H15 N O2 -","- C13 H15 N O2 -","- C52 H60 N4 O8 -","4","1","WM5685","Halz, Jan Henrik; Hentsch, Andreas; Wagner, Christoph; Merzweiler, Kurt","Synthesis and crystal structures of three Schiff bases derived from 3-formylacetylacetone and benzyl-, tert-butyl- and (S)-methylbenzylamine","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","","","10.1107/S205698902300587X","","","0.71073","MoKα","","0.0746","0.041","","","0.0871","0.0969","","","","","","0.94","","","","has coordinates,has Fobs","285170","2023-07-12","02:08:11",""
"2022813","9.8226","0.0007","9.8323","0.0006","11.27","0.0008","90","","108.171","0.005","90","","1034.16","0.13","170","2","170","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-[(<i>tert</i>-Butylamino)methylidene]pentan-2,4-dione","","- C10 H17 N O2 -","- C10 H17 N O2 -","- C40 H68 N4 O8 -","4","1","WM5685","Halz, Jan Henrik; Hentsch, Andreas; Wagner, Christoph; Merzweiler, Kurt","Synthesis and crystal structures of three Schiff bases derived from 3-formylacetylacetone and benzyl-, tert-butyl- and (S)-methylbenzylamine","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","","","10.1107/S205698902300587X","","","0.71073","MoKα","","0.052","0.0361","","","0.0963","0.1041","","","","","","1.029","","","","has coordinates,has Fobs","285170","2023-07-12","02:08:12",""
"2022814","10.0459","0.0009","8.1011","0.0005","15.7052","0.0013","90","","103.372","0.007","90","","1243.48","0.17","170","2","170","2","","","","","","","","4","P 1 21 1","P 2yb","4","","3-{[(<i>S</i>)-Benzyl(methyl)amino]methylidene}pentane-2,4-dione","","- C14 H17 N O2 -","- C14 H17 N O2 -","- C56 H68 N4 O8 -","4","2","WM5685","Halz, Jan Henrik; Hentsch, Andreas; Wagner, Christoph; Merzweiler, Kurt","Synthesis and crystal structures of three Schiff bases derived from 3-formylacetylacetone and benzyl-, tert-butyl- and (S)-methylbenzylamine","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","","","10.1107/S205698902300587X","","","0.71073","MoKα","","0.0661","0.0482","","","0.1157","0.1305","","","","","","1.053","","","","has coordinates,has Fobs","285170","2023-07-12","02:08:12",""
"2022815","15.5444","0.0006","5.5388","0.0003","20.1592","0.0008","90","","103.675","0.007","90","","1686.45","0.14","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis{<i>S</i>-octyl-3-[(thiophen-2-yl)methylidene]dithiocarbazato-κ^2^<i>N</i>^3^,<i>S</i>}nickel(II)","","- C28 H42 N4 Ni S6 -","- C28 H42 N4 Ni S6 -","- C56 H84 N8 Ni2 S12 -","2","0.5","PK2690","Khan, Sultana Shakila; Howlader, Md. Belayet Hossain; Sheikh, Md. Chanmiya; Miyatake, Ryuta; Zangrando, Ennio","Crystal structure of bis{S-octyl-3-[(thiophen-2-yl)methylidene]dithiocarbazato-κ2 N 3,S}nickel(II)","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","","","10.1107/S2056989023005935","","","0.71075","MoKα","","0.0832","0.0446","","","0.0703","0.0787","","","","","","0.999","","","","has coordinates,has Fobs","285171","2023-07-12","02:08:50",""
"2022816","6.2568","0.0005","11.7542","0.0014","16.9162","0.0019","85.329","0.003","79.534","0.004","87.785","0.003","1219","0.2","90","0.2","90","0.2","","","","","","","","4","P -1","-P 1","2","Trihexyphenidylium 4-nitrobenzoate","1-(3-Cyclohexyl-3-hydroxy-3-phenylpropyl)piperidin-1-ium 4-nitrobenzoate","","- C27 H36 N2 O5 -","- C27 H36 N2 O5 -","- C54 H72 N4 O10 -","2","1","VM2286","Vinaya,; Basavaraju, Yeriyur B.; Yathirajan, Hemmige S.; Parkin, Sean","Crystal structures of four organic salts of trihexyphenidyl at 90 K","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","","","10.1107/S2056989023005960","","","0.71073","MoKα","","0.0555","0.0465","","","0.1028","0.1074","","","","","","1.114","","","","has coordinates,has disorder,has Fobs","285218","2023-07-15","01:47:16",""
"2022817","45.098","0.002","8.5314","0.0005","12.3516","0.0006","90","","101.789","0.002","90","","4652","0.4","90","0.2","90","0.2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Trihexyphenidylium 4-hydroxybenzoate","1-(3-Cyclohexyl-3-hydroxy-3-phenylpropyl)piperidin-1-ium 4-hydroxybenzoate","","- C27 H37 N O4 -","- C27 H37 N O4 -","- C216 H296 N8 O32 -","8","1","VM2286","Vinaya,; Basavaraju, Yeriyur B.; Yathirajan, Hemmige S.; Parkin, Sean","Crystal structures of four organic salts of trihexyphenidyl at 90 K","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","","","10.1107/S2056989023005960","","","0.71073","MoKα","","0.0531","0.0414","","","0.0855","0.09","","","","","","1.03","","","","has coordinates,has Fobs","285218","2023-07-15","01:47:17",""
"2022818","6.2422","0.0004","17.8126","0.0014","21.9938","0.0019","90","","97.345","0.003","90","","2425.4","0.3","90","0.2","90","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Trihexyphenidylium 4-bromobenzoate","1-(3-Cyclohexyl-3-hydroxy-3-phenylpropyl)piperidin-1-ium 4-bromobenzoate","","- C27 H36 Br N O3 -","- C27 H36 Br N O3 -","- C108 H144 Br4 N4 O12 -","4","1","VM2286","Vinaya,; Basavaraju, Yeriyur B.; Yathirajan, Hemmige S.; Parkin, Sean","Crystal structures of four organic salts of trihexyphenidyl at 90 K","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","","","10.1107/S2056989023005960","","","0.71073","MoKα","","0.0482","0.0367","","","0.0712","0.0737","","","","","","1.13","","","","has coordinates,has disorder,has Fobs","285218","2023-07-15","01:47:17",""
"2022819","6.2765","0.0003","18.539","0.0013","20.6383","0.0014","89.71","0.002","81.6","0.002","88.977","0.002","2375.3","0.3","90","0.2","90","0.2","","","","","","","","5","P -1","-P 1","2","Trihexyphenidylium thiophene-2-carboxylate hemihydrate","1-(3-Cyclohexyl-3-hydroxy-3-phenylpropyl)piperidin-1-ium thiophene-2-carboxylate hemihydrate","","- C50 H72 N2 O7 S2 -","- C50 H72 N2 O7 S2 -","- C100 H144 N4 O14 S4 -","2","1","VM2286","Vinaya,; Basavaraju, Yeriyur B.; Yathirajan, Hemmige S.; Parkin, Sean","Crystal structures of four organic salts of trihexyphenidyl at 90 K","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","","","10.1107/S2056989023005960","","","0.71073","MoKα","","0.0617","0.0421","","","0.091","0.1014","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","285218","2023-07-15","01:47:17",""
"2022820","7.185","0.0006","18.1117","0.0014","10.5206","0.0008","90","","93.579","0.002","90","","1366.4","0.19","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Hexapotassium tetracarbonatozincate(II)","","- C4 K6 O12 Zn -","- C4 K6 O12 Zn -","- C16 K24 O48 Zn4 -","4","0.5","PK2691","Eder, Felix; Weil, Matthias","Crystal structure of K6[Zn(CO3)4]","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","","","10.1107/S2056989023006072","","","0.71073","MoKα","","0.0838","0.0402","","","0.0612","0.0715","","","","","","0.981","","","","has coordinates,has Fobs","285219","2023-07-15","01:47:55",""
"2022821","5.84787","0.00005","12.18109","0.00009","16.24568","0.00015","90","","90","","90","","1157.24","0.017","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(<i>E</i>)-1-(2,4-Dimethylfuran-3-yl)-3-phenylprop-2-en-1-one","","- C15 H14 O2 -","- C15 H14 O2 -","- C60 H56 O8 -","4","1","VM2287","Khalilov, Ali N.; Khrustalev, Victor N.; Samigullina, Aida I.; Akkurt, Mehmet; Rzayev, Rovnag M.; Bhattarai, Ajaya; Mamedov, İbrahim G.","Crystal structure and Hirshfeld surface analysis of (E)-1-(2,4-dimethylfuran-3-yl)-3-phenylprop-2-en-1-one","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","","","10.1107/S2056989023006084","","","1.54184","CuKα","","0.0302","0.0299","","","0.0802","0.0806","","","","","","1.058","","","","has coordinates,has Fobs","285220","2023-07-15","01:48:24",""
"2022822","10.4951","0.0004","14.1401","0.0005","16.9249","0.0006","90","","106.378","0.008","90","","2409.77","0.18","173","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[(acetonitrile-κ<i>N</i>)(μ~3~-7-{[bis(pyridin-2-ylmethyl)amino]methyl}-8-hydroxyquinoline-5-sulfonato-κ^4^<i>N</i>,<i>O</i>:<i>O</i>':<i>O</i>'')sodium]","","- C24 H22 N5 Na O4 S -","- C24 H22 N5 Na O4 S -","- C96 H88 N20 Na4 O16 S4 -","4","1","YZ2037","Kubono, Koji; Tanaka, Ryoichi; Kashiwagi, Yukiyasu; Tani, Keita; Yokoi, Kunihiko","Crystal structure of poly[(acetonitrile-κN)(μ3-7-{[bis(pyridin-2-ylmethyl)amino]methyl}-8-hydroxyquinoline-5-sulfonato-κ4 N,O:O′:O′′)sodium]","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","","","10.1107/S2056989023005959","","","0.71075","MoKα","","0.0706","0.0435","","","0.0932","0.1028","","","","","","1.014","","","","has coordinates,has Fobs","285221","2023-07-15","01:48:47",""
"2022823","7.9588","0.0001","25.984","0.0004","9.5178","0.0002","90","","96.853","0.001","90","","1954.23","0.06","297","2","297","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-<i>N</i>-{2-[2-(Benzo[<i>b</i>]thiophen-2-yl)ethenyl]-5-fluorophenyl}benzenesulfonamide","","- C22 H16 F N O2 S2 -","- C22 H16 F N O2 S2 -","- C88 H64 F4 N4 O8 S8 -","4","1","ZN2029","Madhan, S.; NizamMohideen, M.; Pavunkumar, Vinayagam; MohanaKrishnan, Arasambattu K.","Crystal-structure determination and Hirshfeld surface analysis of two new thiophene derivatives: (E)-N-{2-[2-(benzo[b]thiophen-2-yl)ethenyl]-5-fluorophenyl}benzenesulfonamide and (E)-N-{2-[2-(benzo[b]thiophen-2-yl)ethenyl]-5-fluorophenyl}-N-(but-2-yn-1-yl)benzenesulfonamide","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","","","10.1107/S2056989023006096","","","1.54178","CuKα","","0.0525","0.0415","","","0.1032","0.1152","","","","","","1.032","","","","has coordinates,has disorder,has Fobs","285320","2023-07-22","01:59:03",""
"2022824","9.3517","0.0003","31.7075","0.0011","8.6063","0.0003","90","","115.179","0.002","90","","2309.45","0.14","297","2","297","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-<i>N</i>-{2-[2-(Benzo[<i>b</i>]thiophen-2-yl)ethenyl]-5-fluorophenyl}-<i>N</i>-(but-2-yn-1-yl)benzenesulfonamide","","- C26 H20 F N O2 S2 -","- C26 H20 F N O2 S2 -","- C104 H80 F4 N4 O8 S8 -","4","1","ZN2029","Madhan, S.; NizamMohideen, M.; Pavunkumar, Vinayagam; MohanaKrishnan, Arasambattu K.","Crystal-structure determination and Hirshfeld surface analysis of two new thiophene derivatives: (E)-N-{2-[2-(benzo[b]thiophen-2-yl)ethenyl]-5-fluorophenyl}benzenesulfonamide and (E)-N-{2-[2-(benzo[b]thiophen-2-yl)ethenyl]-5-fluorophenyl}-N-(but-2-yn-1-yl)benzenesulfonamide","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","","","10.1107/S2056989023006096","","","1.54178","CuKα","","0.1353","0.0659","","","0.1661","0.2324","","","","","","0.998","","","","has coordinates,has Fobs","285320","2023-07-22","01:59:04",""
"2022825","7.4542","0.0001","9.5111","0.0002","16.4378","0.0003","88.838","0.004","81.644","0.001","81.414","0.001","1140.11","0.04","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","4-Cyano-<i>N</i>-[(4-cyanophenyl)sulfonyl]-<i>N</i>-[2-(5-methylfuran-2-yl)phenyl]benzenesulfonamide","","- C25 H17 N3 O5 S2 -","- C25 H17 N3 O5 S2 -","- C50 H34 N6 O10 S4 -","2","1","TX2071","Mammadova, Gunay Z.; Yakovleva, Elizaveta D.; Burkin, Gleb M.; Khrustalev, Victor N.; Akkurt, Mehmet; Çelikesir, Sevim Türktekin; Bhattarai, Ajaya","Crystal structure and Hirshfeld surface analysis of 4-cyano-N-[(4-cyanophenyl)sulfonyl]-N-[2-(5-methylfuran-2-yl)phenyl]benzenesulfonamide","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","","","10.1107/S2056989023006254","","","1.54184","CuKα","","0.0362","0.0355","","","0.0943","0.0949","","","","","","1.076","","","","has coordinates,has Fobs","285321","2023-07-22","01:59:32",""
"2022826","8.5446","0.0006","10.399","0.0007","8.6149","0.0006","90","","116.784","0.002","90","","683.35","0.08","297","2","297.15","","","","","","","","","3","P 1 21 1","P 2yb","4","<i>N</i>-Cyclohexyltryptamine","<i>N</i>-[2-(1<i>H</i>-Indol-3-yl)ethyl]cyclohexanamine","","- C16 H22 N2 -","- C16 H22 N2 -","- C32 H44 N4 -","2","1","TX2070","Naeem, Marilyn; Le, Alexander N.; Bauer, Barbara E.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.","N-Cyclohexyltryptamine: freebase, bromide and fumarate","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","752","756","10.1107/S2056989023006217","","","0.71073","MoKα","","0.053","0.0476","","","0.1185","0.1237","","","","","","1.04","","","","has coordinates,has Fobs","285384","2023-07-29","02:02:24",""
"2022827","10.5584","0.0006","7.9266","0.0005","19.4507","0.0013","90","","92.406","0.002","90","","1626.44","0.18","297","2","297.15","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","<i>N</i>-Cyclohexyltryptammonium bromide","<i>N</i>-[2-(1<i>H</i>-Indol-3-yl)ethyl]cyclohexanaminium bromide","","- C16 H23 Br N2 -","- C16 H23 Br N2 -","- C64 H92 Br4 N8 -","4","1","","Naeem, Marilyn; Le, Alexander N.; Bauer, Barbara E.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.","N-Cyclohexyltryptamine: freebase, bromide and fumarate","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","752","756","10.1107/S2056989023006217","","","0.71073","MoKα","","0.0493","0.0445","","","0.107","0.1087","","","","","","1.224","","","","has coordinates,has Fobs","285384","2023-07-29","02:02:34",""
"2022828","9.2231","0.001","16.1611","0.0016","11.4595","0.0012","90","","99.865","0.004","90","","1682.8","0.3","297","2","297.15","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","<i>N</i>-Cyclohexyltryptammonium fumarate","Bis{<i>N</i>-[2-(1<i>H</i>-indol-3-yl)ethyl]cyclohexanaminium} (2<i>E</i>)-but-2-enedioate","","- C18 H24 N2 O2 -","- C18 H24 N2 O2 -","- C72 H96 N8 O8 -","4","1","","Naeem, Marilyn; Le, Alexander N.; Bauer, Barbara E.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.","N-Cyclohexyltryptamine: freebase, bromide and fumarate","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","752","756","10.1107/S2056989023006217","","","0.71073","MoKα","","0.0546","0.0426","","","0.1112","0.1214","","","","","","1.028","","","","has coordinates,has Fobs","285384","2023-07-29","02:02:34",""
"2022829","4.6034","0.0002","15.1542","0.0007","24.1754","0.0009","90","","90","","90","","1686.5","0.12","293","2","293","2","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","","(<i>E</i>,<i>E</i>)-1,3-(3,4:9,10-Dibenzododeca-1,11-diene-5,7-diyne-1,12-\ diyl)benzene","","- C26 H16 -","- C26 H16 -","- C104 H64 -","4","1","PK2689","Watanabe, Hikaru; Sato, Takuma; Sumita, Michiki; Shiroyama, Mei; Sugawara, Daichi; Tokuyama, Tomoki; Okuda, Yasuhiro; Wakamatsu, Kan; Akashi, Haruo; Orita, Akihiro","Synthesis, optical properties and crystal structure of (E,E)-1,3-(3,4:9,10-dibenzododeca-1,11-diene-5,7-diyne-1,12-diyl)benzene","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","757","761","10.1107/S2056989023006187","","x-ray","0.71073","MoKα","","0.0839","0.0578","","","0.1057","0.1149","","","","","","1.03","","","","has coordinates,has Fobs","285385","2023-07-29","02:03:19",""
"2022830","4.4717","0.0001","11.9367","0.0002","20.1382","0.0003","90","","95.689","0.002","90","","1069.63","0.03","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","<i>N</i>'-[(1<i>E</i>)-(4-Chloro-3-nitrophenyl)methylidene]acetohydrazide","(<i>E</i>)-<i>N</i>'-(4-Chloro-3-nitrobenzylidene)acetohydrazide","","- C9 H8 Cl N3 O3 -","- C9 H8 Cl N3 O3 -","- C36 H32 Cl4 N12 O12 -","4","1","JQ2029","Nasr, Tamer; Kariuki, Benson M.; Elansary, Mai M.; Elhaggar, Radwan; Zaghary, Wafaa","Synthesis and crystal structures of (E)-N′-(4-chloro-3-nitrobenzylidene)acetohydrazide and (E)-2-(4-chlorobenzylidene)-1-(quinolin-8-yl)hydrazine","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","762","766","10.1107/S2056989023006412","","","1.54184","CuKα","","0.0403","0.0383","","","0.1083","0.1111","","","","","","1.084","","","","has coordinates,has disorder,has Fobs","285386","2023-07-29","02:03:56",""
"2022831","7.7968","0.0003","12.0926","0.0004","14.8738","0.0005","90","","100.601","0.003","90","","1378.42","0.08","296","2","296","2","","","","","","","","4","P 1 n 1","P -2yac","7","8-{(<i>E</i>)-2-[(4-Chlorophenyl)methylidene]hydrazin-1-yl}quinoline","(<i>E</i>)-2-(4-Chlorobenzylidene)-1-(quinolin-8-yl)hydrazine","","- C16 H12 Cl N3 -","- C16 H12 Cl N3 -","- C64 H48 Cl4 N12 -","4","2","JQ2029","Nasr, Tamer; Kariuki, Benson M.; Elansary, Mai M.; Elhaggar, Radwan; Zaghary, Wafaa","Synthesis and crystal structures of (E)-N′-(4-chloro-3-nitrobenzylidene)acetohydrazide and (E)-2-(4-chlorobenzylidene)-1-(quinolin-8-yl)hydrazine","Acta Crystallographica Section E Crystallographic Communications","2023","79","8","762","766","10.1107/S2056989023006412","","","1.54184","CuKα","","0.0344","0.0314","","","0.0809","0.0847","","","","","","1.039","","","","has coordinates,has Fobs","285386","2023-07-29","02:03:56",""
"2022833","12.6692","0.0004","7.0967","0.0003","22.3413","0.0009","90","","103.022","0.004","90","","1957.04","0.13","100","0.1","100.15","","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","(Carboxymethyl)triethylazanium bromide–2-(triethylazaniumyl)acetate (1/1)","","- C16 H35 Br N2 O4 -","- C16 H35 Br N2 O4 -","- C64 H140 Br4 N8 O16 -","4","0.5","WM5689","Carlson, Faith M.; Staples, Richard J.; Biros, Shannon M.","Crystal structure of a (carboxymethyl)triethylazanium bromide–2-(triethylazaniumyl)acetate (1/1) hydrogen-bonded dimer","Acta Crystallographica Section E Crystallographic Communications","2023","79","9","","","10.1107/S2056989023006850","","","1.54184","CuKα","","0.0447","0.0396","","","0.1042","0.1086","","","","","","1.075","","","","has coordinates,has disorder,has Fobs","285640","2023-08-12","01:54:29",""
"2022837","16.754","0.003","7.0021","0.0012","22.103","0.004","90","","106.522","0.006","90","","2485.9","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aqua(2,2'-bipyridineκ^2^<i>N</i>,<i>N</i>')bis(3-methylbenzoato)-κ^2^<i>O</i>,<i>O</i>';κ<i>O</i>-copper(II) 0.68-hydrate,","","- C26 H25.36 Cu N2 O5.68 -","- C26 H25.36 Cu N2 O5.68 -","- C104 H101.44 Cu4 N8 O22.72 -","4","1","DJ2063","Qadir, Adnan","Synthesis, crystal structure and Hirshfeld surface analysis of a copper(II) complex involving 3-methylbenzoate and 2,2′-bipyridine ligands","Acta Crystallographica Section E Crystallographic Communications","2023","79","9","","","10.1107/S2056989023006904","","","0.71073","MoKα","","0.0604","0.0419","","","0.094","0.1056","","","","","","1.094","","","","has coordinates,has disorder,has Fobs","285785","2023-08-16","01:52:54",""
"2022838","6.3279","0.0004","7.7816","0.0006","14.1342","0.001","77.191","0.003","83.66","0.003","67.86","0.002","628.35","0.08","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","2-Amino-5-{(1<i>E</i>)-1-[(carbamothioylamino)imino]ethyl}-4-methyl-1,3-thiazol-3-ium chloride monohydrate","","- C7 H14 Cl N5 O S2 -","- C7 H14 Cl N5 O S2 -","- C14 H28 Cl2 N10 O2 S4 -","2","1","WM5691","Huseynov, Elnur Z.; Akkurt, Mehmet; Brito, Ivan; Bhattarai, Ajaya; Naghiyev, Farid N.; Asadov, Khammed A.; Maharramov, Abel M.","Crystal structure and Hirshfeld surface analysis of 2-amino-5-{(1E)-1-[(carbamothioylamino)imino]ethyl}-4-methyl-1,3-thiazol-3-ium chloride monohydrate","Acta Crystallographica Section E Crystallographic Communications","2023","79","9","","","10.1107/S2056989023007090","","","0.71073","MoKα","","0.0524","0.0357","","","0.1016","0.1146","","","","","","1.046","","","","has coordinates,has Fobs","285800","2023-08-17","01:47:37",""
"2022839","10.0987","0.0003","12.2744","0.0004","12.4842","0.0005","99.448","0.003","110.701","0.003","100.696","0.003","1377.27","0.09","100.01","0.1","100.01","0.1","","","","","","","","7","P -1","-P 1","2","","3-(Bromomethyl)-2-[1,2-dibromo-2-(6-nitrobenzo[<i>d</i>][1,3]dioxol-5-yl)ethyl]-1-(phenylsulfonyl)-1<i>H</i>-indole chloroform 0.585-solvate","","- C24.58 H17.58 Br3 Cl1.75 N2 O6 S -","- C24.585 H17.585 Br3 Cl1.755 N2 O6 S -","- C49.17 H35.17 Br6 Cl3.51 N4 O12 S2 -","2","1","HB8071","Achyuta, Nagaraj; Kanagasabai, Somarathinam; Vinayagam, Pavunkumar; Mohanakrishnan, Arasambattu K.; Gautham, Namasivayam; Gunasekaran, Krishnasamy","Crystal structure and Hirshfeld surface analysis of 3-(bromomethyl)-2-[1,2-dibromo-2-(6-nitrobenzo[d][1,3]dioxol-5-yl)ethyl]-1-(phenylsulfonyl)-1H-indole chloroform 0.585-solvate","Acta Crystallographica Section E Crystallographic Communications","2023","79","9","","","10.1107/S2056989023007120","","x-ray","1.54184","CuKα","","0.0493","0.0437","","","0.1271","0.1336","","","","","","1.07","","","","has coordinates,has Fobs","285801","2023-08-17","01:48:36",""
"2022840","16.0139","0.0008","8.2743","0.0004","8.5596","0.0004","90","","96.484","0.001","90","","1126.92","0.09","125","2","125","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-Methoxy-3,4,5,6-tetrahydro-1<i>H</i>-benzo[<i>b</i>]azonine-2,7-dione","","- C13 H15 N O3 -","- C13 H15 N O3 -","- C52 H60 N4 O12 -","4","1","DX2054","Flores, Maritza J.; Mai, Brandon; Tanski, Joseph M.","Spectroscopic, crystallographic, and Hirshfeld surface characterization of nine-membered-ring-containing 9-methoxy-3,4,5,6-tetrahydro-1H-benzo[b]azonine-2,7-dione and its parent tetrahydrocarbazole","Acta Crystallographica Section E Crystallographic Communications","2023","79","9","","","10.1107/S2056989023007259","","x-ray","0.71073","MoKα","","0.0559","0.0401","","","0.0997","0.1099","","","","","","1.044","","","","has coordinates,has Fobs","285854","2023-08-24","01:43:33",""
"2022841","20.513","0.002","5.6374","0.0006","18.783","0.002","90","","100.757","0.002","90","","2133.9","0.4","125","2","125","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","6-Methoxy-1,2,3,4-tetrahydrocarbazole","","- C13 H15 N O -","- C13 H15 N O -","- C104 H120 N8 O8 -","8","1","DX2054","Flores, Maritza J.; Mai, Brandon; Tanski, Joseph M.","Spectroscopic, crystallographic, and Hirshfeld surface characterization of nine-membered-ring-containing 9-methoxy-3,4,5,6-tetrahydro-1H-benzo[b]azonine-2,7-dione and its parent tetrahydrocarbazole","Acta Crystallographica Section E Crystallographic Communications","2023","79","9","","","10.1107/S2056989023007259","","x-ray","0.71073","MoKα","","0.054","0.0415","","","0.1082","0.1166","","","","","","1.032","","","","has coordinates,has Fobs","285854","2023-08-24","01:43:34",""
"2022842","15.4317","0.0003","17.2945","0.0003","7.98733","0.00015","90","","90","","90","","2131.69","0.07","199.95","0.1","199.95","0.1","","","","","","","","6","P n m a","-P 2ac 2n","62","","(1,4,8,11-Tetraazacyclotetradecane-κ^4^<i>N</i>)nickel(II) tetraiodidocadmate(II)","","- C10 H24 Cd I4 N4 Ni -","- C10 H24 Cd I4 N4 Ni -","- C40 H96 Cd4 I16 N16 Ni4 -","4","0.5","EX2074","Andriichuk, Irina L.; Shova, Sergiu; Lampeka, Yaroslaw D.","Crystal structures of the complexes containing macrocyclic cations [M(cyclam)]2+ (M = Ni, Zn) and tetraiodidocadmate(2–) anion","Acta Crystallographica Section E Crystallographic Communications","2023","79","9","","","10.1107/S2056989023007004","","x-ray","0.71073","MoKα","","0.0429","0.0314","","","0.0586","0.0636","","","","","","1.062","","","","has coordinates,has Fobs","285855","2023-08-24","01:44:15",""
"2022843","15.6013","0.0003","17.2644","0.0003","8.1099","0.0002","90","","90","","90","","2184.38","0.08","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Triiodido-1κ^3^<i>I</i>-μ-iodido-(1,4,8,11-tetraazacyclotetradecane-2κ^4^<i>N</i>)cadmium(II)zinc(II)","","- C10 H24 Cd I4 N4 Zn -","- C10 H24 Cd I4 N4 Zn -","- C40 H96 Cd4 I16 N16 Zn4 -","4","0.5","EX2074","Andriichuk, Irina L.; Shova, Sergiu; Lampeka, Yaroslaw D.","Crystal structures of the complexes containing macrocyclic cations [M(cyclam)]2+ (M = Ni, Zn) and tetraiodidocadmate(2–) anion","Acta Crystallographica Section E Crystallographic Communications","2023","79","9","","","10.1107/S2056989023007004","","x-ray","0.71073","MoKα","","0.0445","0.0323","","","0.0597","0.0648","","","","","","1.042","","","","has coordinates,has disorder,has Fobs","285855","2023-08-24","01:44:16",""
"2022844","9.6493","0.0007","13.0873","0.0008","10.4634","0.0007","90","","117.188","0.002","90","","1175.36","0.14","90","0.2","90","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-(Dimethylazaniumyl)-2-hydroxyanilinium dichloride monohydrate","","- C8 H16 Cl2 N2 O2 -","- C8 H16 Cl2 N2 O2 -","- C32 H64 Cl8 N8 O8 -","4","1","VM2289","Anil Kumar, Haleyur G.; Mohan Kumar, Thaluru M.; Divakara, Thayamma R.; Geetha, Doreswamy; Yathirajan, Hemmige S.; Parkin, Sean","Crystal structure studies and Hirshfeld surface analysis of 4-(dimethylazaniumyl)-2-hydroxyanilinium dichloride monohydrate at 90 K","Acta Crystallographica Section E Crystallographic Communications","2023","79","9","","","10.1107/S2056989023007223","","","0.71073","MoKα","","0.0233","0.021","","","0.0616","0.0632","","","","","","1.126","","","","has coordinates,has Fobs","285856","2023-08-24","01:44:46",""
"2022845","18.8065","0.001","10.0745","0.0006","28.847","0.003","90","","90","","90","","5465.5","0.7","294","2","294","2","","","","","","","","4","P b c n","-P 2n 2ab","60","Dimethoxypyrimidyltennimide","3,11,19,27-Tetrakis(4,6-dimethoxypyrimidin-2-yl)-3,11,19,27,33,34,35,36-\ octaazapentacyclo[27.3.1.1^5,9^.1^13,17^.1^21,25^]hexatriaconta-\ 1(33),5,7,9(36),13(35),14,16,21(34),22,24,29,31-dodecaen-\ 2,4,10,12,18,20,26,28-octone 0.167-hydrate","","- C52 H40.33 N16 O16.17 -","- C52 H40.334 N16 O16.167 -","- C208 H161.336 N64 O64.668 -","4","0.5","EX2073","Mocilac, Pavle; Pohl, Fabian; Gallagher, John F.","The unusual (syn-/anti-)2 conformation of a dimethoxypyrimidyl-based tennimide","Acta Crystallographica Section E Crystallographic Communications","2023","79","9","","","10.1107/S2056989023006837","","","1.54184","CuKα","","0.0819","0.0543","","","0.1353","0.1592","","","","","","1.034","","","","has coordinates,has Fobs","285857","2023-08-24","01:45:18",""
"2022846","8.9714","0.0002","9.3564","0.0003","10.4969","0.0002","94.088","0.002","105.954","0.002","107.393","0.002","797.05","0.04","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","2-{[5-(Methylsulfanyl)-4-phenyl-4<i>H</i>-1,2,4-triazol-3-yl]methyl}benzo[<i>d</i>]thiazole","","- C17 H14 N4 S2 -","- C17 H14 N4 S2 -","- C34 H28 N8 S4 -","2","1","YZ2038","Azzam, Rasha A.; Elgemeie, Galal H.; Elboshi, Heba A.; Jones, Peter G.","Crystal structure of 2-{[5-(methylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}benzo[d]thiazole","Acta Crystallographica Section E Crystallographic Communications","2023","79","9","","","10.1107/S2056989023007041","","x-ray","0.71073","MoKα","","0.0322","0.028","","","0.0835","0.0862","","","","","","1.044","","","","has coordinates,has Fobs","285858","2023-08-24","01:45:49",""
"2022848","25.0497","0.0003","9.8428","0.0001","16.7577","0.0002","90","","94.534","0.001","90","","4118.83","0.08","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(2-aminobenzoxazole-κ<i>N</i>^3^)bis(acetato-κ^2^<i>O</i>,<i>O</i>')cadmium(II)","","- C18 H18 Cd N4 O6 -","- C18 H18 Cd N4 O6 -","- C144 H144 Cd8 N32 O48 -","8","1","JY2035","Razzoqova, Surayyo; Ibragimov, Aziz; Torambetov, Batirbay; Kadirova, Shakhnoza; Holczbauer, Tamas; Ashurov, Jamshid; Ibragimov, Bakhtiyar","Synthesis, structure and Hirshfeld surface analysis of a coordination compound of cadmium acetate with 2-aminobenzoxazole","Acta Crystallographica Section E Crystallographic Communications","2023","79","9","862","866","10.1107/S2056989023007399","","x-ray","1.54184","CuKα","","0.0347","0.0297","","","0.0748","0.0784","","","","","","1.047","","","","has coordinates,has Fobs","285923","2023-08-31","02:01:13",""
"2022849","7.52646","0.00006","13.40703","0.00012","12.65801","0.00011","90","","92.8635","0.0008","90","","1275.69","0.019","566.15","","566.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","8-Azaniumylquinolinium tetrachloridozincate(II)","","- C9 H10 Cl4 N2 Zn -","- C9 H10 Cl4 N2 Zn -","- C36 H40 Cl16 N8 Zn4 -","4","1","WM5692","Umirova, Gulnora A.; Turaev, Khayit Kh.; Alimnazarov, Bekmurod Kh.; Kasimov, Sherzod A.; Djalilov, Abdulakhat T.; Ibragimov, Bakhtiyar T.; Ashurov, Jamshid M.","Crystal structure and Hirshfeld surface analysis of 8-azaniumylquinolinium tetrachloridozincate(II)","Acta Crystallographica Section E Crystallographic Communications","2023","79","9","856","861","10.1107/S2056989023007466","","x-ray","1.54184","CuKα","","0.0243","0.0231","","","0.0639","0.0647","","","","","","1.064","","","","has coordinates,has Fobs","285924","2023-08-31","02:01:43",""
"2022850","3.942","","11.5915","0.0002","28.0387","0.0004","90","","90","","90","","1281.19","0.03","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2<i>E</i>)-1-(4-Bromophenyl)-3-(2-methylphenyl)prop-2-en-1-one","","- C16 H13 Br O -","- C16 H13 Br O -","- C64 H52 Br4 O4 -","4","1","TX2073","Akkurt, Mehmet; Naghiyev, Farid N.; Khrustalev, Victor N.; Asadov, Khammed A.; Khalilov, Ali N.; Bhattarai, Ajaya; Mamedov, İbrahim G.","Crystal structure and Hirshfeld surface analysis of (2E)-1-(4-bromophenyl)-3-(2-methylphenyl)prop-2-en-1-one","Acta Crystallographica Section E Crystallographic Communications","2023","79","9","847","851","10.1107/S2056989023007387","","","1.54184","CuKα","","0.0219","0.0215","","","0.0522","0.0524","","","","","","1.143","","","","has coordinates,has Fobs","285925","2023-08-31","02:02:19",""
"2022851","9.759","0.0001","11.7951","0.0002","16.7553","0.0002","90","","90","","90","","1928.68","0.04","183.15","","183.15","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2'-Deoxyguanosine dimethyl sulfoxide disolvate","","- C14 H25 N5 O6 S2 -","- C14 H25 N5 O6 S2 -","- C56 H100 N20 O24 S8 -","4","1","ZV2028","Spingler, Bernhard","Crystal structure of the nucleoside 2′-deoxyguanosine dimethyl sulfoxide disolvate","Acta Crystallographica Section E Crystallographic Communications","2023","79","9","852","855","10.1107/S2056989023007405","","","0.71073","MoKα","","0.0355","0.0304","","","0.0717","0.0729","","","","","","1.009","","","","has coordinates,has Fobs","285926","2023-08-31","02:02:46",""
"2022852","12.7698","0.0016","14.9212","0.0018","7.1087","0.0008","90","","90","","90","","1354.5","0.3","298","2","298","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","Methyl 2-(2-oxo-2<i>H</i>-chromen-4-yl)benzoate","","- C17 H13 N O4 -","- C17 H13 N O4 -","- C68 H52 N4 O16 -","4","1","MW2198","Hollauer, Henrique V. P.; Vilas Novas, Rachel C.; Guedes, Guilherme P.; Buarque, Camilla D.; Escobar, Lívia B. L.","Synthesis, characterization and crystal structure of methyl 2-(2-oxo-2H-chromen-4-ylamino)benzoate","Acta Crystallographica Section E Crystallographic Communications","2023","79","9","842","846","10.1107/S2056989023007351","","","0.71073","MoKα","","0.0741","0.0658","","","0.1539","0.1584","","","","","","1.079","","","","has coordinates,has Fobs","285927","2023-08-31","02:03:11",""
"2022853","6.7445","0.0015","13.498","0.003","8.01","0.002","90","","94.421","0.007","90","","727","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(2-Amino-4-methyl-1,3-thiazol-5-yl)ethan-1-one","","- C6 H8 N2 O S -","- C6 H8 N2 O S -","- C24 H32 N8 O4 S4 -","4","1","VM2288","Huseynov, Elnur Z.; Akkurt, Mehmet; Brito, Ivan; Bhattarai, Ajaya; Rzayev, Rovnag M.; Asadov, Khammed A.; Maharramov, Abel M.","Crystal structure and Hirshfeld surface analysis of 1-(2-amino-4-methyl-1,3-thiazol-5-yl)ethan-1-one","Acta Crystallographica Section E Crystallographic Communications","2023","79","10","","","10.1107/S2056989023007181","","","0.71073","MoKα","","0.1025","0.0496","","","0.1161","0.1416","","","","","","1.041","","","","has coordinates,has Fobs","286282","2023-09-09","01:35:50",""
"2022854","8.8072","0.0012","17.795","0.002","16.222","0.002","90","","91.317","0.009","90","","2541.7","0.5","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Ethyl 1-(4-fluorophenyl)-4-[(4-fluorophenyl)amino]-2,6-diphenyl-1,2,5,6-tetrahydropyridine-3-carboxylate","","- C32 H28 F2 N2 O2 -","- C32 H28 F2 N2 O2 -","- C128 H112 F8 N8 O8 -","4","2","HB8074","Bansal, Ravi; Butcher, Ray J.; Gupta, Sushil K.","Synthesis, crystal structure, Hirshfeld surface analysis, DFT and NBO study of ethyl 1-(4-fluorophenyl)-4-[(4-fluorophenyl)amino]-2,6-diphenyl-1,2,5,6-tetrahydropyridine-3-carboxylate","Acta Crystallographica Section E Crystallographic Communications","2023","79","10","","","10.1107/S205698902300748X","","","0.71073","MoKα","","0.147","0.1177","","","0.297","0.3238","","","","","","1.167","","","","has coordinates,has Fobs","286283","2023-09-09","01:36:18",""
"2022855","6.5899","0.0001","17.9658","0.0002","11.9444","0.0001","90","","96.131","0.001","90","","1406.04","0.03","100","0.1","100","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Tetrakis(3-cyanopyridine <i>N</i>-oxide-κ<i>O</i>)bis(thiocyanato-κ<i>N</i>)\ cobalt(II)","","- C26 H16 Co N10 O4 S2 -","- C26 H16 Co N10 O4 S2 -","- C52 H32 Co2 N20 O8 S4 -","2","0.5","HB8070","Näther, Christian; Jess, Inke","Synthesis, crystal structure and thermal behavior of tetrakis(3-cyanopyridine N-oxide-κO)bis(thiocyanato-κN)cobalt(II), which shows strong pseudosymmetry","Acta Crystallographica Section E Crystallographic Communications","2023","79","10","","","10.1107/S2056989023006862","","x-ray","1.54184","CuKα","","0.0278","0.0266","","","0.0819","0.0827","","","","","","1.113","","","","has coordinates,has Fobs","286284","2023-09-09","01:36:43",""
"2022856","6.6935","0.0001","7.2024","0.0001","12.7978","0.0002","90","","90","","90","","616.973","0.016","100","2","100","0.1","","","","","","","","5","I m m a","-I 2b 2","74","","<i>catena</i>-poly[cobalt(II)-di-μ-chlorido-μ-pyridazine-κ^2^<i>N</i>^1^:<i>N</i>^2^]","","- C4 H4 Cl2 Co N2 -","- C4 H4 Cl2 Co N2 -","- C16 H16 Cl8 Co4 N8 -","4","0.25","HB8073","Näther, Christian; Jess, Inke","Synthesis and crystal structure of catena-poly[cobalt(II)-di-μ-chlorido-μ-pyridazine-κ2 N 1:N 2]","Acta Crystallographica Section E Crystallographic Communications","2023","79","10","","","10.1107/S2056989023007065","","x-ray","1.54184","CuKα","","0.0206","0.0203","","","0.0575","0.0577","","","","","","1.068","","","","has coordinates,has Fobs","286285","2023-09-09","01:37:06",""
"2022858","14.4848","0.0003","12.5663","0.0002","15.2708","0.0003","90","","116.424","0.001","90","","2489.2","0.08","240","2","240","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Ethoxy-1-ethyl-6-nitroquinoxalin-2(1<i>H</i>)-one","","- C12 H13 N3 O4 -","- C12 H13 N3 O4 -","- C96 H104 N24 O32 -","8","2","HB8072","Yousra, Seqqat; El Ghayati, Lhoussaine; Hökelek, Tuncer; Ouazzani Chahdi, Fouad; Mague, Joel T.; Kandri Rodi, Youssef; Sebbar, Nada Kheira","Crystal structure and Hirshfeld surface analysis of 3-ethoxy-1-ethyl-6-nitroquinoxalin-2(1H)-one","Acta Crystallographica Section E Crystallographic Communications","2023","79","10","","","10.1107/S2056989023007624","","","1.54178","CuKα","","0.0553","0.0473","","","0.126","0.1374","","","","","","1.042","","","","has coordinates,has disorder,has Fobs","286287","2023-09-09","01:38:15",""
"2022859","7.45681","0.00013","8.41737","0.0001","12.8928","0.0002","74.0382","0.0012","73.7634","0.0014","72.7034","0.0013","725.4","0.02","100","0.3","100","0.3","","","","","","","","6","P -1","-P 1","2","","3-(4-Fluorophenyl)-2-formyl-7-methylimidazo[1,2-<i>a</i>]pyridin-1-ium chloride monohydrate","","- C15 H14 Cl F N2 O2 -","- C15 H14 Cl F N2 O2 -","- C30 H28 Cl2 F2 N4 O4 -","2","1","JY2034","Guseinov, Firudin I.; Ovsyannikov, Viacheslav O.; Sokolovskiy, Pavel V.; Sebyakin, Yurii L.; Samigullina, Aida I.; Akkurt, Mehmet; Çelikesir, Sevim Türktekin; Bhattarai, Ajaya","Synthesis, crystal structure and Hirshfeld surface analysis of 3-(4-fluorophenyl)-2-formyl-7-methylimidazo[1,2-a]pyridin-1-ium chloride monohydrate","Acta Crystallographica Section E Crystallographic Communications","2023","79","10","","","10.1107/S2056989023007272","","x-ray","1.54184","CuKα","","0.0338","0.0334","","","0.0855","0.0858","","","","","","1.028","","","","has coordinates,has Fobs","286318","2023-09-13","01:44:55",""
"2022860","7.44","0.0008","9.92","0.001","11.52","0.0013","93.071","0.009","105.349","0.01","108.879","0.011","766.71","0.16","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","4-Azido-2-(3,5-dimethylphenyl)-5-(4-nitrophenyl)-2<i>H</i>-1,2,3-triazole","","- C16 H13 N7 O2 -","- C16 H13 N7 O2 -","- C32 H26 N14 O4 -","2","1","ZN2031","Maharramov, Abel; Shikhaliyev, Namiq Q.; Abdullayeva, Afaq; Atakishiyeva, Gulnar T.; Niyazova, Ayten; Khrustalev, Victor N.; Gahramanova, Shahnaz I.; Atioğlu, Zeliha; Akkurt, Mehmet; Bhattarai, Ajaya","Crystal structure and Hirshfeld surface analysis of 4-azido-2-(3,5-dimethylphenyl)-5-(4-nitrophenyl)-2H-1,2,3-triazole","Acta Crystallographica Section E Crystallographic Communications","2023","79","10","","","10.1107/S2056989023007855","","","0.79313","synchrotron","","0.0529","0.0463","","","0.1274","0.1333","","","","","","1.08","","","","has coordinates,has Fobs","286350","2023-09-15","01:44:40",""
"2022861","11.4047","0.0009","7.1107","0.0003","16.8997","0.0013","90","","107.009","0.008","90","","1310.54","0.16","100","0.12","100","0.12","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2,6-Dibromo-3,4,5-trimethoxybenzoic acid","2,6-Dibromo-3,4,5-trimethoxybenzoic acid","","- C10 H10 Br2 O5 -","- C10 H10 Br2 O5 -","- C40 H40 Br8 O20 -","4","1","JY2033","Meurer, Florian; Dimova, Tanya; Bodensteiner, Michael; Kolev, Iliyan","2,6-Dibromo-3,4,5-trimethoxybenzoic acid","Acta Crystallographica Section E Crystallographic Communications","2023","79","10","","","10.1107/S2056989023007831","","x-ray","0.71073","MoKα","","0.0875","0.0528","","","0.1066","0.1231","","","","","","1.0578","","","","has coordinates,has Fobs","286351","2023-09-15","01:45:16",""
"2022862","8.4573","0.0001","23.5853","0.0003","11.0072","0.0001","90","","111.749","0.002","90","","2039.29","0.05","100","2","100","2","","","","","","","","5","C 1 c 1","C -2yc","9","","(2<i>Z</i>,2'<i>E</i>)-2,2'-(3-Methoxy-3-phenylpropane-1,2-diylidene)bis(2-methylhydrazine-1-carbothioamide) dimethylformamide monosolvate","","- C15 H23 N7 O2 S2 -","- C15 H23 N7 O2 S2 -","- C60 H92 N28 O8 S8 -","4","1","YZ2041","Guseinov, Firudin I.; Knyazev, Aleksandr V.; Shuvalova, Elena V.; Kobrakov, Konstantin I.; Samigullina, Aida I.; Atioğlu, Zeliha; Akkurt, Mehmet; Bhattarai, Ajaya","Synthesis, crystal structure and Hirshfeld surface analysis of (2Z,2′E)-2,2′-(3-methoxy-3-phenylpropane-1,2-diylidene)bis(hydrazine-1-carbothioamide) dimethylformamide monosolvate","Acta Crystallographica Section E Crystallographic Communications","2023","79","10","","","10.1107/S2056989023007946","","x-ray","1.54184","CuKα","","0.0318","0.0317","","","0.0874","0.0877","","","","","","1.067","","","","has coordinates,has disorder,has Fobs","286352","2023-09-15","01:45:44",""
"2022863","5.6","0.3","9.6","0.3","28.2","0.3","90","","90.3","0.09","90","","1516","10","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","quabodepistat-2,5-dihydroxybenzoicacid","5-{[(3<i>R</i>,4<i>R</i>)-1-(4-Chloro-2,6-difluorophenyl)-3,4-dihydroxypiperidin-4-yl]methoxy}-8-fluoro-3,4-dihydroquinolin-2(1<i>H</i>)-one–2,5-dihydroxybenzoic acid (1/1)","","- C28 H26 Cl F3 N2 O8 -","- C28 H26 Cl F3 N2 O8 -","- C56 H52 Cl2 F6 N4 O16 -","2","1","DJ2052","Sakamoto, Nasa; Gato, Katsuhiko","Crystal structure of a 1:1 co-crystal of quabodepistat (OPC-167832) with 2,5-dihydroxybenzoic acid using microcrystal electron diffraction","Acta Crystallographica Section E Crystallographic Communications","2023","79","10","","","10.1107/S2056989023006047","","","0.0251","electron","","0.2455","0.1602","","","0.4121","0.4803","","","","","","1.075","","","","has coordinates","286428","2023-09-20","01:48:31",""
"2022864","4.1205","0.0005","4.1205","0.0005","4.1205","0.0005","90","","90","","90","","69.96","0.015","293","","293","","","","","","","","","2","P a -3","-P 2ac 2ab 3","205","","Silicon pernitride","","- N2 Si -","- N2 Si -","- N8 Si4 -","4","0.166667","WM5694","Jurzick, Pascal L.; Krach, Georg; Brüning, Lukas; Schnick, Wolfgang; Bykov, Maxim","Synthesis and crystal structure of silicon pernitride SiN2 at 140 GPa","Acta Crystallographica Section E Crystallographic Communications","2023","79","10","","","10.1107/S2056989023008058","","x-ray","0.28457","synchrotron","","0.1285","0.0706","","","0.1601","0.1907","","","","","","1.072","","","","has coordinates,has Fobs","286429","2023-09-20","01:48:57",""
"2022865","17.349","0.008","6.894","0.003","12.173","0.005","90","","92.878","0.012","90","","1454.1","1.1","110.15","","110.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Ferrocenyl-1-(pyridin-2-yl)-1<i>H</i>-pyrazol-5-amine","","- C18 H16 Fe N4 -","- C18 H16 Fe N4 -","- C72 H64 Fe4 N16 -","4","1","WM5693","Joekar, Delara; Hiscock, Lana K.; Dawe, Louise N.","Synthesis, crystal structure, and Hirshfeld surface analysis of 3-ferrocenyl-1-(pyridin-2-yl)-1H-pyrazol-5-amine","Acta Crystallographica Section E Crystallographic Communications","2023","79","10","","","10.1107/S2056989023008101","","","0.71073","MoKα","","0.0607","0.0355","","","0.0687","0.078","","","","","","1.015","","","","has coordinates,has Fobs","286430","2023-09-20","01:49:34",""
"2022934","8.3265","0.0003","14.9699","0.0005","13.9523","0.0004","90","","99.242","0.001","90","","1716.53","0.1","296.15","","296.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[Bis(pyridin-2-yl-κ<i>N</i>)amine](formato-κ<i>O</i>)(<i>m</i>-hydroxybenzoato-κ^2^<i>O</i>,<i>O</i>')copper(II)","","- C18 H15 Cu N3 O5 -","- C18 H15 Cu N3 O5 -","- C72 H60 Cu4 N12 O20 -","4","1","WM5700","Chaisuriya, Wanassanan; Chainok, Kittipong; Wannarit, Nanthawat","Crystal structure and Hirshfeld surface analysis of a new mononuclear copper(II) complex: [bis(pyridin-2-yl-κN)amine](formato-κO)(m-hydroxybenzoato-κ2 O,O′)copper(II)","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1115","1120","10.1107/S2056989023009234","","x-ray","0.71073","MoKα","","0.0891","0.0455","","","0.096","0.1148","","","","","","1.012","","","","has coordinates,has Fobs","288937","2024-01-07","11:49:33",""
"2022935","5.96605","0.00017","5.13977","0.00012","9.9308","0.0003","90","","107.275","0.003","90","","290.783","0.015","99.99","0.1","99.99","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Calcium hexafluoridosilicate dihydrate","","- Ca F6 H4 O2 Si -","- Ca F6 H4 O2 Si -","- Ca2 F12 H8 O4 Si2 -","2","0.5","HB8080","Motaln, Klemen; Lozinšek, Matic","Crystal structure of CaSiF6·2H2O(mP2) and reevaluation of the SiIV–F bond-valence parameter R 0","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1121","1126","10.1107/S2056989023009349","","x-ray","1.54184","CuKα","","0.025","0.0247","","","0.0691","0.0696","","","","","","1.142","","","","has coordinates,has disorder,has Fobs","288944","2024-01-07","11:50:52",""
"2022936","11.9879","0.0007","12.1807","0.0007","15.4518","0.0009","90","","90","","90","","2256.3","0.2","100","2","100","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","Isobutyl 4-[4-(difluoromethoxy)phenyl]-2,6,6-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate","","- C24 H29 F2 N O4 -","- C24 H29 F2 N O4 -","- C96 H116 F8 N4 O16 -","4","1","EV2001","Yıldırım, Sema Öztürk; Akkurt, Mehmet; Çetin, Gökalp; Şimşek, Rahime; Butcher, Ray J.; Bhattarai, Ajaya","Synthesis, characterization, crystal structure and Hirshfeld surface analysis of isobutyl 4-[4-(difluoromethoxy)phenyl]-2,6,6-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1132","1136","10.1107/S2056989023009623","","","0.71073","MoKα","","0.0838","0.0453","","","0.0947","0.1074","","","","","","1.027","","","","has coordinates,has Fobs","288939","2024-01-07","11:49:57",""
"2022937","16.3178","0.0004","9.2747","0.0002","14.872","0.0004","90","","93.771","0.001","90","","2245.9","0.1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","10-Hydroxy-2-(4-methoxyphenyl)-3-oxo-2,3,3a,4,10,10a-hexahydro-1<i>H</i>-9-thia-2-azacyclopenta[<i>b</i>]fluorene-4-carboxylic acid dimethyl sulfoxide-<i>d</i>~6~ monosolvate","","- C24 H19 D6 N O6 S2 -","- C24 H19 D6 N O6 S2 -","- C96 H76 D24 N4 O24 S8 -","4","1","TX2077","Mammadova, Gunay Z.; Yakovleva, Elizaveta D.; Erokhin, Pavel P.; Grigoriev, Mikhail S.; Atioğlu, Zeliha; Azizova, Asmet N.; Akkurt, Mehmet; Bhattarai, Ajaya","Crystal structure and Hirshfeld surface analysis of 10-hydroxy-2-(4-methoxyphenyl)-3-oxo-2,3,3a,4,10,10a-hexahydro-1H-9-thia-2-azacyclopenta[b]fluorene-4-carboxylic acid dimethyl sulfoxide-d 6 monosolvate","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1127","1131","10.1107/S2056989023009635","","","0.71073","MoKα","","0.0586","0.0492","","","0.1233","0.1292","","","","","","1.123","","","","has coordinates,has disorder,has Fobs","288947","2024-01-07","11:51:25",""
"2022938","9.58785","0.00004","16.83642","0.00008","19.55978","0.0001","90","","103.732","0.0005","90","","3067.19","0.03","99.9","0.6","99.9","0.6","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Pyridine-2,6-diol","6-Hydroxy-1,2-dihydropyridin-2-one","","- C30 H30 N6 O12 -","- C30 H30 N6 O12 -","- C120 H120 N24 O48 -","4","1","JY2036","Phillips, Sara K.; Brancato, Savannah G.; MacMillan, Samantha N.; Snider, Mark J.; Roering, Andrew J.; Hicks, Katherine A.","Synthesis and crystallographic characterization of 6-hydroxy-1,2-dihydropyridin-2-one","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1147","1150","10.1107/S205698902300974X","","x-ray","1.54184","CuKα","","0.0336","0.0318","","","0.0814","0.0828","","","","","","1.023","","","","has coordinates,has disorder,has Fobs","288935","2024-01-07","11:49:14",""
"2022939","13.742","0.0013","8.8912","0.0013","23.114","0.002","90","","94.742","0.004","90","","2814.5","0.5","294","2","294","2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","(2<i>Z</i>)-3-Oxo-<i>N</i>-phenyl-2-[(1<i>H</i>-pyrrol-2-yl)methylidene]butanamide monohydrate","","- C15 H16 N2 O3 -","- C15 H16 N2 O3 -","- C120 H128 N16 O24 -","8","1","VM2291","Safarova, Ayten S.; Khalilov, Ali N.; Akkurt, Mehmet; Brito, Ivan; Bhattarai, Ajaya; Naghiyev, Farid N.; Mamedov, Ibrahim G.","Crystal structure and Hirshfeld surface analysis of (2Z)-3-oxo-N-phenyl-2-[(1H-pyrrol-2-yl)methylidene]butanamide monohydrate","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1142","1146","10.1107/S2056989023009799","","","0.71073","MoKα","","0.0836","0.0411","","","0.0876","0.1085","","","","","","1.046","","","","has coordinates,has Fobs","288941","2024-01-07","11:50:19",""
"2022940","5.0515","0.0002","6.7912","0.0003","8.7083","0.0006","83.585","0.004","79.907","0.004","86.833","0.003","292.09","0.03","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","<i>catena</i>-Poly[[dibromidocadmium(II)]-bis(μ-3-amino-1<i>H</i>-pyrazole)-κ^2^<i>N</i>^3^:<i>N</i>^2^;κ^2^<i>N</i>^2^:<i>N</i>^3^]","","- C6 H10 Br2 Cd N6 -","- C6 H10 Br2 Cd N6 -","- C6 H10 Br2 Cd N6 -","1","0.5","TX2078","Kuzevanova, Iryna S.; Vynohradov, Oleksandr S.; Pavlenko, Vadim A.; Malinkin, Sergey O.; Shova, Sergiu; Fritsky, Igor O.; Seredyuk, Maksym","Crystal structure of polymeric bis(3-amino-1H-pyrazole)cadmium dibromide","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1151","1154","10.1107/S2056989023009751","","x-ray","1.54184","CuKα","","0.0454","0.0452","","","0.1335","0.1336","","","","","","1.272","","","","has coordinates,has Fobs","288942","2024-01-07","11:50:27",""
"2022941","4.9925","0.0006","12.4283","0.0016","15.0643","0.0019","98.42","0.007","94.302","0.007","91.15","0.006","921.6","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","<i>S</i>-<i>n</i>-Octyl 3-(1-phenylethylidene)dithiocarbazate","","- C17 H26 N2 S2 -","- C17 H26 N2 S2 -","- C34 H52 N4 S4 -","2","1","ZV2030","Khan, Sultana Shakila; Howlader, Md. Belayet Hossain; Sheikh, Md. Chanmiya; Miyatake, Ryuta; Zangrando, Ennio; Ansary, Md. Rezaul Haque","Crystal structure of S-n-octyl 3-(1-phenylethylidene)dithiocarbazate and of its bis-chelated nickel(II) complex","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1137","1141","10.1107/S2056989023009726","","","0.71075","MoKα","","0.0922","0.0708","","","0.1829","0.1957","","","","","","1.076","","","","has coordinates,has disorder","288945","2024-01-07","11:51:03",""
"2022942","13.6399","0.0003","17.6532","0.0005","16.7596","0.0003","90","","114","0.008","90","","3686.6","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis[<i>S</i>-<i>n</i>-octyl 3-(1-phenylethylidene)dithiocarbazato]nickel(II)","","- C34 H50 N4 Ni S4 -","- C34 H50 N4 Ni S4 -","- C136 H200 N16 Ni4 S16 -","4","1","ZV2030","Khan, Sultana Shakila; Howlader, Md. Belayet Hossain; Sheikh, Md. Chanmiya; Miyatake, Ryuta; Zangrando, Ennio; Ansary, Md. Rezaul Haque","Crystal structure of S-n-octyl 3-(1-phenylethylidene)dithiocarbazate and of its bis-chelated nickel(II) complex","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1137","1141","10.1107/S2056989023009726","","","0.71075","MoKα","","0.0589","0.0416","","","0.0903","0.0963","","","","","","1.039","","","","has coordinates,has Fobs","288945","2024-01-07","11:51:03",""
"2022943","9.1895","0.0007","10.3507","0.0008","21.6887","0.0016","90","","99.644","0.003","90","","2033.8","0.3","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Tricadmium orthophosphate","Tricadmium bis(orthophosphate)","","- Cd3 O8 P2 -","- Cd3 O8 P2 -","- Cd36 O96 P24 -","12","3","OO2001","Cherif, Fatima-Zahra; Taibi, Mhamed; Boukhari, Ali; Assani, Abderrazzak; Saadi, Mohamed; El Ammari, Lahcen","Crystal structure reinvestigation and spectroscopic analysis of tricadmium orthophosphate","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1155","1160","10.1107/S2056989023009775","","","0.71073","MoKα","","0.0336","0.0232","","","0.0505","0.0535","","","","","","1.074","","","","has coordinates,has Fobs","288946","2024-01-07","11:51:15",""
"2022944","7.74843","0.0001","19.2895","0.0003","10.69753","0.00011","90","","93.3777","0.001","90","","1596.11","0.04","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[μ-2-(1<i>H</i>-1,3-benzodiazol-2-yl)phenolato]bis[ethanol(thiocyanato)cobalt(II)]","","- C32 H30 Co2 N6 O4 S2 -","- C32 H30 Co2 N6 O4 S2 -","- C64 H60 Co4 N12 O8 S4 -","2","0.5","EX2078","Orton, James B.; Diouf, Ngone; Gueye, Rokhaya S.; Gaye, Mohamed; Thiam, Ibrahima Elhadji; Coles, Simon J.","Synthesis and crystal structures of two related Co and Mn complexes: a celebration of collaboration between the universities of Dakar and Southampton","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1109","1114","10.1107/S2056989023009805","","x-ray","1.54178","CuKα","","0.0301","0.0286","","","0.0784","0.0793","","","","","","1.083","","","","has coordinates,has Fobs","288936","2024-01-07","11:49:24",""
"2022945","12.412","0.003","12.43","0.004","15.7","0.005","69.021","0.005","86.73","0.006","75.348","0.009","2186.6","1.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","<i>trans</i>-Bis(2-{1-[(6<i>R</i>,<i>S</i>)-3,5,5,6,8,8-hexamethyl-5,6,7,8-tetrahydronaphthalen-2-yl]ethylidene}-<i>N</i>-methylhydrazinecarbothioamidato-κ^2^<i>N</i>^2^,<i>S</i>)palladium(II) ethanol monosolvate","","- C42 H66 N6 O Pd S2 -","- C42 H66 N6 O Pd S2 -","- C84 H132 N12 O2 Pd2 S4 -","2","1","","Melo, Ana Paula Lopes de; Bresolin, Leandro; Tirloni, Bárbara; Farias, Renan Lira de; Oliveira, Adriano Bof de","Synthesis, crystal structure and Hirshfeld analysis of trans-bis(2-{1-[(6R,S)-3,5,5,6,8,8-hexamethyl-5,6,7,8-tetrahydronaphthalen-2-yl]ethylidene}-N-methylhydrazinecarbothioamidato-κ2 N 2,S)palladium(II) ethanol monosolvate","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1166","1172","10.1107/S2056989023009908","","x-ray","0.71073","MoKα","","0.0322","0.028","","","0.0664","0.0691","","","","","","1.035","","","","has coordinates,has disorder,has Fobs","288938","2024-01-07","11:49:44",""
"2022946","18.9504","0.0009","5.92161","0.00019","11.3049","0.0005","90","","114.729","0.006","90","","1152.27","0.1","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(morpholine-κ<i>N</i>)gold(I) chloride","","- C8 H18 Au Cl N2 O2 -","- C8 H18 Au Cl N2 O2 -","- C32 H72 Au4 Cl4 N8 O8 -","4","0.5","YZ2043","Döring, Cindy; Jones, Peter G.","Crystal structures of the isotypic complexes bis(morpholine)gold(I) chloride and bis(morpholine)gold(I) bromide","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1161","1165","10.1107/S2056989023009702","","","0.71073","MoKα","","0.0217","0.0149","","","0.0239","0.0255","","","","","","1.064","","","","has coordinates,has Fobs","288940","2024-01-07","11:50:07",""
"2022947","18.8719","0.0006","6.0784","0.00017","11.405","0.0004","90","","114.595","0.004","90","","1189.58","0.08","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(morpholine-κ<i>N</i>)gold(I) bromide","","- C8 H18 Au Br N2 O2 -","- C8 H18 Au Br N2 O2 -","- C32 H72 Au4 Br4 N8 O8 -","4","0.5","YZ2043","Döring, Cindy; Jones, Peter G.","Crystal structures of the isotypic complexes bis(morpholine)gold(I) chloride and bis(morpholine)gold(I) bromide","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1161","1165","10.1107/S2056989023009702","","","0.71073","MoKα","","0.0188","0.0151","","","0.0247","0.0256","","","","","","1.079","","","","has coordinates,has Fobs","288940","2024-01-07","11:50:07",""
"2022948","10.79412","0.00006","10.79412","0.00006","11.15065","0.00011","90","","90","","90","","1299.2","0.016","100","0.1","100","0.1","","","","","","","","6","P 4 n c","P 4 -2n","104","","Chloridotetrakis(pyridine-3-carbonitrile)thiocyanatoiron(II)","","- C25 H16 Cl Fe N9 S -","- C25 H16 Cl Fe N9 S -","- C50 H32 Cl2 Fe2 N18 S2 -","2","0.25","NX2002","Müller-Meinhard, Asmus; Jess, Inke; Näther, Christian","Synthesis, crystal structure and properties of chloridotetrakis(pyridine-3-carbonitrile)thiocyanatoiron(II)","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1173","1178","10.1107/S205698902300988X","","x-ray","1.54184","CuKα","","0.0227","0.0225","","","0.0653","0.0654","","","","","","1.139","","","","has coordinates,has Fobs","288943","2024-01-07","11:50:35",""
"2022949","5.5229","0.0002","11.9579","0.0005","22.5767","0.0009","90","","94.962","0.001","90","","1485.43","0.1","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1,3-Bis[(1-octyl-1<i>H</i>-1,2,3-triazol-4-yl)methyl]-1<i>H</i>-benzo[<i>d</i>]imidazol-2(3<i>H</i>)-one","","- C29 H44 N8 O -","- C29 H44 N8 O -","- C58 H88 N16 O2 -","2","1","HB8081","Zouhair, Mustapha; El Ghayati, Lhoussaine; El Monfalouti, Hanae; Abchihi, Hicham; Hökelek, Tuncer; Ahmed, Mazzah; Mague, Joel T.; Sebbar, Nada Kheira","Synthesis, structure and Hirshfeld surface analysis of 1,3-bis[(1-octyl-1H-1,2,3-triazol-4-yl)methyl]-1H-benzo[d]imidazol-2(3H)-one","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1179","1182","10.1107/S2056989023009891","","","0.71073","MoKα","","0.0422","0.0356","","","0.086","0.09","","","","","","1.049","","","","has coordinates,has Fobs","288948","2024-01-07","11:51:35",""
"2022950","5.3864","0.0006","18.013","0.002","7.0112","0.0008","90","","96.288","0.004","90","","676.17","0.13","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Amino-1-(prop-2-yn-1-yl)pyrimidin-2(1<i>H</i>)-one","","- C7 H7 N3 O -","- C7 H7 N3 O -","- C28 H28 N12 O4 -","4","1","WM5702","Lahyaoui, Mouad; Haoudi, Amal; Kartah, Badr Eddine; Mazzah, Ahmed; Hökelek, Tuncer; Mague, Joel T.; Kandri Rodi, Youssef; Sebbar, Nada Kheira","Crystal structure, Hirshfeld surface analysis, intermolecular interaction energies, energy frameworks and DFT calculations of 4-amino-1-(prop-2-yn-1-yl)pyrimidin-2(1H)-one","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1183","1189","10.1107/S2056989023009933","","","0.71073","MoKα","","0.0452","0.0398","","","0.1089","0.1133","","","","","","1.046","","","","has coordinates,has Fobs","288949","2024-01-07","11:51:48",""
"2022951","21.9709","0.0015","5.1271","0.0004","27.022","0.002","90","","93.633","0.004","90","","3037.8","0.4","100","2","100","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","2-(Cyclohexylmethyl)-7-nitro-5-(trifluoromethyl)benzo[<i>d</i>]isothiazol-3(2<i>H</i>)-one","","- C15 H15 F3 N2 O3 S -","- C15 H15 F3 N2 O3 S -","- C120 H120 F24 N16 O24 S8 -","8","1","VM2292","Richter, Adrian; Goddard, Richard; Imming, Peter; Seidel, Rüdiger W.","Crystal structure and antimycobacterial evaluation of 2-(cyclohexylmethyl)-7-nitro-5-(trifluoromethyl)benzo[d]isothiazol-3(2H)-one","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1194","1198","10.1107/S2056989023010137","","","0.71073","MoKα","","0.0587","0.0422","","","0.1036","0.1162","","","","","","1.041","","","","has coordinates,has Fobs","287918","2023-12-01","03:09:02",""
"2022952","12.7712","0.0004","13.6102","0.0004","24.7288","0.0008","98.301","0.003","97.814","0.003","117.051","0.003","3687.5","0.2","103","","103","","","","","","","","","8","P -1","-P 1","2","","Tetrakis{<i>N</i>-[bis(pyrrolidin-1-yl)phosphoryl]acetamidato}bis(propan-2-ol)neodymiumsodium propan-2-ol monosolvate","","- C49 H88 Cl12 N12 Na Nd O11 P4 -","- C49 H88 Cl12 N12 Na Nd O11 P4 -","- C98 H176 Cl24 N24 Na2 Nd2 O22 P8 -","2","1","MW2199","Kariaka, Nataliia S.; Dyakonenko, Viktoriya V.; Znovjyak, Kateryna O.; Shishkina, Svitlana V.; Amirkhanov, Volodymyr M.","Synthesis, crystal structure and Hirshfeld surface analysis of the tetrakis complex NaNdPyr4(i-PrOH)2·i-PrOH with a carbacylamidophosphate of the amide type","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1218","1222","10.1107/S2056989023010071","","","0.71073","MoKα","","0.0581","0.0466","","","0.1025","0.11","","","","","","1.036","","","","has coordinates,has disorder,has Fobs","287919","2023-12-01","03:09:41",""
"2022953","16.6921","0.0004","16.6921","0.0004","12.4112","0.0004","90","","90","","90","","3458.09","0.16","150","2","150","2","","","","","","","","5","I 4/m m m","-I 4 2","139","","Tetrabutylazanium tetramethylazanium hexa-μ~4~-hydroxido-dodeca-μ~2~-pyrazolato-<i>hexahedro</i>-octanickel","","- C56 H90 N26 Ni8 O6 -","- C56 H90 N26 Ni8 O6 -","- C112 H180 N52 Ni16 O12 -","2","0.0625","XI2028","Al Isawi, Wisam A.; Zeller, Matthias; Mezei, Gellert","An octanuclear nickel(II) pyrazolate cluster with a cubic Ni8 core and its methyl- and n-octyl-functionalized derivatives","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1199","1206","10.1107/S2056989023010101","","","1.54178","CuKα","","0.0446","0.0435","","","0.1125","0.1133","","","","","","1.122","","","","has coordinates,has disorder,has Fobs","287920","2023-12-01","03:11:00",""
"2022954","30.39","0.0018","14.5762","0.0009","14.5141","0.0009","90","","90","","90","","6429.3","0.7","150","2","150","2","","","","","","","","6","P m n a","-P 2ac 2","53","","Bis(tetrabutylazanium) hexa-μ~4~-hydroxido-dodeca-μ~2~-(4-methylpyrazolato)-<i>hexahedro</i>-octanickel 1,2-dichloroethane 7.196-solvate","","- C94.39 H164.78 Cl14.39 N26 Ni8 O6 -","- C94.392 H164.784 Cl14.392 N26 Ni8 O6 -","- C188.784 H329.568 Cl28.784 N52 Ni16 O12 -","2","0.25","XI2028","Al Isawi, Wisam A.; Zeller, Matthias; Mezei, Gellert","An octanuclear nickel(II) pyrazolate cluster with a cubic Ni8 core and its methyl- and n-octyl-functionalized derivatives","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1199","1206","10.1107/S2056989023010101","","","1.54178","CuKα","","0.084","0.0812","","","0.2524","0.2542","","","","","","1.099","","","","has coordinates,has disorder,has Fobs","287920","2023-12-01","03:11:01",""
"2022955","13.973","0.008","20.765","0.01","31.873","0.014","99.896","0.017","94.798","0.017","99.1","0.02","8937","8","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","Bis(tetrabutylazanium) hexa-μ~4~-hydroxido-dodeca-μ~2~-(4-octylpyrazolato)-<i>hexahedro</i>-octanickel","","- C164 H306 N26 Ni8 O6 -","- C164 H306 N26 Ni8 O6 -","- C328 H612 N52 Ni16 O12 -","2","1","XI2028","Al Isawi, Wisam A.; Zeller, Matthias; Mezei, Gellert","An octanuclear nickel(II) pyrazolate cluster with a cubic Ni8 core and its methyl- and n-octyl-functionalized derivatives","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1199","1206","10.1107/S2056989023010101","","","1.54178","CuKα","","0.0947","0.0659","","","0.1624","0.1849","","","","","","1.049","","","","has coordinates,has disorder,has Fobs","287920","2023-12-01","03:11:01",""
"2022956","12.364","0.007","11.148","0.005","13.898","0.007","90","","96.5","0.019","90","","1903.3","1.7","303","2","303","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","1,4-diazepane","2,7-Bis(4-chlorophenyl)-3,3-dimethyl-1,4-diazepan-5-one","","- C19 H20 Cl2 N2 O -","- C19 H20 Cl2 N2 O -","- C76 H80 Cl8 N8 O4 -","4","1","JW2001","Akila, Shanmugasundaram; Vidhyasagar, Thankakan; Winfred Jebaraj, John Peter; Thiruvalluvar, Aravazhi Amalan; Rajeswari, Krishnan","Synthesis, crystal structure and computational analysis of 2,7-bis(4-chlorophenyl)-3,3-dimethyl-1,4-diazepan-5-one","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1212","1217","10.1107/S2056989023010162","","","0.71073","MoKα","","0.0902","0.0487","","","0.1046","0.1275","","","","","","1.026","","","","has coordinates,has disorder,has Fobs","287921","2023-12-01","03:11:46",""
"2022957","23.5743","0.0002","7.7286","0.0001","19.726","0.0002","90","","103.858","0.001","90","","3489.39","0.07","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(benzene-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')bis(benzene-1,2-diamine-κ<i>N</i>)cadmium(II) naphthalene-1,5-disulfonate","","- C34 H38 Cd N8 O6 S2 -","- C34 H38 Cd N8 O6 S2 -","- C136 H152 Cd4 N32 O24 S8 -","4","0.5","DJ2067","Suyunov, Jabbor; Torambetov, Batirbay; Turaev, Khayit; Kadirova, Shakhnoza; Alimnazarov, Bekmurod; Ashurov, Jamshid","Synthesis, crystal structure and Hirshfeld surface analysis of a cadmium complex of naphthalene-1,5-disulfonate and o-phenylenediamine","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1190","1193","10.1107/S2056989023010125","","x-ray","1.54184","CuKα","","0.023","0.0225","","","0.0602","0.0605","","","","","","1.04","","","","has coordinates,has Fobs","287922","2023-12-01","03:12:17",""
"2022958","5.3854","0.0013","5.3676","0.0013","17.051","0.004","90","","90","","90","","492.9","0.2","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","Dioxidodibismuth(III) hydroxide nitrate","","- Bi2 H N O6 -","- Bi2 N O6 -","- Bi8 N4 O24 -","4","1","HB8084","Weil, Matthias; Missen, Owen P.; Mills, Stuart J.","Dimorphism of [Bi2O2(OH)](NO3) – the ordered Pna21 structure at 100 K","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1223","1227","10.1107/S205698902301023X","","","0.71073","MoKα","","0.038","0.0298","","","0.055","0.0574","","","","","","0.984","","","","has coordinates,has Fobs","287923","2023-12-01","03:12:50",""
"2023078","11.467","0.0002","8.4852","0.0002","20.4823","0.0004","90","","105.135","0.002","90","","1923.8","0.07","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dimethyl 4'-bromo-3-oxo-5-(thiophen-2-yl)-3,4,5,6-tetrahydro-[1,1'-biphenyl]-2,4-dicarboxylate","","- C20 H17 Br O5 S -","- C20 H17 Br O5 S -","- C80 H68 Br4 O20 S4 -","4","1","NX2007","Naghiyev, Farid N.; Khrustalev, Victor N.; Akkurt, Mehmet; Asadov, Khammed A.; Bhattarai, Ajaya; Khalilov, Ali N.; Mamedov, İbrahim G.","Crystal structure and Hirshfeld surface analysis of dimethyl 4′-bromo-3-oxo-5-(thiophen-2-yl)-3,4,5,6-tetrahydro-[1,1′-biphenyl]-2,4-dicarboxylate","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002858","","x-ray","0.71073","MoKα","","0.0441","0.0335","","","0.0827","0.0863","","","","","","1.023","","","","has coordinates,has disorder","291079","2024-04-05","01:56:14",""
"2023079","10.7082","0.0008","7.027","0.0006","13.882","0.001","90","","91.679","0.01","90","","1044.12","0.14","183","2","183","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-Cyano-2-isonitrosoacetamide–3,4-dimethylpyrazole (1/1)","2-Cyano-2-isonitrosoacetamide–3,4-dimethylpyrazole (1/1)","","- C8 H11 N5 O2 -","- C8 H11 N5 O2 -","- C32 H44 N20 O8 -","4","1","HB8093","Domasevitch, Kostiantyn V.; Senchyk, Ganna A.; Ponomarova, Vira V.; Lysenko, Andrey B.; Krautscheid, Harald","2-Cyano-2-isonitrosoacetamide–3,4-dimethylpyrazole (1/1): a co-crystal of two molecules with agrochemical activities","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002809","","x-ray","1.54186","CuKα","","0.0726","0.0474","","","0.1149","0.1278","","","","","","0.993","","","","has coordinates","291080","2024-04-05","01:56:29",""
"2023080","7.4584","0.0002","7.7429","0.0003","13.2461","0.0003","103.025","0.002","98.735","0.002","90.769","0.002","735.73","0.04","123","","123","","","","","","","","","4","P -1","-P 1","2","cis-Jasmone 4-ethylthiosemicarbazone","<i>N</i>-Ethyl-2-{3-methyl-2-[(2<i>Z</i>)-pent-2-en-1-yl]cyclopent-2-en-1-ylidene}hydrazinecarbothioamide","","- C14 H23 N3 S -","- C14 H23 N3 S -","- C28 H46 N6 S2 -","2","1","YZ2054","Oliveira, Adriano Bof de; Beck, Johannes; Daniels, Jörg","Synthesis, crystal structure and Hirshfeld analysis of N-ethyl-2-{3-methyl-2-[(2Z)-pent-2-en-1-yl]cyclopent-2-en-1-ylidene}hydrazinecarbothioamide","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002913","","x-ray","0.71073","MoKα","","0.0447","0.0341","","","0.0787","0.0845","","","","","","1.019","","","","has coordinates,has disorder","291156","2024-04-10","02:02:25",""
"2023081","7.1686","0.0005","4.8491","0.0003","19.1276","0.0014","90","","90","","90","","664.9","0.08","100","2","100","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","5-Hydroxypentanehydrazide","","- C5 H12 N2 O2 -","- C5 H12 N2 O2 -","- C20 H48 N8 O8 -","4","1","VM2296","Justen, Guilherme Augusto; Carneiro Neto, José Severiano; Sousa Santana, Francielli; Leiriane Batistel Ribas, Maria; Gomes da Silva de Paula, Felipe; Dario, Priscila Paola; Gonçalves Montes D'Oca, Marcelo","Crystal structure and Hirshfeld surface analysis of 5-hydroxypentanehydrazide","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002871","","","0.71073","MoKα","","0.023","0.022","","","0.0583","0.0587","","","","","","1.083","","","","has coordinates","291157","2024-04-10","02:02:42",""
"2023082","8.2816","0.0002","17.4856","0.0003","14.9186","0.0003","90","","104.478","0.002","90","","2091.74","0.08","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(1<i>H</i>-Imidazole-κ<i>N</i>^3^)[4-methyl-2-({[2-oxido-5-(2-phenyldiazen-1-yl)phenyl]methylidene}amino)pentanoate-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']copper(II)","","- C22 H23 Cu N5 O3 -","- C22 H23 Cu N5 O3 -","- C88 H92 Cu4 N20 O12 -","4","2","EE2005","Kaneda, Ai; Suzuki, Soma; Nakane, Daisuke; Kashiwagi, Yukiyasu; Akitsu, Takashiro","Crystal structure and Hirshfeld surface analysis of (1H-imidazole-κN 3)[4-methyl-2-({[2-oxido-5-(2-phenyldiazen-1-yl)phenyl]methylidene}amino)pentanoate-κ3 O,N,O′]copper(II)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002986","","x-ray","1.54184","CuKα","","0.0397","0.036","","","0.0932","0.0957","","","","","","1.052","","","","has coordinates","291225","2024-04-16","02:11:51",""
"2023083","11.902","0.0002","26.4007","0.0002","7.1933","0.0001","90","","104.299","0.001","90","","2190.26","0.05","100","0.1","100","0.1","","","","","","","","6","C 1 c 1","C -2yc","9","","Tris(2-methylpyridine <i>N</i>-oxide-κ<i>O</i>)bis(thiocyanato-κ<i>N</i>)cobalt(II)","","- C20 H21 Co N5 O3 S2 -","- C20 H21 Co N5 O3 S2 -","- C80 H84 Co4 N20 O12 S8 -","4","1","JP2003","Näther, Christian; Jess, Inke","Synthesis, crystal structure and properties of the trigonal–bipyramidal complex tris(2-methylpyridine N-oxide-κO)bis(thiocyanato-κN)cobalt(II)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024003050","","x-ray","1.54184","CuKα","","0.0334","0.0331","","","0.0887","0.089","","","","","","1.037","","","","has coordinates","291226","2024-04-16","02:12:09",""
"2023084","10.6861","0.0004","13.0639","0.0005","15.7006","0.0006","96.304","0.002","107.142","0.002","110.766","0.002","1901.24","0.13","297","2","297","2","","","","","","","","6","P -1","-P 1","2","","(1<i>H</i>-Imidazole){tris[(1-benzyltriazol-4-yl-κ<i>N</i>^3^)methyl]amine-κ<i>N</i>}cobalt(II) bis(tetrafluoroborate)","","- C33 H34 B2 Co F8 N12 -","- C33 H34 B2 Co F8 N12 -","- C66 H68 B4 Co2 F16 N24 -","2","1","JY2045","Batra, Vipul; Reed, Garrett C.; Tierney, David L.","Structure of the five-coordinate CoII complex (1H-imidazole){tris[(1-benzyltriazol-4-yl-κN 3)methyl]amine-κN}cobalt(II) bis(tetrafluoroborate)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S205698902400330X","","","0.71073","MoKα","","0.0707","0.0491","","","0.1084","0.1178","","","","","","1.037","","","","has coordinates,has disorder","291288","2024-04-19","04:39:07",""
"2023085","12.5716","0.0006","8.394","0.0003","20.3319","0.0007","90","","90","","90","","2145.54","0.15","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Trichlorido(4-methylpiperidine)gold(III)","","- C6 H13 Au Cl3 N -","- C6 H13 Au Cl3 N -","- C48 H104 Au8 Cl24 N8 -","8","1","PK2705","Döring, Cindy; Jones, Peter G.","Crystal structures of trichlorido(4-methylpiperidine)gold(III) and two polymorphs of tribromido(4-methylpiperidine)gold(III)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002822","","","0.71073","MoKα","","0.0426","0.0242","","","0.0383","0.0419","","","","","","1.046","","","","has coordinates","291289","2024-04-19","04:39:37",""
"2023086","9.9871","0.0005","7.1505","0.0004","15.716","0.0008","90","","90","","90","","1122.32","0.1","100","2","100","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Tribromido(4-methylpiperidine)gold(III)","","- C6 H13 Au Br3 N -","- C6 H13 Au Br3 N -","- C24 H52 Au4 Br12 N4 -","4","0.5","PK2705","Döring, Cindy; Jones, Peter G.","Crystal structures of trichlorido(4-methylpiperidine)gold(III) and two polymorphs of tribromido(4-methylpiperidine)gold(III)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002822","","","0.71073","MoKα","","0.0422","0.0295","","","0.0472","0.0504","","","","","","1.11","","","","has coordinates","291289","2024-04-19","04:39:38",""
"2023087","12.6471","0.0005","8.7247","0.0003","21.0262","0.0007","90","","90","","90","","2320.08","0.14","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Tribromido(4-methylpiperidine)gold(III)","","- C6 H13 Au Br3 N -","- C6 H13 Au Br3 N -","- C48 H104 Au8 Br24 N8 -","8","1","PK2705","Döring, Cindy; Jones, Peter G.","Crystal structures of trichlorido(4-methylpiperidine)gold(III) and two polymorphs of tribromido(4-methylpiperidine)gold(III)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002822","","","0.71073","MoKα","","0.052","0.0294","","","0.0388","0.0429","","","","","","1.035","","","","has coordinates","291289","2024-04-19","04:39:38",""
"2023088","10.2188","0.0005","10.7365","0.0005","20.4119","0.001","84.376","0.002","89.298","0.002","70.167","0.002","2095.97","0.18","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","2,4-Diamino-6-[(1<i>Z</i>,3<i>E</i>)-1-cyano-2,4-diphenylpenta-1,3-dien-1-yl]pyridine-3,5-dicarbonitrile monohydrate","","- C25 H20 N6 O -","- C25 H20 N6 O -","- C100 H80 N24 O4 -","4","2","OX2003","Mamedov, İbrahim G.; Khrustalev, Victor N.; Akkurt, Mehmet; Kerimli, Fuad Sh.; Bhattarai, Ajaya; Khalilov, Ali N.; Naghiyev, Farid N.","Crystal structure and Hirshfeld surface analysis of 2,4-diamino-6-[(1Z,3E)-1-cyano-2,4-diphenylpenta-1,3-dien-1-yl]pyridine-3,5-dicarbonitrile monohydrate","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002962","","","0.71073","MoKα","","0.0717","0.0492","","","0.1264","0.1433","","","","","","1.016","","","","has coordinates","291290","2024-04-19","04:39:59",""
"2023089","11.46665","0.00013","12.37103","0.00015","13.58185","0.00017","90","","97.0894","0.0011","90","","1911.91","0.04","100","0.1","100","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(μ-4-methylpyridine <i>N</i>-oxide-κ^2^<i>O</i>:<i>O</i>)bis[(methanol-κ<i>O</i>)(4-methylpyridine <i>N</i>-oxide-κ<i>O</i>)bis(thiocyanato-κ<i>N</i>)cobalt(II)]","","- C30 H36 Co2 N8 O6 S4 -","- C30 H36 Co2 N8 O6 S4 -","- C60 H72 Co4 N16 O12 S8 -","2","0.5","JP2005","Näther, Christian; Jess, Inke","Synthesis, crystal structure and thermal properties of the dinuclear complex bis(μ-4-methylpyridine N-oxide-κ2 O:O)bis[(methanol-κO)(4-methylpyridine N-oxide-κO)bis(thiocyanato-κN)cobalt(II)]","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024003128","","x-ray","1.54184","CuKα","","0.0385","0.0376","","","0.1024","0.103","","","","","","1.087","","","","has coordinates","291291","2024-04-19","04:40:15",""
"2023090","16.1699","0.0007","21.1139","0.001","30.0046","0.0014","90","","91.576","0.002","90","","10240","0.8","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis[tris(diisobutyldithiocarbamato)-μ~3~-sulfido-tri-μ~2~-disulfido-trimolybdenum(IV)] sulfide tetrahydrofuran monosolvate","","- C54 H108 Mo6 N6 S27 -","- C54 H108 Mo6 N6 S27 -","- C216 H432 Mo24 N24 S108 -","4","1","OI2005","Fraker, Addison; Donahue, James P.; McSkimming, Alex","Bis[tris(diisobutyldithiocarbamato)-μ3-sulfido-tri-μ2-disulfido-trimolybdenum(IV)] sulfide tetrahydrofuran monosolvate","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002949","","","1.54178","CuKα","","0.0434","0.0379","","","0.084","0.0889","","","","","","1.146","","","","has coordinates,has disorder","291292","2024-04-19","04:40:53",""
"2023091","5.77","0.0001","8.3069","0.0002","14.6243","0.0005","82.891","0.002","87.004","0.004","74.172","0.002","669.07","0.03","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","4-[(1<i>E</i>)-1-[(Carbamothioylamino)imino]ethyl]phenyl propanoate","","- C12 H15 N3 O2 S -","- C12 H15 N3 O2 S -","- C24 H30 N6 O4 S2 -","2","1","WM5713","Madhan, Sundarasamy; NizamMohideen, Mohamed; Viswanathan, Vijayan; Karthik Ananth, Mani; Narasimhan, Srinivasan","Synthesis, crystal structure and Hirshfeld surface analysis of 4-{(1E)-1-[(carbamothioylamino)imino]ethyl}phenyl propanoate","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024003177","","","0.71073","MoKα","","0.0859","0.0654","","","0.1994","0.2189","","","","","","1.089","","","","has coordinates,has disorder","291293","2024-04-19","04:41:11",""
"2023092","10.178","0.002","5.9156","0.0011","7.7158","0.0014","90","","112.658","0.014","90","","428.71","0.15","296","2","296","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Ammonium trinickel(II) hydrogen arsenate arsenate dihydroxide","","- As2 H7 N Ni3 O10 -","- As2 H3 N Ni3 O10 -","- As4 H6 N2 Ni6 O20 -","2","0.25","HB8094","Eder, Felix; Weil, Matthias","Synthesis and crystal structure of (NH4)[Ni3(HAsO4)(AsO4)(OH)2]","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024003487","","","0.71073","MoKα","","0.095","0.0675","","","0.1984","0.2288","","","","","","1.04","","","","has coordinates","291378","2024-04-27","01:54:33",""
"2023093","9.427","0.0005","9.4386","0.0004","12.3849","0.0007","95.392","0.003","96.849","0.003","106.512","0.003","1039.49","0.09","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","(<i>Z</i>)-4-({[2-(Benzo[<i>b</i>]thiophen-3-yl)cyclopent-1-en-1-yl]methyl}(phenyl)amino)-4-oxobut-2-enoic acid","","- C24 H21 N O3 S -","- C24 H21 N O3 S -","- C48 H42 N2 O6 S2 -","2","1","NX2009","Yakovleva, Elizaveta D.; Shelukho, Evgeniya R.; Grigoriev, Mikhail S.; Hasanov, Khudayar I.; Sadikhova, Nurlana D.; Akkurt, Mehmet; Bhattarai, Ajaya","Crystal structure and Hirshfeld surface analysis of (Z)-4-({[2-(benzo[b]thiophen-3-yl)cyclopent-1-en-1-yl]methyl}(phenyl)amino)-4-oxobut-2-enoic acid","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024003232","","","0.71073","MoKα","","0.1126","0.0488","","","0.0932","0.1147","","","","","","0.991","","","","has coordinates","291379","2024-04-27","01:54:49",""
"2023094","9.226","0.0006","12.7703","0.0009","18.6607","0.0013","109.79","0.006","96.72","0.006","90.657","0.006","2051.4","0.3","100","2","100","0.1","","","","","","","","5","P -1","-P 1","2","","(<i>E</i>)-<i>N</i>-(4-Bromophenyl)-2-cyano-3-[3-(2-methylpropyl)-1-phenyl-1<i>H</i>-pyrazol-4-yl]prop-2-enamide","","- C23 H21 Br N4 O -","- C23 H21 Br N4 O -","- C92 H84 Br4 N16 O4 -","4","2","JP2004","Abu-Zaied, Mamdouh A.; Mohamed-Ezzat, Reham A.; Elgemeie, Galal H.; Jones, Peter G.","Crystal structure of (E)-N-(4-bromophenyl)-2-cyano-3-[3-(2-methylpropyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enamide","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024003086","","x-ray","1.54184","CuKα","","0.0403","0.0395","","","0.1015","0.1022","","","","","","1.05","","","","has coordinates","291380","2024-04-27","01:55:06",""
"2023095","13.3577","0.0005","10.0877","0.0003","13.9182","0.0005","90","","106.29","0.004","90","","1800.16","0.11","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(Chlorosulfanyl)tris(propan-2-yl)phosphonium tetrachloridoaurate(III)","","- C9 H21 Au Cl5 P S -","- C9 H21 Au Cl5 P S -","- C36 H84 Au4 Cl20 P4 S4 -","4","1","YZ2053","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002780","","","0.71073","MoKα","","0.0512","0.0403","","","0.0963","0.1023","","","","","","1.079","","","","has coordinates","291382","2024-04-27","01:57:00",""
"2023096","7.5619","0.0004","8.7408","0.0004","15.4558","0.0006","84.346","0.004","78.306","0.004","66.915","0.005","920.07","0.08","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","(<i>tert</i>-Butyl)(chlorosulfanyl)bis(propan-2-yl)phosphonium tetrachloridoaurate(III)","","- C10 H23 Au Cl5 P S -","- C10 H23 Au Cl5 P S -","- C20 H46 Au2 Cl10 P2 S2 -","2","1","YZ2053","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002780","","","0.71073","MoKα","","0.0212","0.0166","","","0.0342","0.036","","","","","","1.049","","","","has coordinates","291382","2024-04-27","01:57:04",""
"2023097","33.653","0.003","7.7933","0.0003","16.212","0.002","90","","113.861","0.008","90","","3888.5","0.7","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(<i>tert</i>-butyl)(chlorosulfanyl)(propan-2-yl)phosphonium tetrachloridoaurate(III)","","- C11 H25 Au Cl5 P S -","- C11 H25 Au Cl5 P S -","- C88 H200 Au8 Cl40 P8 S8 -","8","1","YZ2053","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002780","","","0.71073","MoKα","","0.0523","0.0331","","","0.0582","0.0636","","","","","","1.041","","","","has coordinates","291382","2024-04-27","01:57:05",""
"2023098","9.7661","0.0003","12.5787","0.0003","16.9776","0.0005","90","","103.887","0.003","90","","2024.65","0.1","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Tris(<i>tert</i>-butyl)(chlorosulfanyl)phosphonium tetrachloridoaurate(III)","","- C12 H27 Au Cl5 P S -","- C12 H27 Au Cl5 P S -","- C48 H108 Au4 Cl20 P4 S4 -","4","1","YZ2053","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002780","","","0.71073","MoKα","","0.0731","0.0223","","","0.0421","0.0449","","","","","","0.767","","","","has coordinates","291382","2024-04-27","01:57:06",""
"2023099","7.4202","0.0003","8.5966","0.0003","15.398","0.0006","97.497","0.003","100.128","0.004","109.324","0.004","893.42","0.07","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","(Chloroselanyl)tris(propan-2-yl)phosphonium tetrachloridoaurate(III)","","- C9 H21 Au Cl5 P Se -","- C9 H21 Au Cl5 P Se -","- C18 H42 Au2 Cl10 P2 Se2 -","2","1","YZ2053","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002780","","","0.71073","MoKα","","0.0194","0.0157","","","0.0317","0.0327","","","","","","1.101","","","","has coordinates","291382","2024-04-27","01:57:07",""
"2023100","7.5836","0.0002","8.7603","0.0002","15.4719","0.0006","84.445","0.003","78.641","0.003","67.128","0.003","928.27","0.05","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","(<i>tert</i>-Butyl)(chloroselanyl)bis(propan-2-yl)phosphonium tetrachloridoaurate(III)","","- C10 H23 Au Cl5 P Se -","- C10 H23 Au Cl5 P Se -","- C20 H46 Au2 Cl10 P2 Se2 -","2","1","YZ2053","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002780","","","0.71073","MoKα","","0.0252","0.0208","","","0.052","0.0544","","","","","","1.052","","","","has coordinates","291382","2024-04-27","01:57:07",""
"2023101","33.7472","0.0006","7.79306","0.00008","16.2575","0.0003","90","","113.582","0.003","90","","3918.56","0.14","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(<i>tert</i>-butyl)(chloroselanyl)(propan-2-yl)phosphonium tetrachloridoaurate(III)","","- C11 H25 Au Cl5 P Se -","- C11 H25 Au Cl5 P Se -","- C88 H200 Au8 Cl40 P8 Se8 -","8","1","YZ2053","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002780","","","0.71073","MoKα","","0.0276","0.0209","","","0.0408","0.0428","","","","","","1.107","","","","has coordinates","291382","2024-04-27","01:57:07",""
"2023102","7.8543","0.0004","8.0592","0.0004","15.3505","0.0007","76.717","0.004","83.169","0.004","87.722","0.004","938.89","0.08","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","(Bromosulfanyl)tris(propan-2-yl)phosphonium tetrabromidoaurate(III)","","- C9 H21 Au Br5 P S -","- C9 H21 Au Br5 P S -","- C18 H42 Au2 Br10 P2 S2 -","2","1","YZ2053","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002780","","","0.71073","MoKα","","0.0267","0.0208","","","0.0386","0.04","","","","","","1.081","","","","has coordinates","291382","2024-04-27","01:57:08",""
"2023103","7.8455","0.0006","9.138","0.0006","15.544","0.0009","86.6","0.005","81.097","0.006","64.862","0.006","996.66","0.13","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","(Bromosulfanyl)(<i>tert</i>-butyl)bis(propan-2-yl)phosphonium tetrabromidoaurate(III)","","- C10 H23 Au Br5 P S -","- C10 H23 Au Br5 P S -","- C20 H46 Au2 Br10 P2 S2 -","2","1","YZ2053","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002780","","","0.71073","MoKα","","0.0339","0.0269","","","0.049","0.052","","","","","","1.061","","","","has coordinates","291382","2024-04-27","01:57:08",""
"2023104","12.4712","0.0004","10.3712","0.0003","16.2524","0.0005","90","","92.724","0.003","90","","2099.73","0.11","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(Bromosulfanyl)bis(<i>tert</i>-butyl)(propan-2-yl)phosphonium tetrabromidoaurate(III)","","- C11 H25 Au Br5 P S -","- C11 H25 Au Br5 P S -","- C44 H100 Au4 Br20 P4 S4 -","4","1","YZ2053","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002780","","","0.71073","MoKα","","0.0498","0.0328","","","0.0568","0.061","","","","","","1.09","","","","has coordinates","291382","2024-04-27","01:57:08",""
"2023105","10.2218","0.0005","10.8085","0.0006","11.1163","0.0005","70.909","0.004","71.516","0.005","75.645","0.004","1086.39","0.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","(Bromosulfanyl)tris(<i>tert</i>-butyl)phosphonium tetrabromidoaurate(III)","","- C12 H27 Au Br5 P S -","- C12 H27 Au Br5 P S -","- C24 H54 Au2 Br10 P2 S2 -","2","1","YZ2053","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002780","","","0.71073","MoKα","","0.0486","0.0316","","","0.0604","0.0659","","","","","","1.054","","","","has coordinates","291382","2024-04-27","01:57:09",""
"2023106","7.9212","0.0004","8.0606","0.0004","15.2911","0.0008","76.817","0.005","82.668","0.005","87.728","0.004","942.77","0.09","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","(Bromoselanyl)tris(propan-2-yl)phosphonium tetrabromidoaurate(III)","","- C9 H21 Au Br5 P Se -","- C9 H21 Au Br5 P Se -","- C18 H42 Au2 Br10 P2 Se2 -","2","1","YZ2053","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002780","","","0.71073","MoKα","","0.0347","0.0244","","","0.0423","0.0447","","","","","","1.057","","","","has coordinates","291382","2024-04-27","01:57:09",""
"2023107","7.8155","0.0003","9.1505","0.0003","15.5221","0.0005","85.965","0.002","80.294","0.003","66.049","0.003","999.97","0.06","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","(Bromoselanyl)(<i>tert</i>-butyl)bis(propan-2-yl)phosphonium tetrabromidoaurate(III)","","- C10 H23 Au Br5 P Se -","- C10 H23 Au Br5 P Se -","- C20 H46 Au2 Br10 P2 Se2 -","2","1","YZ2053","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002780","","","0.71073","MoKα","","0.0312","0.0245","","","0.0593","0.0629","","","","","","1.036","","","","has coordinates","291382","2024-04-27","01:57:09",""
"2023108","12.3529","0.0004","10.4233","0.0004","16.4635","0.0005","90","","93.453","0.003","90","","2115.96","0.12","101","2","101","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(Bromoselanyl)bis(<i>tert</i>-butyl)(propan-2-yl)phosphonium tetrabromidoaurate(III)","","- C11 H25 Au Br5 P Se -","- C11 H25 Au Br5 P Se -","- C44 H100 Au4 Br20 P4 Se4 -","4","1","YZ2053","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024002780","","","0.71073","MoKα","","0.0793","0.0337","","","0.057","0.0613","","","","","","0.812","","","","has coordinates","291382","2024-04-27","01:57:09",""
"2023109","7.0415","0.0003","17.9349","0.0008","9.0148","0.0005","90","","100.812","0.002","90","","1118.26","0.09","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Di-μ-hydroxido-bis[dibromido(dimethylformamide-κ<i>O</i>)ethyltin(IV)]","","- C10 H26 Br4 N2 O4 Sn2 -","- C10 H26 Br4 N2 O4 Sn2 -","- C20 H52 Br8 N4 O8 Sn4 -","2","0.5","YY2010","Klecker, Christopher Jan; Reuter, Hans","Dimeric ethyltin(IV)–dibromide–hydroxide–N,N-dimethylformamide","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024003268","","","0.71073","MoKα","","0.022","0.0181","","","0.0448","0.0461","","","","","","1.067","","","","has coordinates","291383","2024-04-27","01:57:51",""
"2023110","17.764","0.003","8.4429","0.0012","11.6601","0.0016","90","","100.948","0.004","90","","1717","0.4","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-[(4-Hydroxyphenyl)amino]-5,5-diphenyl-1<i>H</i>-imidazol-4(5<i>H</i>)-one","","- C21 H17 N3 O2 -","- C21 H17 N3 O2 -","- C84 H68 N12 O8 -","4","1","VM2300","El Moutaouakil Ala Allah, Abderrazzak; Guerrab, Walid; Mague, Joel T.; Alsubari, Abdulsalam; Alzahrani, Abdullah Yahya Abdullah; Ramli, Youssef","Synthesis, crystal structure and Hirshfeld surface analysis of 2-[(4-hydroxyphenyl)amino]-5,5-diphenyl-1H-imidazol-4(5H)-one","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024003499","","","0.71073","MoKα","","0.1042","0.0546","","","0.1125","0.1319","","","","","","1.035","","","","has coordinates","291384","2024-04-27","01:58:04",""
"2023111","8.5194","0.0007","18.1257","0.0013","9.0875","0.0008","90","","105.106","0.003","90","","1354.8","0.19","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","<i>N</i>,2,4,6-Tetramethylanilinium trifluoromethanesulfonate","","- C11 H16 F3 N O3 S -","- C11 H16 F3 N O3 S -","- C44 H64 F12 N4 O12 S4 -","4","1","EJ2004","Stewart, John W.; Irons, Elena M.; Osorio Abanto, Giovanna; Zeller, Matthias; Zaleski, Curtis M.; Predecki, Daniel P.","Synthesis and crystal structures of N,2,4,6-tetramethylanilinium trifluoromethanesulfonate and N-isopropylidene-N,2,4,6-tetramethylanilinium trifluoromethanesulfonate","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024003438","","","0.71073","MoKα","","0.0813","0.0473","","","0.1179","0.1326","","","","","","1.033","","","","has coordinates","291385","2024-04-27","01:58:23",""
"2023112","6.858","0.0004","19.4619","0.0012","12.6131","0.0007","90","","102.024","0.002","90","","1646.53","0.17","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","<i>N</i>-Isopropylidene-<i>N</i>,2,4,6-tetramethylanilinium trifluoromethanesulfonate","","- C14 H20 F3 N O3 S -","- C14 H20 F3 N O3 S -","- C56 H80 F12 N4 O12 S4 -","4","1","EJ2004","Stewart, John W.; Irons, Elena M.; Osorio Abanto, Giovanna; Zeller, Matthias; Zaleski, Curtis M.; Predecki, Daniel P.","Synthesis and crystal structures of N,2,4,6-tetramethylanilinium trifluoromethanesulfonate and N-isopropylidene-N,2,4,6-tetramethylanilinium trifluoromethanesulfonate","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","","","10.1107/S2056989024003438","","","0.71073","MoKα","","0.0649","0.0454","","","0.125","0.1356","","","","","","1.044","","","","has coordinates","291385","2024-04-27","01:58:24",""
"2023113","7.9462","0.0005","26.5977","0.0012","5.186","0.0002","90","","100.613","0.005","90","","1077.31","0.09","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Chlorido(η^2^-ethylene)(quinolin-8-olato-κ^2^<i>N</i>,<i>O</i>)platinum(II)","","- C11 H10 Cl N O Pt -","- C11 H10 Cl N O Pt -","- C44 H40 Cl4 N4 O4 Pt4 -","4","1","OI2006","Chi, Nguyen Thi Thanh; Tuan Cuong, Ngo; Thu Trang, Tran; Van Thong, Pham; Linh, Nguyen Thi Bang; Ly, Nguyen Thi Khanh; Van Meervelt, Luc","Synthesis, crystal structure and anticancer activity of the complex chlorido(η2-ethylene)(quinolin-8-olato-κ2 N,O)platinum(II) by experimental and theoretical methods","Acta Crystallographica Section E Crystallographic Communications","2024","80","5","550","554","10.1107/S2056989024003748","","x-ray","0.71073","MoKα","","0.0433","0.0329","","","0.0695","0.0762","","","","","","1.086","","","","has coordinates","291431","2024-05-01","01:46:59",""
"2023114","10.1542","0.0003","11.9156","0.0003","11.9964","0.0004","75.221","0.001","88.341","0.001","81.751","0.001","1388.9","0.07","100","","100","","","","","","","","","4","P -1","-P 1","2","","5,17-Dibromo-26,28-dihydroxy-25,27-dipropynyloxycalix[4]arene","","- C34 H26 Br2 O4 -","- C34 H26 Br2 O4 -","- C68 H52 Br4 O8 -","2","1","WM5716","Gorbunov, Alexander; Bezzubov, Stanislav; Malakhova, Maria; Kovalev, Vladimir; Vatsouro, Ivan","Synthesis and crystal structures of 5,17-dibromo-26,28-dihydroxy-25,27-dipropynyloxycalix[4]arene, 5,17-dibromo-26,28-dipropoxy-25,27-dipropynyloxycalix[4]arene and 25,27-bis(2-azidoethoxy)-5,17-dibromo-26,28-dihydroxycalix[4]arene","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024003785","","x-ray","0.71073","MoKα","","0.0535","0.0357","","","0.0814","0.0871","","","","","","1.042","","","","has coordinates,has disorder","291490","2024-05-04","01:52:20",""
"2023115","18.1223","0.0007","9.984","0.0004","18.2863","0.0007","90","","90","","90","","3308.6","0.2","100","","100","","","","","","","","","4","P b c n","-P 2n 2ab","60","","5,17-Dibromo-26,28-dipropoxy-25,27-dipropynyloxycalix[4]arene","","- C40 H38 Br2 O4 -","- C40 H38 Br2 O4 -","- C160 H152 Br8 O16 -","4","0.5","WM5716","Gorbunov, Alexander; Bezzubov, Stanislav; Malakhova, Maria; Kovalev, Vladimir; Vatsouro, Ivan","Synthesis and crystal structures of 5,17-dibromo-26,28-dihydroxy-25,27-dipropynyloxycalix[4]arene, 5,17-dibromo-26,28-dipropoxy-25,27-dipropynyloxycalix[4]arene and 25,27-bis(2-azidoethoxy)-5,17-dibromo-26,28-dihydroxycalix[4]arene","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024003785","","x-ray","0.71073","MoKα","","0.0446","0.0298","","","0.0642","0.069","","","","","","1.036","","","","has coordinates","291490","2024-05-04","01:52:21",""
"2023116","36.3261","0.0007","36.3261","0.0007","12.1054","0.0004","90","","90","","120","","13834","0.6","100","","100","","","","","","","","","5","R -3 :H","-R 3","148","","25,27-Bis(2-azidoethoxy)-5,17-dibromo-26,28-dihydroxycalix[4]arene","","- C32 H28 Br2 N6 O4 -","- C32 H28 Br2 N6 O4 -","- C576 H504 Br36 N108 O72 -","18","1","WM5716","Gorbunov, Alexander; Bezzubov, Stanislav; Malakhova, Maria; Kovalev, Vladimir; Vatsouro, Ivan","Synthesis and crystal structures of 5,17-dibromo-26,28-dihydroxy-25,27-dipropynyloxycalix[4]arene, 5,17-dibromo-26,28-dipropoxy-25,27-dipropynyloxycalix[4]arene and 25,27-bis(2-azidoethoxy)-5,17-dibromo-26,28-dihydroxycalix[4]arene","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024003785","","x-ray","0.71073","MoKα","","0.0584","0.0397","","","0.0901","0.0974","","","","","","1.031","","","","has coordinates","291490","2024-05-04","01:52:22",""
"2023117","8.1208","0.0013","8.2262","0.0014","9.5944","0.0015","73.338","0.004","72.167","0.004","62.966","0.004","535.19","0.15","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","1-(6-Amino-5-nitronaphthalen-2-yl)ethanone","","- C12 H10 N2 O3 -","- C12 H10 N2 O3 -","- C24 H20 N4 O6 -","2","1","ZN2036","Shi, Xin-Wei; Bai, Ming-sheng; Zheng, Shao-Jun; Lu, Qiang-Qiang; Li, Gen; Zhou, Ya-Fu","Crystal structure characterization, Hirshfeld surface analysis, and DFT calculation studies of 1-(6-amino-5-nitronaphthalen-2-yl)ethanone","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024003797","","","0.71073","MoKα","","0.0638","0.0505","","","0.1337","0.148","","","","","","1.033","","","","has coordinates","291491","2024-05-04","01:52:39",""
"2023118","8.6173","0.0004","10.6265","0.0006","13.1312","0.0004","93.384","0.004","98.121","0.003","94.09","0.004","1184.45","0.09","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis{2-[5-(3,4,5-trimethoxyphenyl)-4<i>H</i>-1,2,4-triazol-3-yl]pyridine}palladium(II) bis(trifluoroacetate) trifluoroacetic acid disolvate","","- C40 H34 F12 N8 O14 Pd -","- C40 H34 F12 N8 O14 Pd -","- C40 H34 F12 N8 O14 Pd -","1","0.5","JW2005","Zakharchenko, Borys V.; Khomenko, Dmytro M.; Doroshchuk, Roman O.; Bargan, Alexandra; Vassilyeva, Olga Yu.; Lampeka, Rostyslav D.","Crystal structure of bis{2-[5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]pyridine}palladium(II) bis(trifluoroacetate) trifluoroacetic acid disolvate","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S205698902400392X","","","0.71073","MoKα","","0.0466","0.0415","","","0.091","0.0953","","","","","","1.04","","","","has coordinates,has disorder","291492","2024-05-04","01:52:51",""
"2023119","12.7521","0.0006","8.9648","0.0004","16.6801","0.001","90","","111.057","0.001","90","","1779.54","0.16","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(2-chloro-<i>N</i>,<i>N</i>-dimethylethan-1-aminium) tetrachloridocobaltate(II)","","- C8 H22 Cl6 Co N2 -","- C8 H22 Cl6 Co N2 -","- C32 H88 Cl24 Co4 N8 -","4","0.5","EV2006","McGinness, Katelyn; Minton, Kim; White, Katelyn; Bond, Marcus R.","Bis(2-chloro-N,N-dimethylethan-1-aminium) tetrachloridocobaltate(II) and tetrachloridozincate(II)","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024003955","","","0.71073","MoKα","","0.0428","0.0302","","","","0.064","","","","","","1.088","","","","has coordinates,has disorder","291815","2024-05-11","01:50:41",""
"2023120","12.7297","0.0007","8.9784","0.0005","16.6837","0.0011","90","","111.062","0.002","90","","1779.43","0.18","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(2-chloro-<i>N</i>,<i>N</i>-dimethylethan-1-aminium) tetrachloridozincate(II)","","- C8 H22 Cl6 N2 Zn -","- C8 H22 Cl6 N2 Zn -","- C32 H88 Cl24 N8 Zn4 -","4","0.5","EV2006","McGinness, Katelyn; Minton, Kim; White, Katelyn; Bond, Marcus R.","Bis(2-chloro-N,N-dimethylethan-1-aminium) tetrachloridocobaltate(II) and tetrachloridozincate(II)","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024003955","","","0.71073","MoKα","","0.0421","0.0327","","","","0.0701","","","","","","1.116","","","","has coordinates,has disorder","291815","2024-05-11","01:50:42",""
"2023121","9.8042","0.0008","9.4258","0.0008","15.4065","0.0013","90","","108.455","0.003","90","","1350.5","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(<i>Z</i>)-4-Oxo-4-{phenyl[(thiophen-2-yl)methyl]amino}but-2-enoic acid","","- C15 H13 N O3 S -","- C15 H13 N O3 S -","- C60 H52 N4 O12 S4 -","4","1","JY2046","Podrezova, Alexandra G.; Nikitina, Eugeniya V.; Grigoriev, Mikhail S.; Akkurt, Mehmet; Hasanov, Khudayar I.; Sadikhov, Nurlana D.; Bhattarai, Ajaya","Crystal structure and Hirshfeld surface analysis of (Z)-4-oxo-4-{phenyl[(thiophen-2-yl)methyl]amino}but-2-enoic acid","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024003967","","","0.71073","MoKα","","0.0536","0.0378","","","0.089","0.0974","","","","","","1.026","","","","has coordinates,has disorder","291816","2024-05-11","01:50:57",""
"2023122","11.023","0.0001","11.023","0.0001","34.4826","0.0004","90","","90","","120","","3628.53","0.06","297","2","297","2","","","","","","","","5","R -3 :H","-R 3","148","","Bis[hexakis(nitrato-κ^2^<i>O</i>,<i>O</i>')lanthanum(III)] tris[hexaaquanickel(II)] hexahydrate","","- H48 La2 N12 Ni3 O60 -","- H48 La2 N12 Ni3 O60 -","- H144 La6 N36 Ni9 O180 -","3","0.166667","TX2083","Bi, David Wenhua; Liu, Yong; Magrez, Arnaud","High-resolution crystal structure of the double nitrate hydrate [La(NO3)6]2[Ni(H2O)6]3·6H2O","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S205698902400327X","","","0.71073","MoKα","","0.0147","0.0134","","","0.0338","0.0342","","","","","","1.058","","","","has coordinates","291817","2024-05-11","01:51:13",""
"2023123","4.95281","0.00003","14.0515","0.0001","13.5208","0.0001","90","","95.1372","0.0006","90","","937.192","0.011","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(3<i>Z</i>)-4-[(4-Amino-1,2,5-oxadiazol-3-yl)amino]-3-bromo-1,1,1-trifluorobut-3-en-2-one","","- C6 H4 Br F3 N4 O2 -","- C6 H4 Br F3 N4 O2 -","- C24 H16 Br4 F12 N16 O8 -","4","1","TX2085","Guseinov, Firudin I.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Ovsyannikov, Viacheslav O.; Ugrak, Bogdan I.; Lavrova, Oksana M.; Samigullina, Aida I.; Bhattarai, Ajaya","Synthesis, crystal structure and Hirshfeld surface analysis of (3Z)-4-[(4-amino-1,2,5-oxadiazol-3-yl)amino]-3-bromo-1,1,1-trifluorobut-3-en-2-one","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024004080","","x-ray","1.54184","CuKα","","0.0278","0.0275","","","0.0649","0.0651","","","","","","1.093","","","","has coordinates,has disorder","291818","2024-05-11","01:51:27",""
"2023124","9.5331","0.0007","8.9358","0.0003","14.0279","0.0007","90","","107.49","0.007","90","","1139.73","0.12","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","4-Hydroxy-<i>N</i>,<i>N</i>-dimethyltryptamine","3-[2-(Dimethylamino)ethyl]-1<i>H</i>-indol-4-ol","","- C12 H16 N2 O -","- C12 H16 N2 O -","- C48 H64 N8 O4 -","4","1","HB8096","Zeller, Matthias; Parent, Stephan; Schultheiss, Nate","Structural characterization and comparative analysis of polymorphic forms of psilocin (4-hydroxy-N,N-dimethyltryptamine)","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024004201","","","1.54184","CuKα","","0.0785","0.0645","","","0.2089","0.2207","","","","","","1.132","","","","has coordinates,has disorder","291856","2024-05-15","01:58:40",""
"2023125","10.4041","0.0004","8.5286","0.0003","12.4087","0.0004","90","","92.5663","0.0019","90","","1099.95","0.07","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 N2 O -","- C12 H16 N2 O -","- C48 H64 N8 O4 -","4","1","HB8096","Zeller, Matthias; Parent, Stephan; Schultheiss, Nate","Structural characterization and comparative analysis of polymorphic forms of psilocin (4-hydroxy-N,N-dimethyltryptamine)","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024004201","","","0.71073","MoKα","","0.0652","0.0458","","","0.1248","0.1381","","","","","","1.054","","","","has coordinates","291856","2024-05-15","01:58:42",""
"2023126","10.6228","0.0005","8.4984","0.0004","12.5073","0.0005","90","","90.807","0.002","90","","1129.01","0.09","300","2","300","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 N2 O -","- C12 H16 N2 O -","- C48 H64 N8 O4 -","4","1","HB8096","Zeller, Matthias; Parent, Stephan; Schultheiss, Nate","Structural characterization and comparative analysis of polymorphic forms of psilocin (4-hydroxy-N,N-dimethyltryptamine)","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024004201","","","0.71073","MoKα","","0.0971","0.0523","","","0.1459","0.1715","","","","","","1.033","","","","has coordinates","291856","2024-05-15","01:58:42",""
"2023127","5.7032","0.0001","24.2184","0.0005","11.8683","0.0002","90","","91.312","0.002","90","","1638.85","0.05","160","0.1","160","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-[(1-Butyl-1<i>H</i>-1,2,3-triazol-4-yl)methyl]-3-(prop-1-en-2-yl)-1<i>H</i>-benzimidazol-2-one","","- C17 H21 N5 O -","- C17 H21 N5 O -","- C68 H84 N20 O4 -","4","1","WM5715","El Atrassi, Zakaria; Zouhair, Mustapha; Blacque, Olivier; Hökelek, Tuncer; Haoudi, Amal; Mazzah, Ahmed; Cherkaoui, Hassan; Sebbar, Nada Kheira","Crystal structure, Hirshfeld surface analysis, calculations of intermolecular interaction energies and energy frameworks and the DFT-optimized molecular structure of 1-[(1-butyl-1H-1,2,3-triazol-4-yl)methyl]-3-(prop-1-en-2-yl)-1H-benzimidazol-2-one","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024004043","","x-ray","1.54184","CuKα","","0.0409","0.0336","","","0.0803","0.0855","","","","","","1.051","","","","has coordinates","291857","2024-05-15","01:58:59",""
"2023128","12.2214","0.0002","7.023","0.0001","13.0537","0.0003","90","","94.511","0.002","90","","1116.94","0.04","100","","100","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","pentaaminecopper(II) chloride urea","Pentaaminecopper(II) dichloride–urea (1/1)","","- C H19 Cl2 Cu N7 O -","- C H19 Cl2 Cu N7 O -","- C4 H76 Cl8 Cu4 N28 O4 -","4","1","OO2003","Breen, Olivia D.; Keene, Tony D.","Crystal structure and Hirshfeld surface of a pentaaminecopper(II) complex with urea and chloride","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024004298","","x-ray","1.54184","CuKα","","0.035","0.0332","","","0.0903","0.092","","","","","","1.078","","","","has coordinates","291858","2024-05-15","01:59:17",""
"2023129","5.1052","0.0003","5.1052","0.0003","11.08","0.0007","90","","90","","90","","288.78","0.03","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Lithium lutetium bis[orthomolybdate(VI)]","","- Li Lu Mo2 O8 -","- Li Lu Mo2 O8 -","- Li2 Lu2 Mo4 O16 -","2","0.125","WM5719","Hartenbach, Ingo; Hertweck, Robin F.","Mixed occupancy: the crystal structure of scheelite-type LiLu[MoO4]2","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024004365","","x-ray","0.56083","AgKα","","0.0579","0.0186","","","0.0425","0.0483","","","","","","0.958","","","","has coordinates","291949","2024-05-18","01:51:20",""
"2023130","9.0384","0.0003","9.4484","0.0004","14.9524","0.0006","77.267","0.001","83.991","0.001","72.708","0.001","1188.16","0.08","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","1-[3-(2-Oxo-3-phenyl-1,2-dihydroquinoxalin-1-yl)propyl]-3-phenyl-1,2-dihydroquinoxalin-2-one","","- C31 H24 N4 O2 -","- C31 H24 N4 O2 -","- C62 H48 N8 O4 -","2","1","VM2302","Abad, Nadeem; Mague, Joel T.; Alsubari, Abdulsalam; Essassi, El Mokhtar; Alzahrani, Abdullah Yahya Abdullah; Ramli, Youssef","Synthesis, crystal structure and Hirshfeld surface analysis of 1-[3-(2-oxo-3-phenyl-1,2-dihydroquinoxalin-1-yl)propyl]-3-phenyl-1,2-dihydroquinoxalin-2-one","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024004377","","","0.71073","MoKα","","0.0665","0.0461","","","0.1319","0.1397","","","","","","1.081","","","","has coordinates","291950","2024-05-18","01:51:35",""
"2023131","16.9184","0.0013","6.523","0.0005","17.2645","0.0011","90","","111.822","0.004","90","","1768.8","0.2","150","2","150","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","3,3'-[Ethane-1,2-diylbis(oxy)]bis(5,5-dimethylcyclohex-2-en-1-one)","","- C18 H26 O4 -","- C18 H26 O4 -","- C72 H104 O16 -","4","0.5","NX2010","Sadikhova, Nurlana D.; Akkurt, Mehmet; Ismayilov, Valeh M.; Yusubov, Niftali N.; Hasanov, Khudayar I.; Bhattarai, Ajaya","Crystal structure and Hirshfeld surface analysis of 3,3′-[ethane-1,2-diylbis(oxy)]bis(5,5-dimethylcyclohex-2-en-1-one) including an unknown solvate","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024004286","","","0.71073","MoKα","","0.0672","0.0452","","","0.1066","0.118","","","","","","1.036","","","","has coordinates","291951","2024-05-18","01:51:49",""
"2023132","15.612","0.002","12.7649","0.0017","17.18","0.004","90","","116.243","0.005","90","","3070.8","0.9","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(4,4-dimethyl-2-phenyl-2-oxazoline-κ<i>N</i>)(hexamethyldisilylamido-κ<i>N</i>)lithium","","- C28 H44 Li N3 O2 Si2 -","- C28 H44 Li N3 O2 Si2 -","- C112 H176 Li4 N12 O8 Si8 -","4","0.5","EJ2003","Carneiro Neto, José Severiano; Iwaya, Eduardo Mariano; Santana, Francielli Sousa; Soares, Jaísa Fernandes","Crystal structure of a three-coordinate lithium complex with monodentate phenyloxazoline and hexamethyldisilylamide ligands","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024004237","","","0.71073","MoKα","","0.0492","0.0352","","","0.0865","0.0915","","","","","","1.039","","","","has coordinates","291952","2024-05-18","01:52:11",""
"2023133","12.9631","0.0011","11.3802","0.0005","13.1675","0.0011","90","","117.624","0.006","90","","1721.1","0.2","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","4,4'-(Disulfanediyl)dipyridinium chloride triiodide","","- C10 H10 Cl I3 N2 S2 -","- C10 H10 Cl I3 N2 S2 -","- C40 H40 Cl4 I12 N8 S8 -","4","1","EE2006","Podda, Enrico; Aragoni, M. Carla; Caltagirone, Claudia; De Filippo, Greta; Garau, Alessandra; Lippolis, Vito; Mancini, Annalisa; Pintus, Anna; Orton, James B.; Coles, Simon J.; Arca, Massimiliano","Crystal structure of 4,4′-(disulfanediyl)dipyridinium chloride triiodide","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024004213","","","0.71073","MoKα","","0.0259","0.022","","","0.0451","0.0463","","","","","","1.134","","","","has coordinates","291978","2024-05-22","01:52:43",""
"2023134","13.151","0.0004","8.5584","0.0002","18.2071","0.0006","90","","105.714","0.003","90","","1972.65","0.1","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[4-Methoxy-5-(2-methoxy-2-oxoethoxy)-2-(prop-2-en-1-yl)phenyl](quinolin-8-olato)platinum(II)","","- C22 H21 N O5.47 Pt -","- C22 H21 N O5.474 Pt -","- C88 H84 N4 O21.896 Pt4 -","4","1","PK2707","Chi, Nguyen Thi Thanh; Van Thong, Pham; Thang, Nguyen Manh; Thao, Pham Ngoc; Van Meervelt, Luc","Synthesis and crystal structures of three organoplatinum(II) complexes bearing natural arylolefin and quinoline derivatives","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024004572","","x-ray","0.71073","MoKα","","0.0256","0.0212","","","0.0511","0.0543","","","","","","1.102","","","","has coordinates","291979","2024-05-22","01:53:47",""
"2023135","8.2857","0.0004","18.5001","0.0009","14.6282","0.0007","90","","102.014","0.005","90","","2193.19","0.19","100.02","0.1","100.02","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[4-Methoxy-5-(2-oxo-2-propoxyethoxy)-2-(prop-2-en-1-yl)phenyl](quinoline-2-carboxylato)platinum(II)","","- C25 H25 N O6 Pt -","- C25 H25 N O6 Pt -","- C100 H100 N4 O24 Pt4 -","4","1","PK2707","Chi, Nguyen Thi Thanh; Van Thong, Pham; Thang, Nguyen Manh; Thao, Pham Ngoc; Van Meervelt, Luc","Synthesis and crystal structures of three organoplatinum(II) complexes bearing natural arylolefin and quinoline derivatives","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024004572","","x-ray","0.71073","MoKα","","0.0415","0.0334","","","0.0653","0.0701","","","","","","1.051","","","","has coordinates","291979","2024-05-22","01:53:50",""
"2023136","14.576","0.002","11.0945","0.0009","15.7","0.002","90","","117.197","0.018","90","","2258.2","0.6","114","7","114","7","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Chlorido[4-methoxy-5-(2-oxo-2-propoxyethoxy)-2-(prop-2-en-1-yl)phenyl]\ (quinoline)platinum(II)","","- C24 H26 Cl N O4 Pt -","- C24 H26 Cl N O4 Pt -","- C96 H104 Cl4 N4 O16 Pt4 -","4","1","PK2707","Chi, Nguyen Thi Thanh; Van Thong, Pham; Thang, Nguyen Manh; Thao, Pham Ngoc; Van Meervelt, Luc","Synthesis and crystal structures of three organoplatinum(II) complexes bearing natural arylolefin and quinoline derivatives","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024004572","","","0.71073","MoKα","","0.0395","0.0296","","","0.0515","0.0556","","","","","","1.039","","","","has coordinates,has disorder","291979","2024-05-22","01:53:50",""
"2023137","8.8641","0.0003","22.0075","0.0006","6.2771","0.0002","90","","90","","90","","1224.52","0.07","100","","100","","","","","","","","","3","P n a 21","P 2c -2n","33","","2,9-Diamino-5,6,11,12-tetrahydrodibenzo[a,e][8]annulene","","- C16 H18 N2 -","- C16 H18 N2 -","- C64 H72 N8 -","4","1","VM2301","Valdez, Nichole; Nagel, Eric; Redline, Erica; Rodriguez, Mark; Staiger, Chad; Dugger, Jason; Foster, Jeffrey","Synthesis and crystal structure of 2,9-diamino-5,6,11,12-tetrahydrodibenzo[a,e]cyclooctene","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024004468","","","1.54178","CuKα","","0.0593","0.0459","","","0.0982","0.1063","","","","","","1.081","","","","has coordinates","291980","2024-05-22","01:54:23",""
"2023138","6.8597","0.0002","10.8855","0.0004","12.8106","0.0005","107.566","0.001","100.523","0.001","106.799","0.001","834.02","0.05","296","","296","","","","","","","","","5","P -1","-P 1","2","","Poly[di-μ~3~-chlorido-di-μ~2~-chlorido-[4-methyl-<i>N</i>-(pyridin-2-ylmethylidene)aniline]dicadmium(II)]","","- C13 H12 Cd2 Cl4 N2 -","- C13 H12 Cd2 Cl4 N2 -","- C26 H24 Cd4 Cl8 N4 -","2","1","WM5718","Theppitak, Chatphorn; Laksee, Sakchai; Chainok, Kittipong","Synthesis, crystal structure and properties of poly[di-μ3-chlorido-di-μ2-chlorido-bis[4-methyl-N-(pyridin-2-ylmethylidene)aniline]dicadmium(II)]","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024004274","","x-ray","0.71073","MoKα","","0.0546","0.0303","","","0.0588","0.0655","","","","","","1.027","","","","has coordinates","291981","2024-05-22","01:54:41",""
"2023139","10.4506","0.0004","15.6166","0.0006","22.3537","0.0009","90","","90.417","0.002","90","","3648.1","0.2","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","(5,10,15,20-tetrakis(1-benzylpyridin-1-ium-4-yl)-21<i>H</i>,23<i>H</i>-porphyrin)calcium(II) tetrakis(trifluoromethanesulfonate) tetrahydrate","","- C72 H61.81 Ca0.1 F12 N8 O16 S4 -","- C72 H61.808 Ca0.096 F12 N8 O16 S4 -","- C144 H123.616 Ca0.192 F24 N16 O32 S8 -","2","0.5","NY2004","Salomón-Flores, María K.; Valdes-García, Josue; Martínez-Otero, Diego; Dorazco-González, Alejandro","Trifluoromethanesulfonate salt of 5,10,15,20-tetrakis(1-benzylpyridin-1-ium-4-yl)-21H,23H-porphyrin and its CaII complex","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S205698902400447X","","","1.54178","CuKα","","0.0464","0.0425","","","0.1212","0.1258","","","","","","1.035","","","","has coordinates,has disorder","291982","2024-05-22","01:55:03",""
"2023140","5.526","0.0001","8.5012","0.0001","10.1076","0.0002","110.91","0.002","98.128","0.001","96.006","0.001","432.885","0.014","100","2","100","2","","","","","","","","5","P 1","P 1","1","","Dimethyl 2-oxo-4-(pyridin-2-yl)-6-(thiophen-2-yl)cyclohex-3-ene-1,3-dicarboxylate","","- C19 H17 N O5 S -","- C19 H17 N O5 S -","- C19 H17 N O5 S -","1","1","OI2007","Naghiyev, Farid N.; Khrustalev, Victor N.; Akkurt, Mehmet; Huseynov, Elnur Z.; Bhattarai, Ajaya; Khalilov, Ali N.; Mamedov, İbrahim G.","Crystal structure and Hirshfeld surface analysis of dimethyl 2-oxo-4-(pyridin-2-yl)-6-(thiophen-2-yl)cyclohex-3-ene-1,3-dicarboxylate","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024004687","","","1.54184","CuKα","","0.0227","0.0226","","","0.0586","0.0586","","","","","","1.063","","","","has coordinates","292030","2024-05-25","01:50:14",""
"2023141","14.1382","0.0005","15.3202","0.0005","18.3835","0.0007","72.09","0.0018","69.6031","0.0019","74.6737","0.0018","3495.8","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","(6,9-Diacetyl-5,10,15,20-tetraphenylsecochlorinato)nickel(II)","","- C46 H32 N4 Ni O2 -","- C46 H32 N4 Ni O2 -","- C184 H128 N16 Ni4 O8 -","4","2","YY2012","Sharma, Meenakshi; Brückner, Christian; Zeller, Matthias","Crystal structure of (6,9-diacetyl-5,10,15,20-tetraphenylsecochlorinato)nickel(II)","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","","","10.1107/S2056989024004717","","","0.71073","MoKα","","0.061","0.038","","","0.0915","0.103","","","","","","1.014","","","","has coordinates","292031","2024-05-25","01:50:52",""
"2023142","13.5009","0.0005","6.413","0.0002","17.9147","0.0007","90","","103.606","0.004","90","","1507.55","0.1","99.99","0.1","100","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1-(1,3-Benzothiazol-2-yl)-3-(4-bromobenzoyl)thiourea","","- C15 H10 Br N3 O S2 -","- C15 H10 Br N3 O S2 -","- C60 H40 Br4 N12 O4 S8 -","4","1","PK2706","Sow, Salif; Thiam, Mariama; Odame, Felix; Thiam, Elhadj Ibrahima; Diouf, Ousmane; Ellena, Javier; Gaye, Mohamed; Tshentu, Zenixole","Crystal structure of 1-(1,3-benzothiazol-2-yl)-3-(4-bromobenzoyl)thiourea","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","663","666","10.1107/S2056989024004742","","","0.71073","MoKα","","0.0334","0.024","","","0.0541","0.057","","","","","","1.026","","","","has coordinates","292154","2024-06-01","02:13:05",""
"2023143","18.0071","0.0003","18.0071","0.0003","62.9142","0.0009","90","","90","","120","","17667.2","0.5","298","","298","","","","","","","","","5","R -3 :H","-R 3","148","","Pentasodium nonadecacesium tetracosatungstate(VI) heneikosahydrate","","- Cs19 H42 Na5 O105 W24 -","- Cs19 Na4.9999 O105 W24 -","- Cs114 Na29.9994 O630 W144 -","6","0.333333","WM5717","Deblonde, Gauthier; Colliard, Ian","Synthesis and structural characterization of a hydrated sodium–caesium tetracosatungstate(VI), Na5Cs19[W24O84]·21H2O","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","667","670","10.1107/S2056989024004778","","","0.71073","MoKα","","0.0645","0.0617","","","0.1669","0.1704","","","","","","1.079","","","","has coordinates","292155","2024-06-01","02:13:27",""
"2023144","8.2188","0.0004","13.8709","0.0007","20.837","0.0011","90","","96.062","0.002","90","","2362.2","0.2","150","2","150","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Ethyl 2-[(2-oxo-2<i>H</i>-chromen-6-yl)oxy]acetate","","- C13 H12 O5 -","- C13 H12 O5 -","- C104 H96 O40 -","8","1","JY2047","Goyal, Navneet; Donahue, James P.; Thompson, Anthony; Zhang, Xiaodong; Mague, Joel T.; Foroozesh, Maryam","Ethyl 2-[(2-oxo-2H-chromen-6-yl)oxy]acetate","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","659","662","10.1107/S2056989024004729","","","0.71073","MoKα","","0.0467","0.0383","","","0.1066","0.1154","","","","","","1.076","","","","has coordinates","292156","2024-06-01","02:13:43",""
"2023145","19.0089","0.0007","9.7403","0.0003","16.7516","0.0006","90","","113.37","0.003","90","","2847.15","0.18","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diisothiocyanatotetrakis(4-methylpyridine)cobalt(II)","","- C26 H28 Co N6 S2 -","- C26 H28 Co N6 S2 -","- C104 H112 Co4 N24 S8 -","4","1","JP2006","Näther, Christian; Jochim, Aleksej","Synthesis, crystal structure and thermal properties of a new polymorphic modification of diisothiocyanatotetrakis(4-methylpyridine)cobalt(II)","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","677","681","10.1107/S2056989024004997","","","0.71073","MoKα","","0.0661","0.0579","","","0.1592","0.1638","","","","","","1.099","","","","has coordinates","292157","2024-06-01","02:13:59",""
"2023146","7.979","0.006","11.1","0.008","17.54","0.014","90","","99.04","0.03","90","","1534","2","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(Bromomethyl)-3-methyl-1-(phenylsulfonyl)-1<i>H</i>-indole","","- C16 H14 Br N O2 S -","- C16 H14 Br N O2 S -","- C64 H56 Br4 N4 O8 S4 -","4","1","NU2005","Madhan, S.; NizamMohideen, M.; Harikrishnan, K.; MohanaKrishnan, Arasambattu K.","The crystal structures and Hirshfeld surface analysis of three new bromo-substituted 3-methyl-1-(phenylsulfonyl)-1H-indole derivatives","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","682","690","10.1107/S2056989024004985","","","0.71073","MoKα","","0.0771","0.0456","","","0.1018","0.1178","","","","","","1.098","","","","has coordinates","292158","2024-06-01","02:14:27",""
"2023147","8.4252","0.0009","28.669","0.003","8.9462","0.0011","90","","95.445","0.004","90","","2151.1","0.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-[(<i>E</i>)-2-(2-Bromo-5-methoxyphenyl)ethenyl]-3-methyl-1-(phenylsulfonyl)-1<i>H</i>-indole","","- C24 H20 Br N O3 S -","- C24 H20 Br N O3 S -","- C96 H80 Br4 N4 O12 S4 -","4","1","NU2005","Madhan, S.; NizamMohideen, M.; Harikrishnan, K.; MohanaKrishnan, Arasambattu K.","The crystal structures and Hirshfeld surface analysis of three new bromo-substituted 3-methyl-1-(phenylsulfonyl)-1H-indole derivatives","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","682","690","10.1107/S2056989024004985","","","0.71073","MoKα","","0.0622","0.0391","","","0.088","0.0985","","","","","","1.029","","","","has coordinates","292158","2024-06-01","02:14:36",""
"2023148","12.553","0.0008","8.3533","0.0005","19.7698","0.0011","90","","107.078","0.002","90","","1981.6","0.2","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2-[(<i>E</i>)-2-(2-Bromophenyl)ethenyl]-3-methyl-1-(phenylsulfonyl)-1<i>H</i>-indole","","- C23 H18 Br N O2 S -","- C23 H18 Br N O2 S -","- C92 H72 Br4 N4 O8 S4 -","4","1","NU2005","Madhan, S.; NizamMohideen, M.; Harikrishnan, K.; MohanaKrishnan, Arasambattu K.","The crystal structures and Hirshfeld surface analysis of three new bromo-substituted 3-methyl-1-(phenylsulfonyl)-1H-indole derivatives","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","682","690","10.1107/S2056989024004985","","","0.71073","MoKα","","0.0495","0.0362","","","0.0792","0.0865","","","","","","1.099","","","","has coordinates","292158","2024-06-01","02:14:36",""
"2023149","10.689","0.006","11.321","0.006","19.03","0.011","75.306","0.007","84.362","0.007","86.829","0.007","2216","2","296.15","","296.15","","","","","","","","","8","P -1","-P 1","2","","Tetraethylammonium triazidotri-μ~3~-sulfido-[μ~3~-(trimethylsilyl)azanediido][tris(3,5-dimethylpyrazol-1-yl)hydroborato]triiron(+2.33)molybdenum(VI)","","- C26 H51 B Fe3 Mo N17 S3 Si -","- C26 H51 B Fe3 Mo N17 S3 Si -","- C52 H102 B2 Fe6 Mo2 N34 S6 Si2 -","2","1","OI2008","Li, Yue; Wei, Jia; Han, Jie; Chen, Xu-Dong","Synthesis and crystal structure of the cluster (Et4N)[(Tp*)MoFe3S3(μ3-NSiMe3)(N3)3]","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","691","694","10.1107/S2056989024004833","","","0.71073","MoKα","","0.0371","0.0272","","","0.0659","0.0709","","","","","","1.021","","","","has coordinates","292159","2024-06-01","02:14:55",""
"2023150","18.6922","0.0005","18.7278","0.0005","24.4009","0.0006","89.992","0.002","70.083","0.001","85.978","0.002","8008.6","0.4","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","2,8,14,20-Tetrahexyl-6,10:12,16:18,22:24,4-O,O'-tetrakis(quinoxaline-2,3-diyl)calix[4]resorcinarene–benzonitrile (1/2)","","- C98 H90 N10 O8 -","- C98 H90 N10 O8 -","- C392 H360 N40 O32 -","4","2","JW2007","Pinalli, Roberta; Massera, Chiara","Structural characterization of the supramolecular complex between a tetraquinoxaline-based cavitand and benzonitrile","Acta Crystallographica Section E Crystallographic Communications","2024","80","6","671","676","10.1107/S205698902400481X","","","1.54178","CuKα","","0.0887","0.0644","","","0.1697","0.1895","","","","","","1.018","","","","has coordinates,has disorder","292160","2024-06-01","02:15:16",""
"2023187","14.5386","0.0003","9.3464","0.0002","15.4213","0.0004","90","","117.846","0.001","90","","1852.86","0.08","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-[(4-Phenyl-1<i>H</i>-1,2,3-triazol-1-yl)methyl]pyridin-1-ium hexakis(nitrato-κ^2^<i>O</i>,<i>O</i>')thorate(IV)","","- C28 H26 N14 O18 Th -","- C28 H26 N14 O18 Th -","- C56 H52 N28 O36 Th2 -","2","0.5","JW2006","Rangarajan, Shalini; Sheokand, Sonu; Blair, Victoria L.; Deacon, Glen B.; Balakrishna, Maravanji S.","Synthesis, structural studies and Hirshfeld surface analysis of 2-[(4-phenyl-1H-1,2,3-triazol-1-yl)methyl]pyridin-1-ium hexakis(nitrato-κ2 O,O′)thorate(IV)","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024006352","","","0.71073","MoKα","","0.0197","0.0147","","","0.0327","0.0346","","","","","","1.048","","","","has coordinates","293328","2024-07-09","02:06:00",""
"2023188","5.1007","0.0001","6.9544","0.0002","9.047","0.0004","83.198","0.003","79.962","0.003","81.742","0.002","311.289","0.018","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","<i>catena</i>-Poly[[diiodidocadmium(II)]-bis(μ-3-amino-1<i>H</i>-pyrazole)-κ^2^<i>N</i>^2^:<i>N</i>^3^;κ^2^<i>N</i>^3^:<i>N</i>^2^]","","- C6 H10 Cd I2 N6 -","- C6 H10 Cd I2 N6 -","- C6 H10 Cd I2 N6 -","1","0.5","DJ2078","Kuzevanova, Iryna S.; Vynohradov, Oleksandr S.; Pavlenko, Vadim A.; Malinkin, Sergey O.; Shova, Sergiu; Fritsky, Igor O.; Seredyuk, Maksym","Crystal structure of polymeric bis(3-amino-1H-pyrazole)cadmium diiodide","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024006418","","x-ray","0.71073","MoKα","","0.0708","0.0499","","","0.1162","0.1695","","","","","","1.167","","","","has coordinates","293329","2024-07-09","02:06:13",""
"2023189","6.4439","0.0009","6.4439","0.0009","4.226","0.0009","90","","90","","90","","175.48","0.05","100","","100","","","","","","","","","2","I 4/m","-I 4","87","Bismuth pentafluoride","Bismuth pentafluoride","","- Bi F5 -","- Bi F5 -","- Bi2 F10 -","2","0.125","WM5722","Wassermann, Tobias Burghardt; Kraus, Florian","Rerefinement of the crystal structure of BiF5","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024005759","","","0.71073","MoKα","","0.0163","0.0163","","","0.0419","0.0419","","","","","","1.12","","","","has coordinates","293348","2024-07-10","01:50:33",""
"2023190","8.00032","0.0001","15.14469","0.00018","18.9141","0.0002","90","","100.605","0.0012","90","","2252.53","0.05","100","","100","","","","","","","","","5","P 1 c 1","P -2yc","7","","4-(Dimethylamino)pyridin-1-ium 8-hydroxyquinoline-5-sulfonate; <i>N</i>,<i>N</i>-dimethylpyridin-4-amine","","- C23 H27 N5 O4 S -","- C23 H27 N5 O4 S -","- C92 H108 N20 O16 S4 -","4","2","OX2006","Isobe, Mami; Kashiwagi, Yukiyasu; Kubono, Koji","Crystal structure of the 1:1 co-crystal 4-(dimethylamino)pyridin-1-ium 8-hydroxyquinoline-5-sulfonate–N,N-dimethylpyridin-4-amine","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S205698902400642X","","x-ray","1.54184","CuKα","","0.0336","0.0325","","","0.0838","0.0848","","","","","","1.038","","","","has coordinates","293349","2024-07-10","01:50:56",""
"2023191","7.11266","0.00011","13.765","0.00018","24.385","0.0003","90","","90","","90","","2387.43","0.06","100","2","99.9","0.8","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2',3',4',6'-Tetra-<i>O</i>-acetyl-β-<i>D</i>-glucopyranosyl <i>N</i>'-cyano-<i>N</i>-phenylcarbamimidothioate","","- C22 H25 N3 O9 S -","- C22 H25 N3 O9 S -","- C88 H100 N12 O36 S4 -","4","1","YZ2056","Abu-Zaied, Mamdouh A.; Nawwar, Galal A.; Elgemeie, Galal H.; Jones, Peter G.","Crystal structures of four thioglycosides involving carbamimidothioate groups","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024006455","","x-ray","0.71073","MoKα","","0.0329","0.0286","","","0.0763","0.0787","","","","","","1.056","","","","has coordinates,has disorder","293350","2024-07-10","01:52:09",""
"2023192","10.10503","0.00014","14.5978","0.0002","16.4256","0.0002","90","","90","","90","","2422.96","0.06","100","2","99.9","0.8","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2',3',4',6'-Tetra-<i>O</i>-acetyl-β-<i>D</i>-galactopyranosyl <i>N</i>'-cyano-<i>N-</i>phenylcarbamimidothioate","","- C22 H25 N3 O9 S -","- C22 H25 N3 O9 S -","- C88 H100 N12 O36 S4 -","4","1","YZ2056","Abu-Zaied, Mamdouh A.; Nawwar, Galal A.; Elgemeie, Galal H.; Jones, Peter G.","Crystal structures of four thioglycosides involving carbamimidothioate groups","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024006455","","x-ray","0.71073","MoKα","","0.0373","0.031","","","0.0808","0.0843","","","","","","1.056","","","","has coordinates","293350","2024-07-10","01:52:14",""
"2023193","7.34295","0.00007","13.92258","0.00013","21.07464","0.00018","90","","90","","90","","2154.52","0.03","100","2","100","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2',3',4',6'-Tetra-<i>O</i>-acetyl-β-<i>D</i>-galactopyranosyl <i>N</i>'-cyano-<i>N</i>-methylcarbamimidothioate","","- C17 H23 N3 O9 S -","- C17 H23 N3 O9 S -","- C68 H92 N12 O36 S4 -","4","1","YZ2056","Abu-Zaied, Mamdouh A.; Nawwar, Galal A.; Elgemeie, Galal H.; Jones, Peter G.","Crystal structures of four thioglycosides involving carbamimidothioate groups","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024006455","","x-ray","1.54184","CuKα","","0.0245","0.0243","","","0.0653","0.0654","","","","","","1.047","","","","has coordinates","293350","2024-07-10","01:52:16",""
"2023194","7.42044","0.00017","14.9634","0.0004","22.758","0.0005","90","","90","","90","","2526.93","0.1","100","2","99.9","0.9","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2',3',4',6'-Tetra-<i>O</i>-acetyl-β-<i>D</i>-galactopyranosyl <i>N</i>'-cyano-<i>N</i>-<i>p</i>-tolylcarbamimidothioate","","- C23 H27 N3 O9 S -","- C23 H27 N3 O9 S -","- C92 H108 N12 O36 S4 -","4","1","YZ2056","Abu-Zaied, Mamdouh A.; Nawwar, Galal A.; Elgemeie, Galal H.; Jones, Peter G.","Crystal structures of four thioglycosides involving carbamimidothioate groups","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024006455","","x-ray","0.71073","MoKα","","0.0426","0.0359","","","0.0911","0.0944","","","","","","1.041","","","","has coordinates","293350","2024-07-10","01:52:17",""
"2023195","7.41967","0.00005","14.96519","0.00012","22.75622","0.00016","90","","90","","90","","2526.78","0.03","100","2","100.01","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2',3',4',6'-Tetra-<i>O</i>-acetyl-β-<i>D</i>-galactopyranosyl <i>N</i>'-cyano-<i>N</i>-<i>p</i>-tolylcarbamimidothioate","","- C23 H27 N3 O9 S -","- C23 H27 N3 O9 S -","- C92 H108 N12 O36 S4 -","4","1","YZ2056","Abu-Zaied, Mamdouh A.; Nawwar, Galal A.; Elgemeie, Galal H.; Jones, Peter G.","Crystal structures of four thioglycosides involving carbamimidothioate groups","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024006455","","x-ray","1.54184","CuKα","","0.0228","0.0226","","","0.0592","0.0593","","","","","","1.038","","","","has coordinates","293350","2024-07-10","01:52:19",""
"2023196","13.6698","0.0017","19.781","0.002","8.1056","0.001","90","","99.388","0.008","90","","2162.4","0.4","305","2","305","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(3-Methoxyphenyl)-<i>N</i>-{[1-(phenylsulfonyl)-1<i>H</i>-indol-2-yl]methyl}acetamide","","- C24 H22 N2 O4 S -","- C24 H22 N2 O4 S -","- C96 H88 N8 O16 S4 -","4","1","NU2006","Madhan, S.; NizamMohideen, M.; Pavunkumar, Vinayagam; MohanaKrishnan, Arasambattu K.","The crystal structure determination and Hirshfeld surface analysis of N-acetyl-N-3-methoxyphenyl and N-phenylsulfonyl-N-(2,5-dimethoxyphenyl) derivatives of [1-(phenylsulfonyl)-1H-indol-2-yl]methanamine","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024006649","","","1.54178","CuKα","","0.0994","0.0577","","","0.1376","0.1785","","","","","","1.066","","","","has coordinates","293351","2024-07-10","01:52:52",""
"2023197","13.463","0.009","17.193","0.012","11.532","0.007","90","","94.844","0.019","90","","2660","3","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","<i>N</i>-(2,5-Dimethoxyphenyl)-<i>N</i>-{[1-(phenylsulfonyl)-1<i>H</i>-indol-2-yl]methyl}benzenesulfonamide","","- C29 H26 N2 O6 S2 -","- C29 H26 N2 O6 S2 -","- C116 H104 N8 O24 S8 -","4","1","NU2006","Madhan, S.; NizamMohideen, M.; Pavunkumar, Vinayagam; MohanaKrishnan, Arasambattu K.","The crystal structure determination and Hirshfeld surface analysis of N-acetyl-N-3-methoxyphenyl and N-phenylsulfonyl-N-(2,5-dimethoxyphenyl) derivatives of [1-(phenylsulfonyl)-1H-indol-2-yl]methanamine","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024006649","","","0.71073","MoKα","","0.0676","0.0569","","","0.1454","0.1544","","","","","","1.116","","","","has coordinates","293351","2024-07-10","01:52:53",""
"2023198","10.9966","0.0006","13.7147","0.001","17.9345","0.0009","90","","90","","90","","2704.8","0.3","200","0.1","200","0.1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","<i>catena</i>-Poly[[methanoldioxidouranium(VI)]-μ-2-[5-(2-oxidophenyl)-1<i>H</i>-1,2,4-triazol-3-yl]acetato-κ^2^<i>O</i>:<i>O</i>']","","- C11 H11 N3 O6 U -","- C11 H11 N3 O6 U -","- C88 H88 N24 O48 U8 -","8","1","EJ2005","Vashchenko, Oleksandr V.; Khomenko, Dmytro M.; Doroshchuk, Roman O.; Stoica, Alexandru-Constantin; Vassilyeva, Olga Yu.; Lampeka, Rostyslav D.","Crystal structure of catena-poly[[methanoldioxidouranium(VI)]-μ-2-[5-(2-oxidophenyl)-1H-1,2,4-triazol-3-yl]acetato-κ2 O:O′]","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024006637","","x-ray","0.71073","MoKα","","0.0481","0.0331","","","0.0522","0.0561","","","","","","1.047","","","","has coordinates","293407","2024-07-13","02:00:11",""
"2023199","3.8875","0.0001","9.3118","0.0002","14.7772","0.0003","104.228","0.002","93.211","0.002","98.219","0.002","510.87","0.02","100","0.3","100","0.3","","","","","","","","4","P -1","-P 1","2","","2-Methyl-1,4-phenylene bis(3,5-dibromobenzoate)","","- C21 H12 Br4 O4 -","- C21 H12 Br4 O4 -","- C21 H12 Br4 O4 -","1","0.5","WM5727","Weeks, Nathan J.; Lauer, Moira K.; Balaich, Gary J.; Iacono, Scott T.","Crystal and molecular structure of 2-methyl-1,4-phenylene bis(3,5-dibromobenzoate)","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024006820","","x-ray","1.54184","CuKα","","0.0194","0.0189","","","0.0479","0.0482","","","","","","1.111","","","","has coordinates,has disorder","293433","2024-07-17","01:50:23",""
"2023200","12.4983","0.0002","7.17223","0.00012","60.3774","0.0012","90","","94.1762","0.0017","90","","5397.9","0.17","100","0.1","100","0.1","","","","","","","","4","P 1 21 1","P 2yb","4","","12-α-Fluoro-3β-hydroxyolean-28,13β-olide methanol hemisolvate","","- C61 H98 F2 O7 -","- C61 H98 F2 O7 -","- C244 H392 F8 O28 -","4","2","YY2009","Eadsforth, Megan A.; Kong, Linghan; Whitehead, George; Vitórica-Yrezábal, Iñigo J.; O'Keefe, Raymond T.; Bryce, Richard A.; Whitehead, Roger C.","Structural determination of oleanane-28,13β-olide and taraxerane-28,14β-olide fluorolactonization products from the reaction of oleanolic acid with SelectfluorTM","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024006480","","","1.54184","CuKα","","0.1039","0.0975","","","0.2713","0.2766","","","","","","1.045","","","","has coordinates","293435","2024-07-17","01:51:07",""
"2023201","6.6077","0.0002","13.873","0.0004","59.326","0.002","90","","90","","90","","5438.3","0.3","239.99","0.1","239.99","0.1","","","","","","","","4","C 2 2 21","C 2c 2","20","","12-α-Fluoro-3β-hydroxytaraxer-28,14β-olide methanol hemisolvate","","- C61 H98 F2 O7 -","- C61 H98 F2 O7 -","- C244 H392 F8 O28 -","4","0.5","YY2009","Eadsforth, Megan A.; Kong, Linghan; Whitehead, George; Vitórica-Yrezábal, Iñigo J.; O'Keefe, Raymond T.; Bryce, Richard A.; Whitehead, Roger C.","Structural determination of oleanane-28,13β-olide and taraxerane-28,14β-olide fluorolactonization products from the reaction of oleanolic acid with SelectfluorTM","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024006480","","x-ray","1.54184","CuKα","","0.0746","0.0726","","","0.2015","0.2034","","","","","","1.094","","","","has coordinates,has disorder","293435","2024-07-17","01:51:08",""
"2023202","18.396","0.003","20.248","0.004","8.9338","0.0016","90","","90","","90","","3327.7","1","99.98","","99.98","","","","","","","","","3","P 21 21 2","P 2 2ab","18","Staudtienic acid","(1<i>S</i>,4a<i>S</i>,10a<i>R</i>)-1,4a-Dimethyl-7-(prop-2-en-1-yl)-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-1-carboxylic acid","","- C20 H26 O2 -","- C20 H26 O2 -","- C160 H208 O16 -","8","2","DJ2072","Tonga Lembe, Jordan; Mphahlele, Precious Mokgadi; Kamdem Kengne, Michael Hermann; Jiyane, Pangaman; Djuidje Fotsing, Marthe Carine; Ardene, Charmaine; Mmutlane, Edwin Mpho; Ndinteh, Derek Tantoh","Crystal structure of Staudtienic acid, a diterpenoid from Staudtia kamerunensis Warb. (Myristicaceae)","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024005000","","","0.71073","MoKα","","0.1048","0.0552","","","0.1137","0.1338","","","","","","1.017","","","","has coordinates,has disorder","293487","2024-07-20","01:58:14",""
"2023203","3.7283","0.0004","10.5275","0.0012","16.9073","0.0019","90","","94.604","0.002","90","","661.46","0.13","100.15","","100.15","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-Amino-3,5-difluorobenzonitrile","","- C7 H4 F2 N2 -","- C7 H4 F2 N2 -","- C28 H16 F8 N8 -","4","1","JQ2034","Novikov, Egor M.; Guillen Campos, Jesus; Read de Alaniz, Javier; Fonari, Marina S.; Timofeeva, Tatiana V.","Synthesis, molecular and crystal structures of 4-amino-3,5-difluorobenzonitrile, ethyl 4-amino-3,5-difluorobenzoate, and diethyl 4,4′-(diazene-1,2-diyl)bis(3,5-difluorobenzoate)","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024006819","","x-ray","0.71073","MoKα","","0.0578","0.0467","","","0.1233","0.1303","","","","","","1.086","","","","has coordinates","293488","2024-07-20","01:58:37",""
"2023204","14.877","0.003","8.9995","0.0018","13.635","0.003","90","","90","","90","","1825.5","0.7","100.15","","100.15","","","","","","","","","5","P b c n","-P 2n 2ab","60","","Ethyl 4-amino-3,5-difluorobenzoate","","- C9 H9 F2 N O2 -","- C9 H9 F2 N O2 -","- C72 H72 F16 N8 O16 -","8","1","JQ2034","Novikov, Egor M.; Guillen Campos, Jesus; Read de Alaniz, Javier; Fonari, Marina S.; Timofeeva, Tatiana V.","Synthesis, molecular and crystal structures of 4-amino-3,5-difluorobenzonitrile, ethyl 4-amino-3,5-difluorobenzoate, and diethyl 4,4′-(diazene-1,2-diyl)bis(3,5-difluorobenzoate)","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024006819","","x-ray","0.71073","MoKα","","0.0868","0.0599","","","0.1176","0.1307","","","","","","1.209","","","","has coordinates","293488","2024-07-20","01:58:38",""
"2023205","4.6106","0.0017","8.839","0.003","10.969","0.004","99.33","0.008","99.431","0.008","96.442","0.007","430.7","0.3","100.15","","100.15","","","","","","","","","5","P -1","-P 1","2","","Diethyl 4,4'-(diazene-1,2-diyl)bis(3,5-difluorobenzoate)","","- C18 H14 F4 N2 O4 -","- C18 H14 F4 N2 O4 -","- C18 H14 F4 N2 O4 -","1","0.5","JQ2034","Novikov, Egor M.; Guillen Campos, Jesus; Read de Alaniz, Javier; Fonari, Marina S.; Timofeeva, Tatiana V.","Synthesis, molecular and crystal structures of 4-amino-3,5-difluorobenzonitrile, ethyl 4-amino-3,5-difluorobenzoate, and diethyl 4,4′-(diazene-1,2-diyl)bis(3,5-difluorobenzoate)","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024006819","","x-ray","0.71073","MoKα","","0.064","0.0466","","","0.1381","0.1499","","","","","","1.009","","","","has coordinates","293488","2024-07-20","01:58:38",""
"2023206","7.0928","0.0005","14.3933","0.001","10.0419","0.0007","90","","90","","90","","1025.17","0.12","150","2","150","2","","","","","","","","4","P n a 21","P 2c -2n","33","","4-Bromo-5,7-dimethoxy-2,3-dihydro-1<i>H</i>-inden-1-one","","- C11 H11 Br O3 -","- C11 H11 Br O3 -","- C44 H44 Br4 O12 -","4","1","JY2050","Galla, Sri Hari; Sridhar, Jayalakshmi; Mague, Joel T.; Zhang, Xiaodong; White, Kira D.; Zhang, Qiang; Donahue, James P.","Crystal structure of 4-bromo-5,7-dimethoxy-2,3-dihydro-1H-inden-1-one","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024006522","","","0.71073","MoKα","","0.0282","0.0252","","","0.0551","0.0562","","","","","","1.08","","","","has coordinates","293489","2024-07-20","01:58:54",""
"2023207","11.6462","0.0003","13.9943","0.0004","16.9225","0.0005","90","","90","","90","","2758.04","0.13","150","2","150","2","","","","","","","","7","C m c m","-C 2c 2","63","","Bis[dithiobis(formamidinium)] hexabromidoruthenium dibromide trihydrate","","- C4 H22 Br8 N8 O3 Ru S4 -","- C4 H22 Br8 N8 O3 Ru S4 -","- C16 H88 Br32 N32 O12 Ru4 S16 -","4","0.25","NY2005","Rudnitskaya, Olga V.; Komarovskikh, Milena R.; Pekarskaya, Maria G.; Pshenichnyy, Daniil S.; Akkurt, Mehmet; Khalilov, Ali N.; Bhattarai, Ajaya; Mamedov, Ibrahim G.","Synthesis, molecular and crystal structure of [(NH2)2CSSC(NH2)2]2[RuBr6]Br2·3H2O","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024006832","","","0.71073","MoKα","","0.0266","0.0227","","","0.0552","0.0567","","","","","","1.069","","","","has coordinates","293522","2024-07-24","01:57:00",""
"2023208","12.1857","0.0007","8.0515","0.0005","12.6153","0.0008","90","","105.49","0.002","90","","1192.77","0.13","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis[(η^5^-<i>tert</i>-butylcyclopentadienyl)tricarbonylmolybdenum(I)](<i>Mo</i>—<i>Mo</i>)","","- C24 H26 Mo2 O6 -","- C24 H26 Mo2 O6 -","- C48 H52 Mo4 O12 -","2","0.5","WM5725","Ibrahimova, Nigar Z.; Tagiyev, Dilgam B.; Lyatifov, Iltifat U.; Akkurt, Mehmet; Hasanov, Khudayar I.; Bhattarai, Ajaya","Crystal structure of bis[(η5-tert-butylcyclopentadienyl)tricarbonylmolybdenum(I)](Mo—Mo)","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024006959","","","0.71073","MoKα","","0.0362","0.0252","","","0.0495","0.0536","","","","","","1.027","","","","has coordinates","293523","2024-07-24","01:57:16",""
"2023212","12.5708","0.0003","14.8757","0.0005","23.1383","0.0007","84.392","0.003","82.291","0.002","85.686","0.002","4258.7","0.2","110.5","0.8","110.5","0.8","","","","","","","","7","P -1","-P 1","2","","Ben Tickner BJT004","","- C141.78 H168.72 Cl8 Cu20 Ir6 N18 O3.18 -","- C141.18 H168.72 Cl8 Cu20 Ir6 N18 O3.18 -","- C141.18 H168.72 Cl8 Cu20 Ir6 N18 O3.18 -","1","0.5","WM5728","Tickner, Ben. J.; Gammons, Richard; Whitwood, Adrian C.; Duckett, Simon B.","Pyrazine-bridged polymetallic copper–iridium clusters","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","","","10.1107/S2056989024007151","","x-ray","1.54184","CuKα","","0.0599","0.0537","","","0.1306","0.1336","","","","","","1.084","","","","has coordinates,has disorder","293562","2024-07-27","01:52:38",""
"2023213","17.3468","0.0003","10.40583","0.00019","9.87841","0.00016","90","","99.4243","0.0016","90","","1759.06","0.05","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[1-(4-Bromophenyl)-1<i>H</i>-1,2,3-triazol-4-yl]methyl 2-(4-nitrophenoxy)acetate","","- C17 H13 Br N4 O5 -","- C17 H13 Br N4 O5 -","- C68 H52 Br4 N16 O20 -","4","1","ZV2035","Hakimov, Muminjon; Khozhimatova, Shakhnoza; Ortikov, Ilkhomjon; Abdugafurov, Ibragimdjan; Tojiboev, Akmaljon","Synthesis, crystal structure and Hirshfeld surface analysis of [1-(4-bromophenyl)-1H-1,2,3-triazol-4-yl]methyl 2-(4-nitrophenoxy)acetate","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","910","912","10.1107/S2056989024007436","","","1.54184","CuKα","","0.0439","0.0352","","","0.0878","0.0939","","","","","","1.061","","","","has coordinates","293618","2024-08-01","02:14:57",""
"2023214","7.6852","0.0007","14.3992","0.0012","8.7963","0.0007","90","","95.86","0.008","90","","968.32","0.14","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Trichlorido(2-methylpyridine-κ<i>N</i>)gold(III)","","- C6 H7 Au Cl3 N -","- C6 H7 Au Cl3 N -","- C24 H28 Au4 Cl12 N4 -","4","1","WM5729","Döring, Cindy; Jones, Peter G.","Crystal structures of seven gold(III) complexes of the form LAuX 3 (L = substituted pyridine, X = Cl or Br)","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","894","909","10.1107/S2056989024007266","","","0.71073","MoKα","","0.0314","0.0238","","","0.0482","0.0491","","","","","","0.927","","","","has coordinates","293619","2024-08-01","02:19:31",""
"2023215","7.8077","0.0008","16.4881","0.0015","7.6929","0.0009","90","","103.92","0.012","90","","961.26","0.18","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Trichlorido(2-methylpyridine-κ<i>N</i>)gold(III)","","- C6 H7 Au Cl3 N -","- C6 H7 Au Cl3 N -","- C24 H28 Au4 Cl12 N4 -","4","1","WM5729","Döring, Cindy; Jones, Peter G.","Crystal structures of seven gold(III) complexes of the form LAuX 3 (L = substituted pyridine, X = Cl or Br)","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","894","909","10.1107/S2056989024007266","","","0.71073","MoKα","","0.0349","0.0251","","","0.0485","0.0498","","","","","","0.999","","","","has coordinates","293619","2024-08-01","02:19:32",""
"2023216","8.0776","0.0004","14.723","0.0007","8.9682","0.0004","90","","96.617","0.005","90","","1059.45","0.09","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tribromido(2-methylpyridine-κ<i>N</i>)gold(III)","","- C6 H7 Au Br3 N -","- C6 H7 Au Br3 N -","- C24 H28 Au4 Br12 N4 -","4","1","WM5729","Döring, Cindy; Jones, Peter G.","Crystal structures of seven gold(III) complexes of the form LAuX 3 (L = substituted pyridine, X = Cl or Br)","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","894","909","10.1107/S2056989024007266","","","0.71073","MoKα","","0.0447","0.0277","","","0.0379","0.0401","","","","","","0.797","","","","has coordinates","293619","2024-08-01","02:19:32",""
"2023217","18.6763","0.0006","6.78409","0.00014","18.4807","0.0005","90","","118.887","0.004","90","","2050.19","0.12","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tribromido(3-methylpyridine-κ<i>N</i>)gold(III)","","- C6 H7 Au Br3 N -","- C6 H7 Au Br3 N -","- C48 H56 Au8 Br24 N8 -","8","1","WM5729","Döring, Cindy; Jones, Peter G.","Crystal structures of seven gold(III) complexes of the form LAuX 3 (L = substituted pyridine, X = Cl or Br)","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","894","909","10.1107/S2056989024007266","","","0.71073","MoKα","","0.0386","0.0263","","","0.0498","0.0535","","","","","","1.044","","","","has coordinates","293619","2024-08-01","02:19:33",""
"2023218","8.07477","0.00017","17.2853","0.0004","16.3527","0.0004","90","","90.818","0.002","90","","2282.19","0.09","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tribromido(2,4-dimethylpyridine-κ<i>N</i>)gold(III)","","- C7 H9 Au Br3 N -","- C7 H9 Au Br3 N -","- C56 H72 Au8 Br24 N8 -","8","2","WM5729","Döring, Cindy; Jones, Peter G.","Crystal structures of seven gold(III) complexes of the form LAuX 3 (L = substituted pyridine, X = Cl or Br)","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","894","909","10.1107/S2056989024007266","","","0.71073","MoKα","","0.0385","0.0262","","","0.0451","0.0482","","","","","","1.046","","","","has coordinates","293619","2024-08-01","02:19:33",""
"2023219","7.624","0.0003","15.936","0.0006","9.2538","0.0004","90","","112.333","0.005","90","","1039.97","0.08","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Trichlorido(3,5-dimethylpyridine-κ<i>N</i>)gold(III)","","- C7 H9 Au Cl3 N -","- C7 H9 Au Cl3 N -","- C28 H36 Au4 Cl12 N4 -","4","0.5","WM5729","Döring, Cindy; Jones, Peter G.","Crystal structures of seven gold(III) complexes of the form LAuX 3 (L = substituted pyridine, X = Cl or Br)","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","894","909","10.1107/S2056989024007266","","","0.71073","MoKα","","0.0161","0.0144","","","0.0317","0.0322","","","","","","1.065","","","","has coordinates","293619","2024-08-01","02:19:33",""
"2023220","8.2506","0.0003","8.4726","0.0004","9.421","0.0004","113.828","0.004","103.543","0.004","98.368","0.004","563.93","0.05","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Tribromido(3,5-dimethylpyridine-κ<i>N</i>)gold(III)","","- C7 H9 Au Br3 N -","- C7 H9 Au Br3 N -","- C14 H18 Au2 Br6 N2 -","2","1","WM5729","Döring, Cindy; Jones, Peter G.","Crystal structures of seven gold(III) complexes of the form LAuX 3 (L = substituted pyridine, X = Cl or Br)","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","894","909","10.1107/S2056989024007266","","","0.71073","MoKα","","0.0336","0.0271","","","0.0563","0.0594","","","","","","1.063","","","","has coordinates","293619","2024-08-01","02:19:33",""
"2023221","11.0184","0.0003","10.66","0.0002","9.776","0.0003","90","","113.053","0.003","90","","1056.56","0.05","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Trichlorido(2,6-dimethylpyridine-κ<i>N</i>)gold(III)","","- C7 H9 Au Cl3 N -","- C7 H9 Au Cl3 N -","- C28 H36 Au4 Cl12 N4 -","4","0.5","WM5729","Döring, Cindy; Jones, Peter G.","Crystal structures of seven gold(III) complexes of the form LAuX 3 (L = substituted pyridine, X = Cl or Br)","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","894","909","10.1107/S2056989024007266","","","0.71073","MoKα","","0.0132","0.0125","","","0.0258","0.026","","","","","","1.119","","","","has coordinates","293619","2024-08-01","02:19:34",""
"2023222","9.1741","0.0009","11.1922","0.0009","11.4596","0.0007","83.99","0.006","80.777","0.006","69.147","0.008","1083.91","0.16","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Tribromido(2-methylpyridine-κ<i>N</i>)gold(III)–tribromido(3,5-dimethylpyridine-κ<i>N</i>)gold(III)","","- C13 H16 Au2 Br6 N2 -","- C13 H16 Au2 Br6 N2 -","- C26 H32 Au4 Br12 N4 -","2","1","WM5729","Döring, Cindy; Jones, Peter G.","Crystal structures of seven gold(III) complexes of the form LAuX 3 (L = substituted pyridine, X = Cl or Br)","Acta Crystallographica Section E Crystallographic Communications","2024","80","8","894","909","10.1107/S2056989024007266","","","0.71073","MoKα","","0.064","0.0354","","","0.0524","0.0552","","","","","","0.82","","","","has coordinates","293619","2024-08-01","02:19:34",""
"2023234","8.5437","0.0005","11.2672","0.0007","14.8534","0.0009","105.9","0.002","92.647","0.002","111.477","0.002","1262.4","0.13","200","2","200","2","","","","","","","","6","P -1","-P 1","2","hexaglycinium dodecaiodo-triplumbate","Hexaglycinium tetra-μ-iodido-octaiodidotriplumbate","","- C12 H36 I12 N6 O12 Pb3 -","- C12 H36 I12 N6 O12 Pb3 -","- C12 H36 I12 N6 O12 Pb3 -","1","0.5","JY2048","Tonoyan, Gayane S.; Giester, Gerald; Ghazaryan, Vahram V.; Chilingaryan, Ruben Yu.; Margaryan, Arthur A.; Mkrtchyan, Artak H.; Petrosyan, Aram M.","Crystal structure of hexaglycinium dodecaiodotriplumbate","Acta Crystallographica Section E Crystallographic Communications","2024","80","9","","","10.1107/S2056989024007606","","","0.71073","MoKα","","0.0289","0.0216","","","0.037","0.0385","","","","","","1.028","","","","has coordinates","294019","2024-08-07","01:58:55",""
"2023235","7.4579","0.0004","8.4601","0.0005","9.8864","0.0006","97.073","0.002","98.474","0.002","100.644","0.002","599.06","0.06","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Bis[aqua(2,2'-bipyridine)fluoridotin(II)] hexafluoridotin(IV)","","- C20 H20 F8 N4 O2 Sn3 -","- C20 H20 F8 N4 O2 Sn3 -","- C20 H20 F8 N4 O2 Sn3 -","1","0.5","OI2009","Röwekamp-Krugley, Natalia; Reuter, Hans","[SnF(bipy)(H2O)]2[SnF6], a mixed-valent inorganic tin(II)–tin(IV) compound","Acta Crystallographica Section E Crystallographic Communications","2024","80","9","","","10.1107/S2056989024007400","","","0.71073","MoKα","","0.0262","0.0223","","","0.0517","0.0533","","","","","","1.051","","","","has coordinates","294020","2024-08-07","01:59:09",""
"2023236","9.0494","0.0009","10.0326","0.0011","14.6932","0.0015","100.153","0.003","107.292","0.003","90.789","0.004","1250.6","0.2","298","2","298","2","","","","","","","","3","P -1","-P 1","2","Organic","(2<i>E</i>)-1-[3,5-Bis(benzyloxy)phenyl]-3-(4-ethoxyphenyl)prop-2-en-1-one","","- C31 H28 O4 -","- C31 H28 O4 -","- C62 H56 O8 -","2","1","HB8103","Jeyashri, K. R.; Logeshwari, G.; Rajapandiyan, U.; Sivakumar, K.; Selvanayagam, S.; Manikandan, H.; Kaviyarasu, K.","Synthesis and crystal structure of (2E)-1-[3,5-bis(benzyloxy)phenyl]-3-(4-ethoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E Crystallographic Communications","2024","80","9","","","10.1107/S2056989024007552","","","0.71073","MoKα","","0.0881","0.0565","","","0.1501","0.1779","","","","","","1.048","","","","has coordinates","294021","2024-08-07","01:59:32",""
"2023237","9.3964","0.0008","20.2572","0.0016","9.9822","0.0007","90","","96.358","0.002","90","","1888.4","0.3","296.15","","296.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dichlorido[2-(3-cyclopentyl-1,2,4-triazol-5-yl-κ<i>N</i>^4^)pyridine-κ<i>N</i>]palladium(II) dimethylformamide monosolvate","","- C15 H21 Cl2 N5 O Pd -","- C15 H21 Cl2 N5 O Pd -","- C60 H84 Cl8 N20 O4 Pd4 -","4","1","EX2086","Dyakonenko, Viktoriya V.; Khomenko, Dmytro M.; Doroshchuk, Roman O.; Ivanova, Ganna V.; Lampeka, Rostyslav D.","Crystal structure and Hirshfeld surface analysis of dichlorido[2-(3-cyclopentyl-1,2,4-triazol-5-yl-κN 4)pyridine-κN]palladium(II) dimethylformamide monosolvate","Acta Crystallographica Section E Crystallographic Communications","2024","80","9","","","10.1107/S2056989024007801","","","0.71073","MoKα","","0.0724","0.0511","","","0.0874","0.0925","","","","","","1.124","","","","has coordinates","294161","2024-08-17","01:49:47",""
"2023238","9.406","0.0003","19.3779","0.0004","9.4225","0.0003","90","","97.925","0.002","90","","1701.02","0.08","100","0.1","100.15","","","","","","","","","5","P 1 21 1","P 2yb","4","","(1,4,7,10,13,16-Hexaoxacyclooctadecane-1κ^6^<i>O</i>)(μ-oxalato-1κ^2^<i>O</i>^1^,<i>O</i>^2^:2κ^2^<i>O</i>^1'^,<i>O</i>^2'^)triphenyl-2κ^3^<i>C</i>-potassium(I)tin(IV)","","- C32 H39 K O10 Sn -","- C32 H39 K O10 Sn -","- C64 H78 K2 O20 Sn2 -","2","1","NY2007","Song, Xueqing; Li, William; Torres, Yolanda; Greaves, Tazena","Crystal structure of (1,4,7,10,13,16-hexaoxacyclooctadecane-κ6 O)potassium-μ-oxalato-triphenylstannate(IV), the first reported 18-crown-6-stabilized potassium salt of triphenyloxalatostannate","Acta Crystallographica Section E Crystallographic Communications","2024","80","9","","","10.1107/S2056989024007758","","x-ray","0.71073","MoKα","","0.0368","0.0327","","","0.0848","0.1049","","","","","","1.077","","","","has coordinates","294162","2024-08-17","01:50:05",""
"2023239","12.5184","0.0004","9.1855","0.0002","22.1339","0.0006","90","","105.133","0.0015","90","","2456.87","0.12","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1,3-Bis(acetoxymethyl)-5-{[(4,6-dimethylpyridin-2-yl)amino]methyl}-2,4,6-triethylbenzene","{3-[(Acetyloxy)methyl]-5-{[(4,6-dimethylpyridin-2-yl)amino]methyl}-2,4,6-triethylphenyl}methyl acetate","","- C26 H36 N2 O4 -","- C26 H36 N2 O4 -","- C104 H144 N8 O16 -","4","1","EX2085","Stapf, Manuel; Miyyapuram, Venugopal Rao; Seichter, Wilhelm; Mazik, Monika","Synthesis and crystal structure of 1,3-bis(acetoxymethyl)-5-{[(4,6-dimethylpyridin-2-yl)amino]methyl}-2,4,6-triethylbenzene","Acta Crystallographica Section E Crystallographic Communications","2024","80","9","","","10.1107/S2056989024007515","","","0.71073","MoKα","","0.0601","0.0422","","","0.1087","0.12","","","","","","1.025","","","","has coordinates","294163","2024-08-17","01:50:27",""
"2023240","9.229","0.003","19.235","0.006","30.058","0.01","90","","90","","90","","5336","3","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","3-(2-Chloroacetyl)-2,4,6,8-tetraphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one","","- C33 H29 Cl N2 O2 -","- C33 H29 Cl N2 O2 -","- C264 H232 Cl8 N16 O16 -","8","1","WM5730","Divyabharathi, Sivagnanam; Karthiga, Anjalai Ramachandran; Shalo, Rajans Reshwen; Rajeswari, Krishnan; Vidhyasagar, Thankakan; Selvanayagam, Sivashanmugam","Crystal structure, Hirshfeld surface analysis, DFT and the molecular docking studies of 3-(2-chloroacetyl)-2,4,6,8-tetraphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one","Acta Crystallographica Section E Crystallographic Communications","2024","80","9","981","985","10.1107/S2056989024008302","","","0.71073","MoKα","","0.155","0.07","","","0.1196","0.1509","","","","","","1.067","","","","has coordinates","294309","2024-08-31","02:04:12",""
"2023241","10.02487","0.00011","11.92992","0.00015","16.6237","0.0002","100.479","0.0011","100.124","0.001","111.131","0.0011","1759.25","0.04","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","","Diethyl {[(5-[2-(diethoxyphosphoryl)acetamido]-3-{2-[2-(diethoxyphosphoryl)acetamido]ethyl}pentyl)carbamoyl]methyl}phosphonate","","- C25 H52 N3 O12 P3 -","- C25 H52 N3 O12 P3 -","- C50 H104 N6 O24 P6 -","2","1","VU2007","Wackerle, Brandon G.; Werner, Eric J.; Staples, Richard J.; Biros, Shannon M.","Crystal structure of a tris(2-aminoethyl)methane capped carbamoylmethylphosphine oxide compound","Acta Crystallographica Section E Crystallographic Communications","2024","80","9","993","996","10.1107/S2056989024008478","","","1.54184","CuKα","","0.0435","0.0371","","","0.0952","0.0993","","","","","","1.072","","","","has coordinates,has disorder","294310","2024-08-31","02:04:31",""
"2023242","13.6667","0.0017","4.4102","0.0007","11.2816","0.0014","90","","90","","90","","679.97","0.16","173","2","173","2","","","","","","","","5","P m n 21","P 2ac -2","31","","Poly[[μ-aqua-aquabis(μ~3~-carbamoylcyanonitrosomethanido)barium] monohydrate]","","- C6 H10 Ba N6 O7 -","- C6 H10 Ba N6 O7 -","- C12 H20 Ba2 N12 O14 -","2","0.5","YZ2057","Domasevitch, Kostiantyn V.; Senchyk, Ganna A.; Ponomarova, Vira V.; Lysenko, Andrey B.; Krautscheid, Harald","Three-dimensional alkaline earth metal–organic framework poly[[μ-aqua-aquabis(μ3-carbamoylcyanonitrosomethanido)barium] monohydrate] and its thermal decomposition","Acta Crystallographica Section E Crystallographic Communications","2024","80","9","986","992","10.1107/S2056989024008375","","","0.71073","MoKα","","0.0171","0.0169","","","0.0428","0.0429","","","","","","1.154","","","","has coordinates","294311","2024-08-31","02:04:51",""
"2023243","10.8691","0.0008","9.4578","0.0007","17.7217","0.0014","90","","104.364","0.003","90","","1764.8","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-[6-Bromo-2-(3-bromophenyl)-1,2,3,4-tetrahydroquinolin-4-yl]pyrrolidin-2-one","","- C19 H18 Br2 N2 O -","- C19 H18 Br2 N2 O -","- C76 H72 Br8 N8 O4 -","4","1","NX2012","Pronina, Anastasia A.; Kutasevich, Alexandra G.; Grigoriev, Mikhail S.; Hasanov, Khudayar I.; Sadikhova, Nurlana D.; Javadzade, Tahir A.; Akkurt, Mehmet; Bhattarai, Ajaya","Crystal structure and Hirshfeld surface analysis of 1-[6-bromo-2-(3-bromophenyl)-1,2,3,4-tetrahydroquinolin-4-yl]pyrrolidin-2-one","Acta Crystallographica Section E Crystallographic Communications","2024","80","9","967","972","10.1107/S2056989024008144","","","0.71073","MoKα","","0.0468","0.029","","","0.0528","0.0574","","","","","","1.015","","","","has coordinates","294312","2024-08-31","02:05:06",""
"2023244","11.2716","0.0002","11.2716","0.0002","4.331","0.0001","90","","90","","90","","550.249","0.019","105","2","105","2","","","","","","","","4","P 4 b m","P 4 -2ab","100","Propane-1,3-diaminium squarate dihydrate","Propane-1,3-diaminium 3,4-dioxocyclobutene-1,2-diolate dihydrate","","- C7 H16 N2 O6 -","- C7 H16 N2 O6 -","- C14 H32 N4 O12 -","2","0.25","PK2708","Seidel, Rüdiger W.; Kolev, Tsonko M.","Crystal structure of propane-1,3-diaminium squarate dihydrate","Acta Crystallographica Section E Crystallographic Communications","2024","80","9","973","975","10.1107/S2056989024008235","","","0.71073","MoKα","","0.0282","0.0268","","","0.069","0.0702","","","","","","1.093","","","","has coordinates","294313","2024-08-31","02:05:19",""
"2023245","6.5176","0.0013","9.4854","0.0019","15.967","0.002","90","","93.035","0.015","90","","985.7","0.3","200","0.1","200.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis[μ-2,2'-(4<i>H</i>-1,2,4-triazole-3,5-diyl)diacetato]bis[diaquacopper(II)] dihydrate","","- C12 H22 Cu2 N6 O14 -","- C12 H22 Cu2 N6 O14 -","- C24 H44 Cu4 N12 O28 -","2","0.5","OI2010","Vynohradov, Oleksandr S.; Vashchenko, Oleksandr V.; Khomenko, Dmytro M.; Doroshchuk, Roman O.; Raspertova, Ilona V.; Lampeka, Rostyslav D.; Stoica, Alexandru-Constantin","Synthesis, crystal structure and Hirshfeld surface analysis of a new copper(II) complex based on diethyl 2,2′-(4H-1,2,4-triazole-3,5-diyl)diacetate","Acta Crystallographica Section E Crystallographic Communications","2024","80","9","976","980","10.1107/S2056989024008259","","","0.71073","MoKα","","0.0572","0.041","","","0.0912","0.0957","","","","","","1.004","","","","has coordinates","294314","2024-08-31","02:05:32",""
"2023246","21.03214","0.00018","8.61349","0.00006","16.69445","0.00013","90","","102.555","0.0008","90","","2952.05","0.04","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,3-Dihydro-2<i>H</i>-benzimidazol-2-iminium 3-carboxy-4-hydroxybenzenesulfonate","","- C14 H13 N3 O6 S -","- C14 H13 N3 O6 S -","- C112 H104 N24 O48 S8 -","8","2","WM5724","Mukhammadiev, Salmon; Rajabov, Sarvar; Tojiboev, Akmaljon; Ashurov, Jamshid; Murodov, Sardor; Daminova, Shahlo","Synthesis, crystal structure, and Hirshfeld surface analysis of 1,3-dihydro-2H-benzimidazol-2-iminium 3-carboxy-4-hydroxybenzenesulfonate","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","","","10.1107/S2056989024008557","","x-ray","1.54184","CuKα","","0.0378","0.0338","","","0.0962","0.0992","","","","","","1.055","","","","has coordinates","294669","2024-09-07","01:44:51",""
"2023247","7.14981","0.00011","9.79512","0.00011","10.74206","0.00014","90","","96.9437","0.0014","90","","746.784","0.017","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Methoxy-5-nitroaniline","","- C7 H8 N2 O3 -","- C7 H8 N2 O3 -","- C28 H32 N8 O12 -","4","1","EV2011","Filley, Jonathan","Color center creation by dipole stacking in crystals of 2-methoxy-5-nitroaniline","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","","","10.1107/S2056989024008739","","x-ray","1.54184","CuKα","","0.0392","0.0353","","","0.0927","0.0974","","","","","","1.057","","","","has coordinates","294712","2024-09-11","01:38:06",""
"2023248","6.2445","0.0008","13.2335","0.0016","13.4984","0.0016","79.168","0.002","88.671","0.002","78.962","0.002","1075.2","0.2","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","Tris[(6-bromopyridin-2-yl)methyl]amine","","- C18 H15 Br3 N4 -","- C18 H15 Br3 N4 -","- C36 H30 Br6 N8 -","2","1","EV2008","Yan, Ran; Dai, Zhaohua; Shlian, Daniel G.; Mitchell, Trinit'y D.; Loo, Aaron; Mulosmani, Kaltrina; Upmacis, Rita K.","Molecular structure of tris[(6-bromopyridin-2-yl)methyl]amine","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","","","10.1107/S2056989024008685","","","0.71073","MoKα","","0.0884","0.0452","","","0.0984","0.1139","","","","","","1.016","","","","has coordinates","294713","2024-09-11","01:38:20",""
"2023249","9.3404","0.0006","13.1888","0.0009","17.4549","0.0011","79.515","0.002","87.981","0.002","88.516","0.002","2112.6","0.2","300","2","300","2","","","","","","","","5","P -1","-P 1","2","3-Methyl-1-(2-thiocyanatoacetyl)-2,6-bis(4-methylphenyl)piperidin-4-one","1-[2-(Cyanosulfanyl)acetyl]-3-methyl-2,6-bis(4-methylphenyl)piperidin-4-one","","- C23 H24 N2 O2 S -","- C23 H24 N2 O2 S -","- C92 H96 N8 O8 S4 -","4","2","VU2005","Karthiga, A. R.; Divyabharathi, S.; Shalo, R. Reshwen; Rajeswari, K.; Vidhyasagar, T.; Selvanayagam, S.","Crystal structure, Hirshfeld surface analysis, DFT optimized molecular structure and the molecular docking studies of 1-[2-(cyanosulfanyl)acetyl]-3-methyl-2,6-bis(4-methylphenyl)piperidin-4-one","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","","","10.1107/S2056989024008508","","","0.71073","MoKα","","0.1594","0.0769","","","0.1859","0.2423","","","","","","1.052","","","","has coordinates,has disorder","294735","2024-09-13","01:33:45",""
"2023250","9.4289","0.001","9.6739","0.0009","11.4872","0.0011","90","","97.668","0.004","90","","1038.43","0.18","270","2","270","2","","","","","","","","4","P 1 21 1","P 2yb","4","","4'-Cyano-[1,1'-biphenyl]-4-yl 3-(benzyloxy)benzoate","","- C27 H19 N O3 -","- C27 H19 N O3 -","- C54 H38 N2 O6 -","2","1","HB8105","Harish Kumar, M.; Vinduvahini, M.; Devarajegowda, H. C.; Srinivasa, H. T.; Palakshamurthy, B. S.","Synthesis, crystal structure and Hirshfeld surface analysis of 4′-cyano-[1,1′-biphenyl]-4-yl 3-(benzyloxy)benzoate","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","","","10.1107/S2056989024008570","","","0.71073","MoKα","","0.0432","0.0379","","","0.0777","0.0795","","","","","","1.083","","","","has coordinates","294736","2024-09-13","01:34:01",""
"2023251","13.732","0.0001","8.2475","0.0001","15.5387","0.0002","90","","107.505","0.001","90","","1678.33","0.03","100.01","0.1","100.01","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(<i>E</i>)-<i>N</i>-(2-Styrylphenyl)benzenesulfonamide","<i>N</i>-{2-[(<i>E</i>)-2-Phenylethenyl]phenyl}benzenesulfonamide","","- C20 H17 N O2 S -","- C20 H17 N O2 S -","- C80 H68 N4 O8 S4 -","4","1","NX2013","Albert A. M., Dharani; Nagaraj, Achyuta; Somarathinam, Kanagasabai; Vinayagam, Pavunkumar; Arasambattu K., Mohanakrishnan; Kothandan, Gugan","Crystal structure and Hirshfeld surface analysis of (E)-N-(2-styrylphenyl)benzenesulfonamide","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","","","10.1107/S2056989024008892","","x-ray","1.54184","CuKα","","0.0329","0.0316","","","0.0834","0.0844","","","","","","1.073","","","","has coordinates","294840","2024-09-21","02:24:17",""
"2023252","11.087","0.003","11.758","0.005","11.991","0.003","90","","115.337","0.006","90","","1412.8","0.8","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(Phenylselanyl)[1,2,4]selenadiazolo[4,5-<i>a</i>]pyridin-4-ylium chloride dichloromethane","","- C12.35 H9.7 Cl1.7 N2 Se2 -","- C12.352 H9.704 Cl1.704 N2 Se2 -","- C49.408 H38.816 Cl6.816 N8 Se8 -","4","1","JW2003","Temesgen, Ayalew W.; Tskhovrebov, Alexander G.; Artemjev, Alexey A.; Kubasov, Alexey S.; Novikov, Alexander S.; Borisov, Alexander V.; Kirichuk, Anatoly A.; Kritchenkov, Andreii S.; Le, Tuan Anh","Coupling between 2-pyridylselenyl chloride and phenylselenocyanate: synthesis, crystal structure and non-covalent interactions","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","","","10.1107/S2056989024008831","","","0.71073","MoKα","","0.0634","0.0432","","","0.0826","0.0881","","","","","","1.062","","","","has coordinates,has disorder","294841","2024-09-21","02:24:39",""
"2023253","10.297","0.004","10.94","0.004","11.711","0.005","63.57","0.03","72.47","0.03","62.92","0.03","1043.8","0.8","163","2","163","2","","","","","","","","6","P -1","-P 1","2","Indium(III)[5-nonanoyl-8-hydroxyquinolinate]dichloride monohydrate","Bis(μ~2~-5-nonanoylquinolin-8-olato)bis[aquadichloridoindium(III)]","","- C36 H48 Cl4 In2 N2 O6 -","- C36 H48 Cl4 In2 N2 O6 -","- C36 H48 Cl4 In2 N2 O6 -","1","0.5","JP2009","Fuhrmann, Betty; Meier, Eric; Mazik, Monika","Crystal structure of bis(μ2-5-nonanoylquinolin-8-olato)bis[aquadichloridoindium(III)]","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","","","10.1107/S205698902400882X","","x-ray","0.71073","MoKα","","0.0713","0.0388","","","0.0555","0.0606","","","","","","0.879","","","","has coordinates","294842","2024-09-21","02:25:13",""
"2023254","11.67627","0.00007","11.61861","0.00006","10.60662","0.00007","90","","107.593","0.0007","90","","1371.61","0.015","99.99","0.1","99.99","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[ethanol(μ-4-methylpyridine <i>N</i>-oxide)di-μ-thiocyanato-cobalt(II)]","","- C10 H13 Co N3 O2 S2 -","- C10 H13 Co N3 O2 S2 -","- C40 H52 Co4 N12 O8 S8 -","4","1","PK2710","Näther, Christian; Jess, Inke","Synthesis and crystal structure of poly[ethanol(μ-4-methylpyridine N-oxide)di-μ-thiocyanato-cobalt(II)]","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","","","10.1107/S2056989024009058","","x-ray","1.54184","CuKα","","0.0223","0.0221","","","0.0581","0.0582","","","","","","1.051","","","","has coordinates","294843","2024-09-21","02:26:26",""
"2023255","11.9686","0.0012","21.18","0.002","20.107","0.002","90","","92.659","0.007","90","","5091.5","0.9","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","A1/A2-Bromobutoxy–hydroxy difunctionalized pillar[5]arene– hexanedinitrile (1/1)","","- C53 H61.18 Br0.82 N2 O10 -","- C52.9988 H61.1838 Br0.8153 N2 O9.9997 -","- C211.995 H244.735 Br3.2612 N8 O39.9988 -","4","1","JQ2036","Vinodh, Mickey; Al-Azemi, Talal F.","Crystal structure and supramolecular features of a host–guest inclusion complex based on A1/A2-hetero-difunctionalized pillar[5]arene","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","","","10.1107/S2056989024009216","","","0.71075","MoKα","","0.0951","0.0541","","","0.1479","0.1702","","","","","","1.017","","","","has coordinates,has disorder","294881","2024-09-25","02:05:46",""
"2023256","11.3889","0.0008","15.6537","0.0011","12.5193","0.0009","90","","99.92","0.002","90","","2198.6","0.3","100.15","","100.15","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,2'-Diisobutoxy-1,1'-binaphthalene","","- C28 H30 O2 -","- C28 H30 O2 -","- C112 H120 O8 -","4","1","HB8104","Coulibaly, Pénayori Marie-Aimée; Ziki, Eric; Bisseyou, Yvon Bibila Mayaya; Camara, Tchambaga Etienne; Coulibaly, Souleymane; Sissouma, Drissa","Synthesis, non-spherical structure refinement and Hirshfeld surface analysis of racemic 2,2′-diisobutoxy-1,1′-binaphthalene","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","","","10.1107/S2056989024009101","","","0.71073","MoKα","","0.0352","0.0226","","","0.0441","0.0502","","","","","","1.0755","","","","has coordinates","294882","2024-09-25","02:06:02",""
"2023257","7.0557","0.0005","14.5923","0.0008","17.4171","0.0013","90","","92.253","0.009","90","","1791.9","0.2","170","2","170.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[[μ-chlorido-μ-(2,3-dimethylpyrazine)-copper(I)] ethanol hemisolvate]","","- C7 H11 Cl Cu N2 O0.5 -","- C7 H11 Cl Cu N2 O0.5 -","- C56 H88 Cl8 Cu8 N16 O4 -","8","2","NX2014","Näther, Christian; Jess, Inke","Synthesis and crystal structure of poly[[μ-chlorido-μ-(2,3-dimethylpyrazine)-copper(I)] ethanol hemisolvate], which shows a new isomeric CuCl(2,3-dimethylpyrazine) network","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","","","10.1107/S2056989024009174","","","0.71073","MoKα","","0.0558","0.0378","","","0.0917","0.0998","","","","","","1.014","","","","has coordinates,has disorder","294883","2024-09-25","02:06:19",""
"2023258","19.1227","0.001","19.1227","0.001","7.477","0.0005","90","","90","","120","","2367.9","0.2","173","2","173","2","","","","","","","","5","P -3","-P 3","147","","Hexakis(1-methyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)zinc(II) dinitrate","","- C24 H36 N14 O6 Zn -","- C24 H36 N14 O6 Zn -","- C72 H108 N42 O18 Zn3 -","3","0.5","YY2011","Magwa, Nomampondo Penelope; Rashamuse, Thompho Jason","Synthesis, characterization, and crystal structure of hexakis(1-methyl-1H-imidazole-κN 3)zinc(II) dinitrate","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","","","10.1107/S2056989024008806","","x-ray","0.71073","MoKα","","0.036","0.0315","","","0.0829","0.0904","","","","","","1.121","","","","has coordinates","294884","2024-09-25","02:06:39",""
"2023259","5.8838","0.0008","11.6532","0.0015","12.3276","0.0016","84.722","0.006","78.442","0.005","81.94","0.005","818.14","0.19","298","2","298","2","","","","","","","","5","P -1","-P 1","2","Sulfamethoxazolium methyl sulfate monohydrate","4-[(5-Methyl-1,2-oxazol-3-yl)sulfamoyl]anilinium methyl sulfate monohydrate","","- C11 H17 N3 O8 S2 -","- C11 H17 N3 O8 S2 -","- C22 H34 N6 O16 S4 -","2","1","EX2088","Moroni, Aldana B.; Bottoso, Tiago; Lionello, Diego F.; Vega, Daniel R.; Kaufman, Teodoro S.; Calvo, Natalia L.","Synthesis, crystal structure and Hirshfeld surface analysis of sulfamethoxazolium methylsulfate monohydrate","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","","","10.1107/S2056989024009204","","","0.71073","MoKα","","0.0568","0.043","","","0.089","0.1","","","","","","1.058","","","","has coordinates","294885","2024-09-25","02:06:54",""
"2023260","9.1085","0.0009","13.1958","0.0013","14.9869","0.0014","90","","102.261","0.003","90","","1760.2","0.3","150.15","","150.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Trichloro-phenyl-(1,10-phenanthroline)-tin(iv)","Trichlorido(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')phenyltin(IV)","","- C18 H13 Cl3 N2 Sn -","- C18 H13 Cl3 N2 Sn -","- C72 H52 Cl12 N8 Sn4 -","4","1","ZN2038","Benlatreche, Tarek; Bensegueni, Mohamed Abdellatif; Dénès, Georges; Golhen, Stéphane; Merazig, Hocine","Crystal structure and Hirshfeld surface analysis of trichlorido(1,10-phenanthroline-κ2 N,N′)phenyltin(IV)","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","","","10.1107/S2056989024009150","","","0.71073","MoKα","","0.0289","0.0246","","","0.0523","0.0545","","","","","","1.142","","","","has coordinates","294886","2024-09-25","02:07:09",""
"2023261","8.4699","0.0005","9.7818","0.0005","12.9026","0.0011","77.238","0.006","89.207","0.006","78.038","0.005","1019.37","0.12","291.15","","291.15","","","","","","","","","6","P -1","-P 1","2","","8-Hydroxyquinolinium trichlorido(pyridine-2,6-dicarboxylic acid-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')copper(II) dihydrate","","- C16 H17 Cl3 Cu N2 O7 -","- C16 H17 Cl3 Cu N2 O7 -","- C32 H34 Cl6 Cu2 N4 O14 -","2","1","EJ2008","Nazarov, Yusufjon Eshkobilovich; Turaev, Khayit Khudainazarovich; Suyunov, Jabbor Ruziboevich; Alimnazarov, Bekmurod Khurramovich; Rasulov, Abdusamat Abdujabborovich; Ibragimov, Bakhtiyar Tulyaganovich; Ashurov, Jamshid Mengnorovich","8-Hydroxyquinolinium trichlorido(pyridine-2,6-dicarboxylic acid-κ3 O,N,O′)copper(II) dihydrate","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","","","10.1107/S2056989024009186","","x-ray","1.54184","CuKα","","0.0611","0.0415","","","0.0937","0.1046","","","","","","1.013","","","","has coordinates","294887","2024-09-25","02:07:30",""
"2023262","12.8451","0.0014","7.4508","0.0007","15.9284","0.0017","90","","96.965","0.003","90","","1513.2","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","{2-[Bis(pyridin-2-ylmethyl)amino]ethane-1-thiolato}chloridocadmium(II)","","- C14 H16 Cd Cl N3 S -","- C14 H16 Cd Cl N3 S -","- C56 H64 Cd4 Cl4 N12 S4 -","4","1","YZ2058","Reynolds, Todd M.; Berry, Steven M.; Bebout, Deborah C.","Crystal structure and Hirshfeld surface analysis of {2-[bis(pyridin-2-ylmethyl)amino]ethane-1-thiolato}chloridocadmium(II)","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","1081","1086","10.1107/S2056989024009198","","","0.71073","MoKα","","0.0153","0.0148","","","0.0348","0.0353","","","","","","1.078","","","","has coordinates","294949","2024-10-01","02:14:07",""
"2023263","9.5599","0.0004","11.8056","0.0005","17.5322","0.0007","94.808","0.002","104.562","0.002","95.408","0.002","1894.7","0.14","100","0.5","100","0.5","","","","","","","","5","P -1","-P 1","2","","2,3,5-Triphenyltetrazol-3-ium chloride hemipentahydrate","","- C19 H20 Cl N4 O2.5 -","- C19 H20 Cl N4 O2.5 -","- C76 H80 Cl4 N16 O10 -","4","2","HB8107","Uppu, Rao M.; Chikkula, Krishnaveni; Saneei, Soheil; Babu, Sainath; Fronczek, Frank R.","Structure of 2,3,5-triphenyltetrazol-3-ium chloride hemipentahydrate","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","1097","1100","10.1107/S205698902400940X","","","0.56086","AgKα","","0.078","0.0632","","","0.134","0.1413","","","","","","1.158","","","","has coordinates","294950","2024-10-01","02:14:35",""
"2023264","14.2552","0.0004","9.0574","0.0002","23.0043","0.0007","90","","96.703","0.003","90","","2949.9","0.14","100","2","100","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","Bis(triisopropylphosphane sulfide)gold(I) tetrachloridoaurate(III)","Bis[tris(propan-2-yl)-λ^5^-phosphanethione-κ<i>S</i>]gold(I) tetrachloridoaurate(III)","","- C18 H42 Au2 Cl4 P2 S2 -","- C18 H42 Au2 Cl4 P2 S2 -","- C72 H168 Au8 Cl16 P8 S8 -","4","1","WM5733","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of seven mixed-valence gold compounds of the form [(R 1 R 2 R 3PE)2AuI]+[AuIII X 4]− (R = tert-butyl or isopropyl, E = S or Se, and X = Cl or Br)","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","1087","1096","10.1107/S2056989024009095","","","0.71073","MoKα","","0.0463","0.0282","","","0.0449","0.0491","","","","","","1.047","","","","has coordinates","294951","2024-10-01","02:15:40",""
"2023265","11.7607","0.0003","16.4174","0.0004","17.2173","0.0004","79.931","0.002","76.467","0.002","78.015","0.002","3133.59","0.14","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H46 Au2 Cl4 P2 S2 -","- C20 H46 Au2 Cl4 P2 S2 -","- C80 H184 Au8 Cl16 P8 S8 -","4","2","WM5733","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of seven mixed-valence gold compounds of the form [(R 1 R 2 R 3PE)2AuI]+[AuIII X 4]− (R = tert-butyl or isopropyl, E = S or Se, and X = Cl or Br)","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","1087","1096","10.1107/S2056989024009095","","","0.71073","MoKα","","0.0488","0.0297","","","0.0495","0.0547","","","","","","1.052","","","","has coordinates","294951","2024-10-01","02:15:41",""
"2023266","8.5541","0.0002","9.155","0.0003","12.0421","0.0004","107.427","0.003","97.511","0.003","102.841","0.003","857.31","0.05","100","2","100","2","","","","","","","","6","P -1","-P 1","2","Bis(tri-<i>tert</i>-butylphosphane sulfide)gold(I) tetrachloridoaurate(III)","Bis(tri-<i>tert</i>-butylphosphane sulfide-κ<i>S</i>)gold(I) tetrachloridoaurate(III)","","- C24 H54 Au2 Cl4 P2 S2 -","- C24 H54 Au2 Cl4 P2 S2 -","- C24 H54 Au2 Cl4 P2 S2 -","1","0.5","WM5733","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of seven mixed-valence gold compounds of the form [(R 1 R 2 R 3PE)2AuI]+[AuIII X 4]− (R = tert-butyl or isopropyl, E = S or Se, and X = Cl or Br)","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","1087","1096","10.1107/S2056989024009095","","","0.71073","MoKα","","0.0204","0.0161","","","0.0365","0.0382","","","","","","1.094","","","","has coordinates","294951","2024-10-01","02:15:41",""
"2023267","13.7871","0.0004","10.4042","0.0003","22.724","0.0006","90","","93.035","0.003","90","","3255.04","0.16","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H46 Au2 Br4 P2 S2 -","- C20 H46 Au2 Br4 P2 S2 -","- C80 H184 Au8 Br16 P8 S8 -","4","1","WM5733","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of seven mixed-valence gold compounds of the form [(R 1 R 2 R 3PE)2AuI]+[AuIII X 4]− (R = tert-butyl or isopropyl, E = S or Se, and X = Cl or Br)","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","1087","1096","10.1107/S2056989024009095","","","0.71073","MoKα","","0.0601","0.0459","","","0.1032","0.1117","","","","","","1.015","","","","has coordinates","294951","2024-10-01","02:15:41",""
"2023268","13.7265","0.0003","10.5615","0.0003","22.7782","0.0005","90","","94.096","0.002","90","","3293.78","0.14","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Bis(<i>tert</i>-butyldiisopropylphosphane selenide)gold(I) tetrabromidoaurate(III)","Bis[<i>tert</i>-butylbis(propan-2-yl)-λ^5^-phosphaneselanone-κ<i>Se</i>]gold(I) tetrabromidoaurate(III)","","- C20 H46 Au2 Br4 P2 Se2 -","- C20 H46 Au2 Br4 P2 Se2 -","- C80 H184 Au8 Br16 P8 Se8 -","4","1","WM5733","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of seven mixed-valence gold compounds of the form [(R 1 R 2 R 3PE)2AuI]+[AuIII X 4]− (R = tert-butyl or isopropyl, E = S or Se, and X = Cl or Br)","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","1087","1096","10.1107/S2056989024009095","","","0.71073","MoKα","","0.0516","0.0298","","","0.0445","0.049","","","","","","1.027","","","","has coordinates","294951","2024-10-01","02:15:42",""
"2023269","8.4858","0.0004","9.3738","0.0004","11.991","0.0005","105.533","0.004","97.476","0.004","99.318","0.004","891.63","0.07","100","2","100","2","","","","","","","","6","P -1","-P 1","2","Bis(tri-<i>tert</i>-butylphosphane sulfide)gold(I) tetrabromidoaurate(III)","Bis(tri-<i>tert</i>-butylphosphane sulfide)gold(I) tetrabromidoaurate(III)","","- C24 H54 Au2 Br4 P2 S2 -","- C24 H54 Au2 Br4 P2 S2 -","- C24 H54 Au2 Br4 P2 S2 -","1","0.5","WM5733","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of seven mixed-valence gold compounds of the form [(R 1 R 2 R 3PE)2AuI]+[AuIII X 4]− (R = tert-butyl or isopropyl, E = S or Se, and X = Cl or Br)","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","1087","1096","10.1107/S2056989024009095","","","0.71073","MoKα","","0.0212","0.0165","","","0.0314","0.0325","","","","","","1.06","","","","has coordinates","294951","2024-10-01","02:15:42",""
"2023270","8.4403","0.0004","9.2135","0.0004","12.6496","0.0005","106.172","0.004","101.1","0.004","97.485","0.004","909.28","0.08","100","2","100","2","","","","","","","","6","P -1","-P 1","2","Bis(tri-<i>tert</i>-butylphosphane selenide)gold(I) tetrabromidoaurate(III)","Bis(tri-<i>tert</i>-butylphosphane selenide-κ<i>Se</i>)gold(I) tetrabromidoaurate(III)","","- C24 H54 Au2 Br4 P2 Se2 -","- C24 H54 Au2 Br4 P2 Se2 -","- C24 H54 Au2 Br4 P2 Se2 -","1","0.5","WM5733","Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza","Crystal structures of seven mixed-valence gold compounds of the form [(R 1 R 2 R 3PE)2AuI]+[AuIII X 4]− (R = tert-butyl or isopropyl, E = S or Se, and X = Cl or Br)","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","1087","1096","10.1107/S2056989024009095","","","0.71073","MoKα","","0.0284","0.0204","","","0.0344","0.0358","","","","","","1.062","","","","has coordinates","294951","2024-10-01","02:15:42",""
"2023271","5.782","0.0003","26.5057","0.0014","11.7704","0.0005","90","","90.407","0.004","90","","1803.84","0.15","160","0.1","160","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-[(1-Hexyl-1<i>H</i>-1,2,3-triazol-4-yl)methyl]-3-(1-methylethenyl)benzimidazol-2-one","","- C19 H25 N5 O -","- C19 H25 N5 O -","- C76 H100 N20 O4 -","4","1","WM5732","El Atrassi, Zakaria; Benzekri, Zakaria; Blacque, Olivier; Hökelek, Tuncer; Mazzah, Ahmed; Cherkaoui, Hassan; Sebbar, Nada Kheira","Crystal structure, Hirshfeld surface analysis, and calculations of intermolecular interaction energies and energy frameworks of 1-[(1-hexyl-1H-1,2,3-triazol-4-yl)methyl]-3-(1-methylethenyl)-benzimidazol-2-one","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","1075","1080","10.1107/S2056989024008703","","x-ray","1.54184","CuKα","","0.0561","0.0452","","","0.1164","0.1273","","","","","","1.026","","","","has coordinates,has disorder","294952","2024-10-01","02:16:09",""
"2023272","13.15698","0.00017","13.5836","0.00018","17.547","0.0003","88.5722","0.0012","87.003","0.0012","79.7149","0.0011","3080.99","0.08","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","","(η^2^:η^2^-Cycloocta-1,5-diene)(η^6^-toluene)iridium(I) tri-μ-chlorido-bis({3-[(di-<i>tert</i>-butylphosphanyl)oxy]-9,10-dioxoanthracen-2-yl}hydridoiridium(III)) toluene monosolvate,","","- C66 H78 Cl3 Ir3 O6 P2 -","- C66 H78 Cl3 Ir3 O6 P2 -","- C132 H156 Cl6 Ir6 O12 P4 -","2","1","JY2049","Thackeray, Sachin; Mahoney, James; Arrington, Ashleigh; Wilklow-Marnell, Miles; Brennessel, William W.","Crystal structures of the (η2:η2-cycloocta-1,5-diene)(η6-toluene)iridium(I) cation and μ-chlorido-iridium(III) complexes of 2-(phosphinito)- and 2-(phosphinomethyl)anthraquinone ligands","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","1101","1109","10.1107/S2056989024008922","","x-ray","1.54184","CuKα","","0.0432","0.0353","","","0.0886","0.0919","","","","","","1.04","","","","has coordinates,has disorder","294953","2024-10-01","02:16:30",""
"2023273","8.8215","0.0003","12.1331","0.0004","14.4895","0.0003","81.5747","0.0019","84.576","0.002","76.465","0.003","1488.57","0.08","173","0.1","173","0.1","","","","","","","","6","P -1","-P 1","2","","Di-μ-chlorido-bis(carbonyl{3-[(di-<i>tert</i>-butylphosphanyl)oxy]-9,10-dioxoanthracen-2-yl}hydridoiridium(I))","","- C48 H54 Cl2 Ir2 O6 P2 -","- C48 H54 Cl2 Ir2 O6 P2 -","- C48 H54 Cl2 Ir2 O6 P2 -","1","0.5","JY2049","Thackeray, Sachin; Mahoney, James; Arrington, Ashleigh; Wilklow-Marnell, Miles; Brennessel, William W.","Crystal structures of the (η2:η2-cycloocta-1,5-diene)(η6-toluene)iridium(I) cation and μ-chlorido-iridium(III) complexes of 2-(phosphinito)- and 2-(phosphinomethyl)anthraquinone ligands","Acta Crystallographica Section E Crystallographic Communications","2024","80","10","1101","1109","10.1107/S2056989024008922","","x-ray","1.54184","CuKα","","0.0298","0.027","","","0.0662","0.0671","","","","","","1.064","","","","has coordinates","294953","2024-10-01","02:16:31",""
"2023275","9.11238","0.00007","13.67434","0.0001","27.49214","0.00018","90","","92.9206","0.0006","90","","3421.23","0.04","100.01","0.1","100.01","0.1","","","","","","","","8","P 1 c 1","P -2yc","7","","(μ-Tetrathioantimonato-κ^2^<i>S</i>:<i>S</i>')bis[(1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>)zinc(II)] perchlorate 0.8-hydrate","","- C20 H49.6 Cl N8 O4.8 S4 Sb Zn2 -","- C20 H49.6 Cl N8 O4.8 S4 Sb Zn2 -","- C80 H198.4 Cl4 N32 O19.2 S16 Sb4 Zn8 -","4","2","HB8108","Näther, Christian; Lühmann, Henning; Bensch, Wolfgang","Synthesis, crystal structure and properties of μ-tetrathioantimonato-bis[(cyclam)zinc(II)] perchlorate 0.8-hydrate","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1151","1156","10.1107/S2056989024009356","","x-ray","0.71073","MoKα","","0.0238","0.0227","","","0.0577","0.0582","","","","","","1.025","","","","has coordinates,has disorder","296768","2024-12-07","17:09:04",""
"2023276","6.7412","0.0008","8.2961","0.0008","11.8621","0.0017","79.608","0.002","89.207","0.002","87.03","0.001","651.63","0.14","173","2","173.15","","","","","","","","","6","P -1","-P 1","2","","<i>catena</i>-Poly[[triaquasodium]-di-μ-aqua-[triaquasodium]-μ-(ethane-1,2-diyl)bis[(3-methoxypropyl)phosphinodithiolato]]","","- C5 H19 Na O5 P S2 -","- C5 H19 Na O5 P S2 -","- C10 H38 Na2 O10 P2 S4 -","2","1","EV2010","Nell, Bryan P.; Tyler, David R.; Zakharov, Lev N.; Johnston, Dean H.","Synthesis and crystal structure of sodium (ethane-1,2-diyl)bis[(3-methoxypropyl)phosphinodithiolate] octahydrate","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1138","1141","10.1107/S2056989024009642","","x-ray","0.71073","MoKα","","0.03","0.0264","","","0.0653","0.068","","","","","","1.021","","","","has coordinates,has disorder","296769","2024-12-07","17:09:12",""
"2023277","9.5718","0.0006","14.4498","0.0008","20.0041","0.0012","90","","92.874","0.002","90","","2763.3","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","<i>N</i>-{[3-Bromo-1-(phenylsulfonyl)-1<i>H</i>-indol-2-yl]methyl}-<i>N</i>-(4-bromo-3-methoxyphenyl)benzenesulfonamide","","- C28 H22 Br2 N2 O5 S2 -","- C28 H22 Br2 N2 O5 S2 -","- C112 H88 Br8 N8 O20 S8 -","4","1","NU2007","Madhan, S.; NizamMohideen, M.; Pavunkumar, Vinayagam; MohanaKrishnan, Arasambattu K.","The crystal structures determination and Hirshfeld surface analysis of N-(4-bromo-3-methoxyphenyl)- and N-{[3-bromo-1-(phenylsulfonyl)-1H-indol-2-yl]methyl}- derivatives of N-{[3-bromo-1-(phenylsulfonyl)-1H-indol-2-yl]methyl}benzenesulfonamide","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1110","1117","10.1107/S2056989024009587","","","0.71073","MoKα","","0.0568","0.0403","","","0.0888","0.0992","","","","","","1.053","","","","has coordinates","296771","2024-12-07","17:09:50",""
"2023278","8.2664","0.0004","34.7886","0.0018","12.5972","0.0006","90","","104.55","0.002","90","","3506.5","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","<i>N</i>,<i>N</i>-Bis{[3-bromo-1-(phenylsulfonyl)-1<i>H</i>-indol-2-yl]methyl}benzenesulfonamide","","- C36 H27 Br2 N3 O6 S3 -","- C36 H27 Br2 N3 O6 S3 -","- C144 H108 Br8 N12 O24 S12 -","4","1","NU2007","Madhan, S.; NizamMohideen, M.; Pavunkumar, Vinayagam; MohanaKrishnan, Arasambattu K.","The crystal structures determination and Hirshfeld surface analysis of N-(4-bromo-3-methoxyphenyl)- and N-{[3-bromo-1-(phenylsulfonyl)-1H-indol-2-yl]methyl}- derivatives of N-{[3-bromo-1-(phenylsulfonyl)-1H-indol-2-yl]methyl}benzenesulfonamide","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1110","1117","10.1107/S2056989024009587","","","0.71073","MoKα","","0.0621","0.0478","","","0.1133","0.1199","","","","","","1.118","","","","has coordinates","296771","2024-12-07","17:09:50",""
"2023279","9.1747","0.0008","17.3698","0.0013","20.841","0.002","90","","101.049","0.003","90","","3259.7","0.5","300.15","","300.15","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","[1,3-Di-<i>tert</i>-butyl-2,4-bis(<i>tert</i>-butylamino)-1,3,2λ^5^,4λ^5^-diazadiphosphetidine-2,4-diselone-κ^2^<i>Se</i>,<i>Se</i>']diiodidomercury(II) <i>N</i>,<i>N</i>-dimethylformamide monosolvate","","- C19 H45 Hg I2 N5 O P2 Se2 -","- C19 H45 Hg I2 N5 O P2 Se2 -","- C76 H180 Hg4 I8 N20 O4 P8 Se8 -","4","1","EV2009","Selby-Karney, Troy; Sampath, Kalpana; Arumugam, Kuppuswamy; Chandrasekaran, Chandru P.","Mercury(II) halide complex of cis-[( t BuNH)(Se)P(μ-N t Bu)2P(Se)(NH t Bu)]","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1142","1145","10.1107/S205698902400937X","","","0.71073","MoKα","","0.0702","0.0401","","","0.0789","0.0885","","","","","","1","","","","has coordinates","296772","2024-12-07","17:10:00",""
"2023280","9.4306","0.0003","8.5084","0.0003","26.7891","0.001","90","","93.27","0.001","90","","2146.04","0.13","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Benzyl-1-(3-bromopropyl)-5,5-diphenylimidazolidine-2,4-dione","","- C25 H23 Br N2 O2 -","- C25 H23 Br N2 O2 -","- C100 H92 Br4 N8 O8 -","4","1","JY2051","Lamssane, Houda; Haoudi, Amal; Kartah, Badr Eddine; Mazzah, Ahmed; Mague, Joel T.; Hökelek, Tuncer; Kandri Rodi, Youssef; Sebbar, Nada Kheira","Crystal structure and Hirshfeld surface analyses, crystal voids, intermolecular interaction energies and energy frameworks of 3-benzyl-1-(3-bromopropyl)-5,5-diphenylimidazolidine-2,4-dione","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1118","1124","10.1107/S2056989024009228","","","1.54178","CuKα","","0.0239","0.0236","","","0.0593","0.0595","","","","","","1.053","","","","has coordinates","296773","2024-12-07","17:10:13",""
"2023281","7.1738","0.0004","7.2872","0.0004","32.0348","0.0018","90","","91.111","0.002","90","","1674.37","0.16","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","<i>N</i>,<i>N</i>'-Dibenzylethylenediammonium dichloride","Benzyl[2-(benzylazaniumyl)ethyl]azanium dichloride","","- C16 H22 Cl2 N2 -","- C16 H22 Cl2 N2 -","- C64 H88 Cl8 N8 -","4","1","YY2013","Marmande, Mary Helene; Baxter, Bailey N.; Zeller, Matthias; Forbes, David C.","N,N′-Dibenzylethylenediammonium dichloride","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1130","1134","10.1107/S205698902400954X","","","1.54178","CuKα","","0.0348","0.0325","","","0.0937","0.0952","","","","","","1.075","","","","has coordinates","296774","2024-12-07","17:10:23",""
"2023282","12.3711","0.0007","3.8255","0.0002","21.4175","0.0012","90","","104.195","0.002","90","","982.65","0.09","123","","123","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4,4'-Bipyridine–4-nitrophenol (1/2)","","- C22 H18 N4 O6 -","- C22 H18 N4 O6 -","- C44 H36 N8 O12 -","2","0.5","JY2052","Gotingco, Angela; Villanueva Contreras, Merary; Wolfarth, Jeanette A.; Stieber, S. Chantal E.; Marr, Zoe Y.","Crystal structure of a hydrogen-bonded 2:1 co-crystal of 4-nitrophenol and 4,4′-bipyridine","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1135","1137","10.1107/S205698902400971X","","","0.71073","MoKα","","0.0765","0.0574","","","0.147","0.161","","","","","","1.098","","","","has coordinates","296777","2024-12-07","17:10:51",""
"2023283","8.7321","0.0005","15.2444","0.0009","10.8545","0.0006","90","","94.973","0.005","90","","1439.46","0.14","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Nitrato-κ^2^<i>O</i>,<i>O</i>')(1,4,7,10-tetraazacyclododecane-κ^4^<i>N</i>)nickel(II) nitrate","","- C8 H20 N6 Ni O6 -","- C8 H20 N6 Ni O6 -","- C32 H80 N24 Ni4 O24 -","4","1","PK2709","Reibenspies, Joseph; Small, Nadia; Bhuvanesh, Nattamai; Chiarella, Gina; Salazar, Vivian; Pery, Bréayshia; Smith, Rukiyah; Toole, Deja; Hewage, Shamika; Fernando, Harschica; Reinheimer, Eric","Crystal structure and Hirshfeld surface analysis of (nitrato-κ2 O,O′)(1,4,7,10-tetraazacyclododecane-κ4 N)nickel(II) nitrate","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1157","1160","10.1107/S2056989024009496","","","0.71073","MoKα","","0.0534","0.0362","","","0.0903","0.1044","","","","","","1.086","","","","has coordinates","296778","2024-12-07","17:11:00",""
"2023284","9.05718","0.00012","6.71363","0.00011","32.8419","0.0004","90","","95.9308","0.0012","90","","1986.31","0.05","99.99","0.11","99.99","0.11","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","[1-(3,4-Dimethoxybenzyl)-6,7-dimethoxyisoquinoline–fumaric acid (1/0.5)","","- C22 H23 N O6 -","- C22 H23 N O6 -","- C88 H92 N4 O24 -","4","1","OX2007","Shibata, Hiroki; Sakon, Aya; Takata, Noriyuki; Takiyama, Hiroshi","Crystal structures of two different multi-component crystals consisting of 1-(3,4-dimethoxybenzyl)-6,7-dimethoxyisoquinoline and fumaric acid","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1146","1150","10.1107/S2056989024009794","","x-ray","1.54184","CuKα","","0.0347","0.0325","","","0.0852","0.087","","","","","","1.0424","","","","has coordinates","296780","2024-12-07","17:11:21",""
"2023285","9.529","0.0002","10.5445","0.0003","12.6509","0.0004","91.606","0.002","104.98","0.002","97.823","0.002","1213.86","0.06","99.9","0.4","99.9","0.4","","","","","","","","4","P -1","-P 1","2","","[1-(3,4-Dimethoxybenzyl)-6,7-dimethoxyisoquinoline–fumaric acid (1/1.5)","","- C26 H27 N O10 -","- C26 H27 N O10 -","- C52 H54 N2 O20 -","2","1","OX2007","Shibata, Hiroki; Sakon, Aya; Takata, Noriyuki; Takiyama, Hiroshi","Crystal structures of two different multi-component crystals consisting of 1-(3,4-dimethoxybenzyl)-6,7-dimethoxyisoquinoline and fumaric acid","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1146","1150","10.1107/S2056989024009794","","x-ray","1.54184","CuKα","","0.0599","0.0467","","","0.1226","0.1325","","","","","","1.064","","","","has coordinates,has disorder","296780","2024-12-07","17:11:21",""
"2023286","3.8056","0.00005","9.49424","0.00011","14.01599","0.00015","90","","92.9639","0.0011","90","","505.738","0.01","123.15","","123.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1<i>H</i>-1,2,4-Triazole-3,5-diamine monohydrate","","- C2 H7 N5 O -","- C2 H7 N5 O -","- C8 H28 N20 O4 -","4","1","DX2060","Inoue, Kazuki; Nakami, Shun; Kumasaki, Mieko; Matsumoto, Shinya","Synthesis and crystal structure of 1H-1,2,4-triazole-3,5-diamine monohydrate","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1161","1164","10.1107/S2056989024009265","","x-ray","1.54184","CuKα","","0.0318","0.0312","","","0.0799","0.0805","","","","","","1.11","","","","has coordinates","296787","2024-12-07","17:12:39",""
"2023287","17.4126","0.0013","5.0996","0.0004","14.9856","0.0011","90","","109.652","0.002","90","","1253.17","0.16","296","2","296","2","","","","","","","","3","C 1 2 1","C 2y","5","(1<i>S</i>,2<i>R</i>,3<i>S</i>,4<i>R</i>)-5-(But-3-en-1-ynyl)-1,2-dihydroxy-3,4-isopropylidenedioxocycle-5-hexene","(3a<i>S</i>,4<i>R</i>,5<i>S</i>,7a<i>R</i>)-7-(But-3-en-1-yn-1-yl)-2,2-dimethyl-3a,4,5,7a-tetrahydro-2<i>H</i>-1,3-benzodioxole-4,5-diol","","- C13 H16 O4 -","- C13 H16 O4 -","- C52 H64 O16 -","4","1","EE2008","Peixoto de Abreu Lima, Alejandro; Pandolfi, Enrique; Schapiro, Valeria; Suescun, Leopoldo","Synthesis, crystal structure and absolute configuration of (3aS,4R,5S,7aR)-7-(but-3-en-1-yn-1-yl)-2,2-dimethyl-3a,4,5,7a-tetrahydro-2H-1,3-benzodioxole-4,5-diol","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1165","1169","10.1107/S2056989024009733","","","1.54178","CuKα","","0.0908","0.0804","","","0.2344","0.2483","","","","","","1.128","","","","has coordinates","296788","2024-12-07","17:12:46",""
"2023288","9.6288","0.0003","11.5103","0.0004","13.0302","0.0005","78.734","0.003","81.153","0.003","77.708","0.003","1374.33","0.09","149.99","0.1","149.99","0.1","","","","","","","","5","P -1","-P 1","2","","Bis[2-methyl-3-(pyridin-2-yl)imidazo[1,5-<i>a</i>]pyridin-2-ium] tetrachloridocadmium(II)","","- C26 H24 Cd Cl4 N6 -","- C26 H24 Cd Cl4 N6 -","- C52 H48 Cd2 Cl8 N12 -","2","1","EJ2007","Vassilyeva, Olga Yu.; Buvaylo, Elena A.; Kokozay, Vladimir N.; Goreshnik, Evgeny A.","Triclinic polymorph of bis[2-methyl-3-(pyridin-2-yl)imidazo[1,5-a]pyridin-2-ium] tetrachloridocadmium(II)","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1125","1129","10.1107/S2056989024009654","","x-ray","0.71073","MoKα","","0.0438","0.0313","","","0.0589","0.0649","","","","","","1.092","","","","has coordinates","296789","2024-12-07","17:12:57",""
"2023291","9.4484","0.0008","7.0977","0.0007","15.3781","0.0014","90","","90","","90","","1031.28","0.16","296.15","","296.15","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-Hydroxy-<i>N</i>'-methylacetohydrazide","","- C3 H8 N2 O2 -","- C3 H8 N2 O2 -","- C24 H64 N16 O16 -","8","1","YZ2059","Vashchenko, Oleksandr V.; Khomenko, Dmytro M.; Dyakonenko, Viktoriya V.; Lampeka, Rostyslav D.","Synthesis, structures and Hirshfeld surface analyses of 2-hydroxy-N′-methylacetohydrazide and 2-hydroxy-N-methylacetohydrazide","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1170","1174","10.1107/S2056989024009526","","","0.71073","MoKα","","0.1091","0.1028","","","0.1957","0.1985","","","","","","1.339","","","","has coordinates","296781","2024-12-07","17:11:31",""
"2023292","11.646","0.01","9.304","0.01","10.514","0.01","90","","105.65","0.04","90","","1097","1.8","296.15","","296.15","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-Hydroxy-<i>N</i>-methylacetohydrazide","","- C3 H8 N2 O2 -","- C3 H8 N2 O2 -","- C24 H64 N16 O16 -","8","1","YZ2059","Vashchenko, Oleksandr V.; Khomenko, Dmytro M.; Dyakonenko, Viktoriya V.; Lampeka, Rostyslav D.","Synthesis, structures and Hirshfeld surface analyses of 2-hydroxy-N′-methylacetohydrazide and 2-hydroxy-N-methylacetohydrazide","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1170","1174","10.1107/S2056989024009526","","","0.71073","MoKα","","0.1624","0.0499","","","0.1049","0.1259","","","","","","0.813","","","","has coordinates","296781","2024-12-07","17:11:31",""
"2023293","35.5812","0.0004","29.757","0.0003","8.8942","0.0001","90","","90","","90","","9417.09","0.18","100.01","0.1","100.01","0.1","","","","","","","","6","F d d 2","F 2 -2d","43","","[μ~2~-7-[{Bis(pyridin-2-ylmethyl)amino-1κ^3^<i>N</i>,<i>N</i>',<i>N</i>''}methyl]-5-chloroquinolin-8-olato-2κ<i>N</i>;1:2κ^2^<i>O</i>]trichlorido-1κ<i>Cl</i>,2κ^2^<i>Cl</i>-dizinc(II)","","- C22 H18 Cl4 N4 O Zn2 -","- C22 H18 Cl4 N4 O Zn2 -","- C352 H288 Cl64 N64 O16 Zn32 -","16","1","JP2012","Kubono, Koji; Tanaka, Kanata; Tani, Keita; Kashiwagi, Yukiyasu","Crystal structure of (μ2-7-{[bis(pyridin-2-ylmethyl)amino-1κ3 N,N′,N′′]methyl}-5-chloroquinolin-8-olato-2κN;1:2κ2 O)trichlorido-1κCl,2κ2 Cl-dizinc(II)","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1175","1179","10.1107/S2056989024009782","","x-ray","1.54184","CuKα","","0.0285","0.028","","","0.0726","0.0731","","","","","","1.037","","","","has coordinates","296786","2024-12-07","17:12:31",""
"2023294","10.6348","0.0003","11.139","0.0004","11.7989","0.0003","72.392","0.003","64.047","0.003","75.829","0.003","1187.52","0.07","293","","293","","","","","","","","","5","P -1","-P 1","2","","(2-Amino-1-methylbenzimidazole-κ<i>N</i>^3^)aquabis(4-oxopent-2-en-2-olato-κ^2^<i>O</i>,<i>O</i>')nickel(II) ethanol monosolvate","","- C20 H31 N3 Ni O6 -","- C20 H31 N3 Ni O6 -","- C40 H62 N6 Ni2 O12 -","2","1","NY2006","Siddikova, Kyzlarkhan; Sardor, Murodov; Tojiboyev, Akmaljon; Kadirova, Zukhra; Ashurov, Jamshid; Daminova, Shahlo","Synthesis, crystal structure and Hirshfeld surface analysis of (2-amino-1-methylbenzimidazole-κN 3)aquabis(4-oxopent-2-en-2-olato-κ2 O,O′)nickel(II) ethanol monosolvate","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1186","1189","10.1107/S2056989024008958","","x-ray","1.54184","CuKα","","0.0632","0.0479","","","0.1251","0.1393","","","","","","1.076","","","","has coordinates","296776","2024-12-07","17:10:42",""
"2023295","9.3141","0.0003","6.7593","0.0002","15.3574","0.0005","90","","105.163","0.001","90","","933.19","0.05","285","2","285","2","","","","","","","","4","P 1 21 1","P 2yb","4","","6-Cyanonaphthalen-2-yl 4-(benzyloxy)benzoate","","- C25 H17 N O3 -","- C25 H17 N O3 -","- C50 H34 N2 O6 -","2","1","WM5736","Harish Kumar, Mahadevaiah; Santhosh Kumar, Shivakumar; Devarajegowda, Hirehalli Chikkegowda; Srinivasa, Hosapalya Thimmaiah; Palakshamurthy, Bandrehalli Siddagangaiah","Crystal structure, Hirshfeld surface analysis, and DFT and molecular docking studies of 6-cyanonaphthalen-2-yl 4-(benzyloxy)benzoate","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1180","1185","10.1107/S2056989024009964","","","0.71073","MoKα","","0.0557","0.0486","","","0.1085","0.1119","","","","","","1.113","","","","has coordinates","296782","2024-12-07","17:11:39",""
"2023296","5.2152","0.0002","7.8039","0.0003","10.1294","0.0004","93.3762","0.0012","104.111","0.0011","96.4297","0.0012","395.71","0.03","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","2-Amino-5-iodopyridinium bromide","","- C5 H6 Br I N2 -","- C5 H6 Br I N2 -","- C10 H12 Br2 I2 N4 -","2","1","ZN2039","Mukda, Benjamin A.; Dickie, Diane A.; Turnbull, Mark M.","Salts of 2-amino-5-iodopyridinium","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1230","1234","10.1107/S2056989024010259","","x-ray","0.71073","MoKα","","0.0129","0.0124","","","0.0287","0.0289","","","","","","1.106","","","","has coordinates","295710","2024-11-01","02:54:46",""
"2023297","9.6998","0.0007","13.5527","0.0008","13.8518","0.0011","90","","107.336","0.003","90","","1738.2","0.2","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","2-Amino-5-iodopyridinium (2-amino-5-iodopyridine-κ<i>N</i>^1^)bromido/chlorido(0.51/2.48)cobalt(II)","","- C10 H11 Br0.51 Cl2.48 Co I2 N4 -","- C10 H11 Br0.514 Cl2.486 Co I2 N4 -","- C40 H44 Br2.056 Cl9.944 Co4 I8 N16 -","4","1","ZN2039","Mukda, Benjamin A.; Dickie, Diane A.; Turnbull, Mark M.","Salts of 2-amino-5-iodopyridinium","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1230","1234","10.1107/S2056989024010259","","x-ray","0.71073","MoKα","","0.064","0.0402","","","0.082","0.0903","","","","","","1.085","","","","has coordinates,has disorder","295710","2024-11-01","02:54:47",""
"2023298","8.3073","0.0007","8.88","0.0006","9.3838","0.0007","90","","102.004","0.007","90","","677.09","0.09","100","0.1","100.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Iodoethylammonium iodide","","- C2 H7 I2 N -","- C2 H7 I2 N -","- C8 H28 I8 N4 -","4","1","WM5738","Petrosova, Hanna R.; Naumova, Dina D.; Golenya, Irina A.; Buta, Ildiko; Gural'skiy, Il'ya A.","Crystal structure and Hirshfeld surface analysis of the salt 2-iodoethylammonium iodide – a possible side product upon synthesis of hybrid perovskites","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1226","1229","10.1107/S205698902401034X","","","0.71073","MoKα","","0.0537","0.0505","","","0.1528","0.1589","","","","","","1.117","","","","has coordinates","295711","2024-11-01","02:55:12",""
"2023299","10.1898","0.0006","6.7445","0.0004","14.2538","0.0011","90","","110.901","0.002","90","","915.13","0.1","125","2","125","2","","","","","","","","5","P 1 21 1","P 2yb","4","","2-{4-[(2-Chlorophenyl)methyl]-3-methyl-6-oxopyridazin-1-yl}-<i>N</i>-phenylacetamide","","- C20 H18 Cl N3 O2 -","- C20 H18 Cl N3 O2 -","- C40 H36 Cl2 N6 O4 -","2","1","VM2308","Assila, Hamza; Zaoui, Younes; Kalonji Mubengayi, Camille; Guerrab, Walid; Alsubari, Abdulsalam; Mague, Joel T.; Ramli, Youssef; Ansar, Mhammed","Synthesis, crystal structure and Hirshfeld surface analysis of 2-{4-[(2-chlorophenyl)methyl]-3-methyl-6-oxopyridazin-1-yl}-N-phenylacetamide","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1221","1225","10.1107/S2056989024010296","","","0.71073","MoKα","","0.0552","0.0493","","","0.1082","0.1109","","","","","","1.087","","","","has coordinates,has disorder","295712","2024-11-01","02:55:30",""
"2023300","18.805","0.0007","12.2925","0.0006","10.8938","0.0005","90","","121.853","0.003","90","","2138.98","0.18","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[[diaquadiimidazolecobalt(II)]-μ~2~-2,3,5,6-tetrabromobenzene-1,4-dicarboxylato]","","- C14 H12 Br4 Co N4 O6 -","- C14 H12 Br4 Co N4 O6 -","- C56 H48 Br16 Co4 N16 O24 -","4","0.5","JP2013","Kumagai, Hitoshi; Kawata, Satoshi; Ogihara, Nobuhiro","Crystal structure of catena-poly[[diaquadiimidazolecobalt(II)]-μ2-2,3,5,6-tetrabromobenzene-1,4-dicarboxylato]","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1217","1220","10.1107/S2056989024009915","","","0.71075","MoKα","","0.0295","0.0275","","","0.0653","0.0665","","","","","","1.065","","","","has coordinates","295714","2024-11-01","02:55:48",""
"2023301","12.8146","0.0004","10.1523","0.0004","27.5618","0.001","90","","90","","90","","3585.7","0.2","200","0.1","200","0.1","","","","","","","","6","P b c n","-P 2n 2ab","60","","Bis{5-(4-chlorophenyl)-3-[6-(1<i>H</i>-pyrazol-1-yl)pyridin-2-yl]-1<i>H</i>-1,2,4-triazol-1-ido}nickel(II) methanol disolvate","","- C34 H28 Cl2 N12 Ni O2 -","- C34 H28 Cl2 N12 Ni O2 -","- C136 H112 Cl8 N48 Ni4 O8 -","4","0.5","TX2090","Znovjyak, Kateryna; Shova, Sergiu; Panov, Dmitriy M.; Kariaka, Nataliia S.; Fritsky, Igor O.; Malinkin, Sergey O.; Seredyuk, Maksym","Crystal structure of bis{5-(4-chlorophenyl)-3-[6-(1H-pyrazol-1-yl)pyridin-2-yl]-1H-1,2,4-triazol-1-ido}nickel(II) methanol disolvate","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1235","1239","10.1107/S2056989024010338","","x-ray","0.71073","MoKα","","0.0607","0.0417","","","0.0802","0.087","","","","","","1.053","","","","has coordinates","295715","2024-11-01","02:56:05",""
"2023302","11.0204","0.0004","16.1387","0.0006","16.2772","0.0006","90","","90","","90","","2894.98","0.18","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1,3,5-Tris[(1<i>H</i>-benzotriazol-1-yl)methyl]-2,4,6-triethylbenzene","","- C33 H33 N9 -","- C33 H33 N9 -","- C132 H132 N36 -","4","1","JP2011","Koch, Niklas; Förster, Sebastian; Mazik, Monika","Synthesis and crystal structure of 1,3,5-tris[(1H-benzotriazol-1-yl)methyl]-2,4,6-triethylbenzene","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1240","1243","10.1107/S2056989024009988","","","0.71073","MoKα","","0.042","0.0348","","","0.0774","0.0809","","","","","","1.047","","","","has coordinates","295716","2024-11-01","02:56:28",""
"2023303","11.9074","0.0003","14.3289","0.0003","8.7169","0.0002","90","","113.629","0.001","90","","1362.58","0.06","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Pentacadmium tetrakis[oxidotellurate(IV)] dinitrate","","- Cd4 O14 Te5 -","- Cd4 O14 Te5 -","- Cd16 O56 Te20 -","4","0.5","PK2712","Eder, Felix; Weil, Matthias","The cadmium oxidotellurates(IV) Cd5(TeO3)4(NO3)2 and Cd4Te5O14","Acta Crystallographica Section E Crystallographic Communications","2024","80","12","","","10.1107/S2056989024010387","","","0.71073","MoKα","","0.0264","0.0219","","","0.0392","0.0401","","","","","","1.208","","","","has coordinates","295791","2024-11-06","02:58:46",""
"2023304","9.9442","0.0004","5.6173","0.0002","16.6136","0.0007","90","","102.737","0.001","90","","905.19","0.06","300","2","300","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Tetracadmium pentaoxidotellurate(IV)","","- Cd5 N2 O18 Te4 -","- Cd5 N2 O18 Te4 -","- Cd10 N4 O36 Te8 -","2","0.5","PK2712","Eder, Felix; Weil, Matthias","The cadmium oxidotellurates(IV) Cd5(TeO3)4(NO3)2 and Cd4Te5O14","Acta Crystallographica Section E Crystallographic Communications","2024","80","12","","","10.1107/S2056989024010387","","","0.71073","MoKα","","0.0497","0.0304","","","0.0552","0.0605","","","","","","0.986","","","","has coordinates","295791","2024-11-06","02:58:47",""
"2023305","11.661","0.002","23.251","0.002","19.602","0.003","90","","122.53","0.01","90","","4480.9","1.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Pentakis(2-aminopyridinium) nonavanado(V)tellurate(VI)","","- C25 H35 N10 O28 Te V9 -","- C25 H35 N10 O28 Te V9 -","- C100 H140 N40 O112 Te4 V36 -","4","1","HB8109","Mrad, Houda; Maalaoui, Ahlem; Rzaigui, Mohamed; Akriche, Samah","Synthesis and structure of pentakis(2-aminopyridinium) nonavanado(V)tellurate(VI)","Acta Crystallographica Section E Crystallographic Communications","2024","80","12","","","10.1107/S2056989024010533","","x-ray","0.56087","AgKα","","0.1818","0.076","","","0.1718","0.2112","","","","","","1.033","","","","has coordinates,has disorder","295792","2024-11-06","02:59:12",""
"2023306","8.55214","0.00016","26.0026","0.0004","10.3057","0.0002","90","","102.829","0.0019","90","","2234.55","0.07","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Bis(benzoylacetonato)(ethanol)dioxidouranium(VI)","","- C22 H24 O7 U -","- C22 H24 O7 U -","- C88 H96 O28 U4 -","4","1","EJ2006","Jabborova, Xolida; Tursinboyeva, Xusnida; Ruzieva, Bakhtigul; Turgunov, Kambarali; Ashurov, Jamshid; Tojiboev, Akmaljon; Daminova, Shahlo","Crystal structure and Hirshfeld surface analysis of bis(benzoylacetonato)(ethanol)dioxidouranium(VI)","Acta Crystallographica Section E Crystallographic Communications","2024","80","12","","","10.1107/S2056989024010417","","x-ray","1.54184","CuKα","","0.0542","0.0409","","","0.1032","0.1146","","","","","","1.052","","","","has coordinates","295793","2024-11-06","02:59:31",""
"2023310","10.229","0.0009","13.0681","0.001","16.9601","0.0015","90","","98.377","0.003","90","","2242.9","0.3","140","2","140","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Bis[μ-3,3,3',3'-tetraethyl-1,1'-(furan-2,5-dicarbonyl)bis(thioureato)]dicopper(II) dichloromethane disolvate","","- C34 H48 Cl4 Cu2 N8 O6 S4 -","- C34 H48 Cl4 Cu2 N8 O6 S4 -","- C68 H96 Cl8 Cu4 N16 O12 S8 -","2","0.5","OO2007","Le, Canh Dinh; Nguyen, Hoang Phuc; Pham, Chien Thang","Crystal structure of a solvated dinuclear CuII complex derived from 3,3,3′,3′-tetraethyl-1,1′-(furan-2,5-dicarbonyl)bis(thiourea)","Acta Crystallographica Section E Crystallographic Communications","2024","80","12","","","10.1107/S2056989024010703","","","0.71073","MoKα","","0.0713","0.0376","","","0.0675","0.076","","","","","","1.03","","","","has coordinates,has disorder","295851","2024-11-09","02:46:01",""
"2023311","9.5487","0.0002","17.8992","0.0003","18.0001","0.0003","90","","94.103","0.002","90","","3068.59","0.1","120.15","","120.15","","","","","","","","","5","P 1 21 1","P 2yb","4","","{2,2'-[(1<i>S</i>,2<i>S</i>)-1,2-Diphenylethane-1,2-diylbis(nitrilophenylmethanylylidene)]diphenolato}nickel(II)","","- C40 H30 N2 Ni O2 -","- C40 H30 N2 Ni O2 -","- C160 H120 N8 Ni4 O8 -","4","2","OX2008","Ito, Masataka; Chikaraishi Kasuga, Noriko; Matsuse, Ryo; Hirotsu, Masakazu","Crystal structures and circular dichroism of {2,2′-[(1S,2S)-1,2-diphenylethane-1,2-diylbis(nitrilophenylmethanylylidene)]diphenolato}nickel(II) and its ethanol solvate","Acta Crystallographica Section E Crystallographic Communications","2024","80","12","","","10.1107/S2056989024010508","","x-ray","0.71073","MoKα","","0.0353","0.0326","","","0.0823","0.0835","","","","","","1.062","","","","has coordinates","295852","2024-11-09","02:46:24",""
"2023312","10.583","0.0002","12.411","0.0002","13.9837","0.0002","94.352","0.001","100.599","0.001","90.584","0.001","1799.61","0.05","120.15","","120.15","","","","","","","","","5","P 1","P 1","1","","{2,2'-[(1<i>S</i>,2<i>S</i>)-1,2-Diphenylethane-1,2-diylbis(nitrilophenylmethanylylidene)]diphenolato}nickel(II) ethanol disolvate","","- C44 H42 N2 Ni O4 -","- C44 H42 N2 Ni O4 -","- C88 H84 N4 Ni2 O8 -","2","2","OX2008","Ito, Masataka; Chikaraishi Kasuga, Noriko; Matsuse, Ryo; Hirotsu, Masakazu","Crystal structures and circular dichroism of {2,2′-[(1S,2S)-1,2-diphenylethane-1,2-diylbis(nitrilophenylmethanylylidene)]diphenolato}nickel(II) and its ethanol solvate","Acta Crystallographica Section E Crystallographic Communications","2024","80","12","","","10.1107/S2056989024010508","","x-ray","0.71073","MoKα","","0.0375","0.0349","","","0.0817","0.0834","","","","","","1.027","","","","has coordinates,has disorder","295852","2024-11-09","02:46:25",""
"2023313","4.1538","0.0009","8.9978","0.0016","25.487","0.005","90","","92.468","0.007","90","","951.7","0.3","567","2","567","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Ethyl 5-amino-2-bromoisonicotinate","Ethyl 5-amino-2-bromopyridine-4-carboxylate","","- C8 H9 Br N2 O2 -","- C8 H9 Br N2 O2 -","- C32 H36 Br4 N8 O8 -","4","1","OI2013","Mahadevaiah, Harish Kumar; Shivanna, Harishkumar; Hanumaiah, Anil Kumar; Hirehalli Chikkegowda, Devarajegowda; Bandrehalli Siddagangaiah, Palakshamurthy","Crystal structure, Hirshfeld surface analysis, DFT and molecular docking studies of ethyl 5-amino-2-bromoisonicotinate","Acta Crystallographica Section E Crystallographic Communications","2024","80","12","","","10.1107/S2056989024010594","","","0.71073","MoKα","","0.0433","0.0316","","","0.0649","0.0689","","","","","","1.036","","","","has coordinates","295853","2024-11-09","02:46:41",""
"2023314","18.4793","0.0006","10.4036","0.0003","18.5669","0.0007","90","","93.035","0.001","90","","3564.5","0.2","100","0.2","100","0.2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-(4-<i>tert</i>-Butyl-2-ethoxyphenyl)-2-(2,6-difluorophenyl)oxazole","","- C21 H21 F2 N O2 -","- C21 H21 F2 N O2 -","- C168 H168 F16 N8 O16 -","8","1","NX2015","Mohan Kumar, Thaluru M.; Bhaskar, Besagarahally L.; Priyanka, Prabhakar; Divakara, Thayamma R.; Yathirajan, Hemmige S.; Parkin, Sean","Crystal structure and Hirshfeld-surface analysis of an etoxazole metabolite designated R13","Acta Crystallographica Section E Crystallographic Communications","2024","80","12","","","10.1107/S2056989024010600","","","0.71073","MoKα","","0.0388","0.0325","","","0.0798","0.0849","","","","","","1.069","","","","has coordinates","295854","2024-11-09","02:46:58",""
"2023315","6.2653","0.0006","13.5033","0.0012","14.0112","0.0013","90","","90","","90","","1185.38","0.19","293","","293","","","","","","","","","2","P b c m","-P 2c 2b","57","Aluminium phosphorus chloride","Phosphorus tetrachloride tetrachloridoaluminate","","- Al Cl8 -","- Al Cl8 P -","- Al4 Cl32 P4 -","4","0.5","OI2012","Seo, Hyeonjin; Shin, Seungyong; Hong, Seung-Tae","Crystal structure of AlPCl8","Acta Crystallographica Section E Crystallographic Communications","2024","80","12","","","10.1107/S2056989024010661","","","0.71073","MoKα","","0.093","0.093","","0.0558","0.0558","0.0558","","","","","","1.1645","","","","has coordinates","295855","2024-11-09","02:47:25",""
"2023316","12.7442","0.0006","10.6851","0.0006","14.4027","0.0006","90","","96.645","0.007","90","","1948.08","0.17","296","2","296","2","","","","","","","synthesis as described","7","P 1 21/c 1","-P 2ybc","14","","<i>fac</i>-Bromidotricarbonyl[4-(4-methoxyphenyl)-2-(pyridin-2-yl)thiazole-κ^2^<i>N</i>,<i>N</i>']rhenium(I)","","- C18 H12 Br N2 O4 Re S -","- C18 H12 Br N2 O4 Re S -","- C72 H48 Br4 N8 O16 Re4 S4 -","4","1","JP2014","Matsuda, Yuki; Nakamura, Ryota; Ozawa, Yoshiki; Abe, Masaaki","Crystal structures of two polymorphs for fac-bromidotricarbonyl[4-(4-methoxyphenyl)-2-(pyridin-2-yl)thiazole-κ2 N,N′]rhenium(I)","Acta Crystallographica Section E Crystallographic Communications","2024","80","12","","","10.1107/S2056989024010727","","x-ray","0.71073","MoKα","","0.0455","0.0341","","","0.0747","0.0786","","","","","","1.132","","","","has coordinates","295856","2024-11-09","02:47:53",""
"2023317","13.2169","0.0003","11.2764","0.0002","25.8716","0.0005","90","","90","","90","","3855.88","0.13","296","2","296","2","","","","","","","synthesis as described","7","P n a 21","P 2c -2n","33","","<i>fac</i>-Bromidotricarbonyl[4-(4-methoxyphenyl)-2-(pyridin-2-yl)thiazole-κ^2^<i>N</i>,<i>N</i>']rhenium(I)","","- C18 H12 Br N2 O4 Re S -","- C18 H12 Br N2 O4 Re S -","- C144 H96 Br8 N16 O32 Re8 S8 -","8","2","JP2014","Matsuda, Yuki; Nakamura, Ryota; Ozawa, Yoshiki; Abe, Masaaki","Crystal structures of two polymorphs for fac-bromidotricarbonyl[4-(4-methoxyphenyl)-2-(pyridin-2-yl)thiazole-κ2 N,N′]rhenium(I)","Acta Crystallographica Section E Crystallographic Communications","2024","80","12","","","10.1107/S2056989024010727","","x-ray","0.71073","MoKα","","0.0467","0.0326","","","0.0615","0.0654","","","","","","1.016","","","","has coordinates","295856","2024-11-09","02:47:55",""
"2023318","8.247","0.003","12.0714","0.0016","25.771","0.004","90","","98.572","0.016","90","","2536.9","1.1","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,10-Phenanthrolinium violurate violuric acid pentahydrate","1,10-Phenanthrolinium 6-hydroxy-5-(oxidoimino)-1,3-diazinane-2,4-dione–\ 6-hydroxy-5-(hydroxyimino)-1,3-diazinane-2,4-dione–water (1/1/5)","","- C20 H24 N8 O13 -","- C20 H20 N8 O13 -","- C80 H80 N32 O52 -","4","1","WM5737","Seidel, Rüdiger W.; Kolev, Tsonko M.","Crystal structure of 1,10-phenanthrolinium violurate violuric acid pentahydrate","Acta Crystallographica Section E Crystallographic Communications","2024","80","12","","","10.1107/S205698902401065X","","","0.71073","MoKα","","0.146","0.0666","","","0.1478","0.1873","","","","","","1.011","","","","has coordinates","295930","2024-11-15","02:48:49",""
"2023319","5.0082","0.0009","20.728","0.004","11.1549","0.0014","90","","96.998","0.015","90","","1149.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","<i>N</i>-(4-Methoxyphenyl)picolinamide","<i>N</i>-(4-Methoxyphenyl)pyridine-2-carboxamide","","- C13 H12 N2 O2 -","- C13 H12 N2 O2 -","- C52 H48 N8 O8 -","4","1","DX2062","Burieva, Dilnoza; Torambetov, Batirbay; Bobonazarova, Sarvinoz; Abdushukurov, Anvar; Kholikov, Tursinali; Khan, Akram A.; Ashurov, Jamshid; Yusufov, Mukhriddin","Synthesis, crystal structure and Hirshfeld surface analysis of N-(4-methoxyphenyl)picolinamide","Acta Crystallographica Section E Crystallographic Communications","2024","80","12","","","10.1107/S2056989024010843","","x-ray","1.54184","CuKα","","0.1546","0.0609","","","0.105","0.1391","","","","","","1.001","","","","has coordinates","295931","2024-11-15","02:49:22",""
"2023320","13.2412","0.0006","14.3856","0.0006","21.3601","0.0011","108.186","0.003","99.785","0.003","91.272","0.003","3796.9","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","5,5'-(Triaz-1-ene-1,3-diyl)bis(3-nitro-1<i>H</i>-1,2,4-triazole)–triethylammonium nitrate (1/1)","","- C10 H19 N13 O7 -","- C9.9985 H18.996 N12.9997 O7 -","- C79.988 H151.968 N103.998 O56 -","8","4","EJ2009","Gettings, Matthew; Zeller, Matthias; Piercey, Davin","Crystal structure of the 1:1 cocrystal 5,5′-(triaz-1-ene-1,3-diyl)bis(3-nitro-1H-1,2,4-triazole)–triethylammonium nitrate","Acta Crystallographica Section E Crystallographic Communications","2024","80","12","","","10.1107/S205698902401096X","","","0.71073","MoKα","","0.1228","0.0698","","","0.1879","0.2224","","","","","","1.06","","","","has coordinates,has disorder","296083","2024-11-23","03:04:07",""
"2023321","7.7456","0.00014","24.4234","0.0004","13.059","0.0002","90","","101.611","0.0009","90","","2419.87","0.07","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2,7-Diethoxynaphthalene-1,8-diyl)bis[(4-bromophenyl)methanone]","","- C28 H22 Br2 O4 -","- C28 H22 Br2 O4 -","- C112 H88 Br8 O16 -","4","1","JP2015","Li, Kun; Yao, Jiali; Iitsuka, Hiroaki; Yonezawa, Noriyuki; Okamoto, Akiko","Crystal structure and Hirshfeld surface analysis of (2,7-diethoxynaphthalene-1,8-diyl)bis[(4-bromophenyl)methanone]","Acta Crystallographica Section E Crystallographic Communications","2024","80","12","","","10.1107/S205698902401123X","","","1.54187","CuKα","","0.0429","0.0406","","","0.1107","0.113","","","","","","1.02","","","","has coordinates","296084","2024-11-23","03:04:24",""
"2023322","21.8447","0.0013","13.014","0.0008","12.1123","0.0007","90","","92.62","0.001","90","","3439.8","0.4","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,2-Bis[2-(2,3,4,5-tetrafluorophenyl)ethynyl]benzene","","- C22 H6 F8 -","- C22 H6 F8 -","- C176 H48 F64 -","8","2","JY2054","Bosch, Eric; Bowling, Nathan P.","Intra- and intermolecular C—H...F hydrogen bonds in the crystal structure of 1,2-bis[2-(2,3,4,5-tetrafluorophenyl)ethynyl]benzene","Acta Crystallographica Section E Crystallographic Communications","2024","80","12","","","10.1107/S2056989024010995","","","0.71073","MoKα","","0.0723","0.0395","","","0.093","0.1114","","","","","","1.007","","","","has coordinates","296085","2024-11-23","03:04:46",""
"2023323","10.5425","0.0013","3.8532","0.0005","42.419","0.004","90","","90","","90","","1723.2","0.3","120","2","120","2","","","","","","","","6","P n a 21","P 2c -2n","33","","2-{4-[(<i>E</i>)-(4-Acetylphenyl)diazenyl]phenyl}-1-(5-bromothiophen-2-yl)ethanone","","- C19 H13 Br N2 O3 S -","- C19 H13 Br N2 O3 S -","- C76 H52 Br4 N8 O12 S4 -","4","1","EE2010","Santhosh Kumar, S.; Srinivasa, H.T; Harish Kumar, M.; Devarajegowda, H. C.; Palakshamurthy, B. S.","Crystal structure, Hirshfeld surface, DFT and molecular docking studies of 2-{4-[(E)-(4-acetylphenyl)diazenyl]phenyl}-1-(5-bromothiophen-2-yl)ethanone; a compound with bromine...oxygen-type contacts","Acta Crystallographica Section E Crystallographic Communications","2024","80","12","","","10.1107/S2056989024010776","","","0.71074","MoKα","","0.0379","0.0373","","","0.0912","0.0914","","","","","","1.234","","","","has coordinates","296086","2024-11-23","03:05:00",""
"2023324","20.128","0.004","19.816","0.004","13.429","0.003","90","","90","","90","","5356.2","1.9","243.15","","243.15","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","<i>p</i>-Xylene@silicalite-1","<i>p</i>-Xylene@silicalite-1","","- C16 H20 O48 Si24 -","- C16 H20 O48 Si24 -","- C64 H80 O192 Si96 -","4","1","TX2091","Hwang, In-Chul","Crystal structure of p-xylene@silicalite-1","Acta Crystallographica Section E Crystallographic Communications","2025","81","1","","","10.1107/S2056989024011642","","","0.7","synchrotron","","0.0305","0.0277","","","0.0775","0.0789","","","","","","1.041","","","","has coordinates","296212","2024-12-04","02:49:49",""
"2023325","9.0322","0.0002","13.974","0.0003","16.0004","0.0004","90","","90","","90","","2019.51","0.08","298","","298","","","","","","","","","5","P n m a","-P 2ac 2n","62","","Bis(acetylacetonato-κ^2^<i>O</i>,<i>O</i>')(2-amino-1-methyl-1<i>H</i>-\ benzimidazole-κ<i>N</i>^3^)copper(II)","","- C18 H23 Cu N3 O4 -","- C18 H23 Cu N3 O4 -","- C72 H92 Cu4 N12 O16 -","4","0.5","TX2089","Siddikova, Kyzlarkhan; Ziyatov, Daminbek; Tojiboev, Akmaljon; Ashurov, Jamshid; Kadirova, Zukhra; Daminova, Shahlo","Synthesis, crystal structure and Hirshfeld surface analysis of bis(acetylacetonato-κ2 O,O′)(2-amino-1-methyl-1H-benzimidazole-κN 3)copper(II)","Acta Crystallographica Section E Crystallographic Communications","2025","81","1","","","10.1107/S2056989024011538","","","1.54184","CuKα","","0.044","0.0362","","","0.1029","0.1093","","","","","","1.0436","","","","has coordinates","296213","2024-12-04","02:50:07",""
"2023326","9.6337","0.0001","9.8825","0.0002","12.8446","0.0003","87.546","0.002","86.605","0.001","70.914","0.003","1153.26","0.04","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","(2<i>E</i>)-3-[4-(Diphenylamino)phenyl]-1-[4-(prop-1-yn-2-yloxy)phenyl]prop-2-en-1-one","","- C30 H23 N O2 -","- C30 H23 N O2 -","- C60 H46 N2 O4 -","2","1","WM5735","Madhan, Sundarasamy; Nizam Mohideen, Mohamed Hanifa; Viswanathan, Vijayan; Velmurugan, Devadasan","Crystal structure and Hirshfeld surface analysis of the chalcone derivative (2E)-3-[4-(diphenylamino)phenyl]-1-[4-(prop-1-yn-2-yloxy)phenyl]prop-2-en-1-one","Acta Crystallographica Section E Crystallographic Communications","2025","81","1","","","10.1107/S2056989024011721","","","0.71073","MoKα","","0.0573","0.0416","","","0.1079","0.1202","","","","","","1.033","","","","has coordinates,has disorder","296251","2024-12-06","02:47:40",""
"2023327","7.0271","0.0001","19.2243","0.0001","17.7558","0.0001","90","","97.332","0.001","90","","2379.04","0.04","100","0.4","100","0.4","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3,3,4,4,5,5-Heptafluoro-2-(3-[(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)oxy]-2-{[(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)oxy]methyl}-2-methylpropoxy)cyclopentene","","- C20 H9 F21 O3 -","- C20 H9 F21 O3 -","- C80 H36 F84 O12 -","4","1","HB8112","Peloquin, Andrew J.; Balaich, Gary J.; Jennings, Abby R.","Crystal structure and Hirshfeld surface analysis of 1,3,3,4,4,5,5-heptafluoro-2-(3-[(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)oxy]-2-{[(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)oxy]methyl}-2-methylpropoxy)cyclopentene","Acta Crystallographica Section E Crystallographic Communications","2025","81","1","","","10.1107/S2056989024011484","","x-ray","1.54184","CuKα","","0.0402","0.0373","","","0.0868","0.0879","","","","","","1.0712","","","","has coordinates","296252","2024-12-06","02:48:00",""
"2023328","9.5718","0.0006","14.4498","0.0008","20.0041","0.0012","90","","92.874","0.002","90","","2763.3","0.3","303","2","303","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","<i>N</i>-{[3-Bromo-1-(phenylsulfonyl)-1<i>H</i>-indol-2-yl]methyl}-<i>N</i>-(4-bromo-3-methoxyphenyl)benzenesulfonamide","","- C28 H22 Br2 N2 O5 S2 -","- C28 H22 Br2 N2 O5 S2 -","- C112 H88 Br8 N8 O20 S8 -","4","1","NU2007","Madhan, S.; NizamMohideen, M.; Pavunkumar, Vinayagam; MohanaKrishnan, Arasambattu K.","The crystal structures determination and Hirshfeld surface analysis of N-(4-bromo-3-methoxyphenyl)- and N-{[3-bromo-1-(phenylsulfonyl)-1H-indol-2-yl]methyl}- derivatives of N-{[3-bromo-1-(phenylsulfonyl)-1H-indol-2-yl]methyl}benzenesulfonamide","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1110","1117","10.1107/S2056989024009587","","","0.71073","MoKα","","0.0568","0.0403","","","0.0888","0.0992","","","","","","1.053","","","","has coordinates","296745","2024-12-07","16:43:17",""
"2023329","8.2664","0.0004","34.7886","0.0018","12.5972","0.0006","90","","104.55","0.002","90","","3506.5","0.3","303","2","303","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","<i>N</i>,<i>N</i>-Bis{[3-bromo-1-(phenylsulfonyl)-1<i>H</i>-indol-2-yl]methyl}benzenesulfonamide","","- C36 H27 Br2 N3 O6 S3 -","- C36 H27 Br2 N3 O6 S3 -","- C144 H108 Br8 N12 O24 S12 -","4","1","NU2007","Madhan, S.; NizamMohideen, M.; Pavunkumar, Vinayagam; MohanaKrishnan, Arasambattu K.","The crystal structures determination and Hirshfeld surface analysis of N-(4-bromo-3-methoxyphenyl)- and N-{[3-bromo-1-(phenylsulfonyl)-1H-indol-2-yl]methyl}- derivatives of N-{[3-bromo-1-(phenylsulfonyl)-1H-indol-2-yl]methyl}benzenesulfonamide","Acta Crystallographica Section E Crystallographic Communications","2024","80","11","1110","1117","10.1107/S2056989024009587","","","0.71073","MoKα","","0.0621","0.0478","","","0.1133","0.1199","","","","","","1.118","","","","has coordinates","296745","2024-12-07","16:43:18",""
"2023330","8.4947","0.0004","8.3064","0.0005","21.6425","0.0014","90","","96.15","0.005","90","","1518.31","0.15","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[bis(<i>N</i>,<i>O</i>-dimethylhydroxylammonium) [di-μ-bromido-dibromidostannate(II)]]","","- C4 H16 Br4 N2 O2 Sn -","- C4 H16 Br4 N2 O2 Sn -","- C16 H64 Br16 N8 O8 Sn4 -","4","0.5","WM5741","Sirenko, Valerii Y.; Apostu, Mircea-Odin; Golenya, Irina A.; Naumova, Dina D.; Partsevska, Sofiia V.","Crystal structure of catena-poly[bis(N,O-dimethylhydroxylammonium) [di-μ-bromido-dibromidostannate(II)]]","Acta Crystallographica Section E Crystallographic Communications","2025","81","1","","","10.1107/S2056989024012027","","x-ray","0.71073","MoKα","","0.0745","0.0457","","","0.0788","0.0905","","","","","","1.058","","","","has coordinates","296869","2024-12-14","02:52:55",""
"2023331","9.1493","0.0002","12.3058","0.0003","20.1432","0.0005","76.076","0.002","84.791","0.002","71.829","0.002","2091.19","0.09","100","","100","","","","","","","","","4","P -1","-P 1","2","","4-{[(4-{[1-({[(3,4-Dimethoxyphenyl)methyl](3-acetamidophenyl)carbamoyl}methyl)-1<i>H</i>-1,2,3-triazol-4-yl]methoxy}-3-methoxyphenyl)methyl]amino}benzoic acid–acetonitrile–water (1/2/2)","","- C41 H48 N8 O10 -","- C41 H48 N8 O10 -","- C82 H96 N16 O20 -","2","1","EV2012","Filley, Jonathan","Binary solvent participation in crystals of a multi-aromatic 1,2,3-triazole","Acta Crystallographica Section E Crystallographic Communications","2025","81","1","","","10.1107/S2056989024011915","","","1.54184","CuKα","","0.0521","0.0452","","","0.1217","0.1301","","","","","","1.038","","","","has coordinates","296870","2024-12-14","02:53:37",""
"2023332","7.9334","0.0002","15.4735","0.0006","15.4898","0.0006","90","","90","","90","","1901.49","0.11","170.15","","170.15","","","","","","","","","5","C m c e","-C 2ac 2","64","","Poly[di-μ-bromido-(μ-2,5-dimethylpyrazine)cadmium(II)]","","- C6 H8 Br2 Cd N2 -","- C6 H8 Br2 Cd N2 -","- C48 H64 Br16 Cd8 N16 -","8","0.5","HB8115","Näther, Christian","Synthesis, crystal structure and thermal properties of poly[di-μ-bromido-(μ-2,5-dimethylpyrazine)cadmium(II)]","Acta Crystallographica Section E Crystallographic Communications","2025","81","1","","","10.1107/S2056989024011824","","","0.71073","MoKα","","0.0394","0.0326","","","0.0835","0.0875","","","","","","1.132","","","","has coordinates","296871","2024-12-14","02:54:24",""
"2023333","9.3994","0.0002","10.8016","0.0003","15.2355","0.0004","104.272","0.002","99.186","0.002","101.529","0.002","1432.86","0.07","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","Dichlorido{1,1'-[(3-fluorophenyl)methylene]bis[3-(3-fluorophenyl)imidazo[1,5-<i>a</i>]pyridine]-κ^2^<i>N</i>,<i>N</i>'}copper(II)","","- C33 H21 Cl2 Cu F3 N4 -","- C33 H21 Cl2 Cu F3 N4 -","- C66 H42 Cl4 Cu2 F6 N8 -","2","1","WM5742","Le Thi Hong, Hai; Nguyen Van, Hau; Hoang Tuan, Duong; Tran Quang, Hung; Dang Thanh, Tuan; Van Meervelt, Luc","Syntheses, structures and anticancer activities of CuII and ZnII complexes containing 1,1′-[(3-fluorophenyl)methylene]bis[3-(3-fluorophenyl)imidazo[1,5-a]pyridine]","Acta Crystallographica Section E Crystallographic Communications","2025","81","1","","","10.1107/S2056989024011617","","x-ray","0.71073","MoKα","","0.0451","0.0352","","","0.0827","0.0889","","","","","","1.07","","","","has coordinates","296872","2024-12-14","02:55:39",""
"2023334","8.1431","0.0002","8.8362","0.0002","25.1787","0.0007","90","","97.264","0.002","90","","1797.17","0.08","100.02","0.1","100.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[bis(2-iodoethylammonium) [di-μ-iodido-diiodidogermanate(II)]]","","- C4 H14 Ge I6 N2 -","- C4 H14 Ge I6 N2 -","- C16 H56 Ge4 I24 N8 -","4","1","OO2009","Kucheriv, Olesia I.; Apostu, Mircea-Odin; Prysiazhna, Olena; Potaskalov, Vadim A.; Malinkin, Sergey O.","Crystal structure and Hirshfeld surface analysis of the layered hybrid metal halide poly[bis(2-iodoethylammonium) [di-μ-iodido-diiodidogermanate(II)]]","Acta Crystallographica Section E Crystallographic Communications","2025","81","1","","","10.1107/S2056989024011800","","","0.71073","MoKα","","0.0421","0.0352","","","0.0861","0.0917","","","","","","1.189","","","","has coordinates","296873","2024-12-14","02:55:55",""
"2023335","5.195","0.0002","10.0347","0.0003","18.909","0.0006","90","","91.892","0.003","90","","985.19","0.06","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetraaquabis{2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetato-κ<i>O</i>}cobalt(II)","","- C10 H18 Co N4 O8 S4 -","- C10 H18 Co N4 O8 S4 -","- C20 H36 Co2 N8 O16 S8 -","2","0.5","WM5739","Kinshakova, Ekaterina; Torambetov, Batirbay; Kaur, Simranjeet; Ashurov, Jamshid; Kadirova, Shakhnoza","Synthesis, crystal structure, Hirshfeld surface analysis and DFT calculations of the coordination compound tetraaquabis{2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetato-κO}cobalt(II)","Acta Crystallographica Section E Crystallographic Communications","2025","81","1","","","10.1107/S2056989024011939","","x-ray","1.54184","CuKα","","0.045","0.0376","","","0.0911","0.0984","","","","","","1.064","","","","has coordinates","296911","2024-12-18","03:07:16",""
"2023336","20.1106","0.0012","9.2112","0.0004","19.2309","0.0012","90","","116.353","0.006","90","","3192.2","0.4","220","2","220.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[[bis(4-methylpyridine-κ<i>N</i>)cobalt(II)]-di-μ-thiocyanato-κ^2^<i>N</i>:<i>S</i>;κ^2^<i>S</i>:<i>N</i>]","","- C14 H14 Co N4 S2 -","- C14 H14 Co N4 S2 -","- C112 H112 Co8 N32 S16 -","8","1","OX2010","Näther, Christian; Boeckmann, Jan","Synthesis, crystal structure and properties of catena-poly[[bis(4-methylpyridine-κN)cobalt(II)]-di-μ-thiocyanato-κ2 N:S;κ2 S:N], which shows a rare coordination geometry","Acta Crystallographica Section E Crystallographic Communications","2025","81","1","","","10.1107/S2056989024012003","","","0.71073","MoKα","","0.0427","0.0346","","","0.0902","0.0948","","","","","","1.041","","","","has coordinates","296912","2024-12-18","03:08:28",""
"2023337","29.0324","0.0008","9.1477","0.0002","15.0296","0.0004","90","","108.533","0.001","90","","3784.56","0.17","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C15 H20 Br F4 I2 N -","- C15 H20 Br F4 I2 N -","- C120 H160 Br8 F32 I16 N8 -","8","1","YZ2062","Gurbanov, Atash V.; Hökelek, Tuncer; Mammadova, Gunay Z.; Hasanov, Khudayar I.; Javadzade, Tahir A.; Belay, Alebel N.","Crystal structure and Hirshfeld surface analysis of supramolecular aggregate of 2,2,6,6-tetramethylpiperidin-1-ium bromide with 1,2,3,4-tetrafluoro-5,6-diiodobenzene","Acta Crystallographica Section E Crystallographic Communications","2025","81","1","","","10.1107/S2056989024011502","","","0.71073","MoKα","","0.0312","0.0262","","","0.067","0.0692","","","","","","1.1","","","","has coordinates","296913","2024-12-18","03:09:05",""
"2023338","16.2304","0.0009","6.5804","0.0003","13.2222","0.0007","90","","107.156","0.006","90","","1349.33","0.13","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(4-Nitrophenyl)-2-(piperidin-1-yl)acetamide","","- C13 H17 N3 O3 -","- C13 H17 N3 O3 -","- C52 H68 N12 O12 -","4","1","VM2309","Maimoune, Imane; Kariuki, Benson M.; El Moutaouakil Ala Allah, Abderrazzak; Nchioua, Intissar; Alsubari, Abdulsalam; Mague, Joel T.; Zarrouk, Abdelkader; Ramli, Youssef","Crystal structure and Hirshfeld surface analysis of N-(4-nitrophenyl)-2-(piperidin-1-yl)acetamide (lidocaine analogue)","Acta Crystallographica Section E Crystallographic Communications","2025","81","1","","","10.1107/S205698902401185X","","","0.71073","MoKα","","0.0833","0.0585","","","0.1625","0.1799","","","","","","1.058","","","","has coordinates","296958","2024-12-24","02:55:20",""
"2023340","9.8527","0.0001","28.716","0.0003","10.7754","0.0001","90","","109.085","0.002","90","","2881.11","0.06","100","1","100","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","<i>anti</i>-4-(1^9^<i>H</i>,5^9^<i>H</i>-3-Aza-1,5(3,9)-dicarbazolacyclooctaphane-3-yl)benzonitrile (host molecule) dichloromethane monosolvate","10-(4-Cyanophenyl)-10,11,22,23-tetrahydro-9<i>H</i>,21<i>H</i>-5,8:15,12-bis(metheno)[1,5,11]triazacyclohexadecino[1,16-<i>a</i>:5,6-<i>a</i>']diindole dichloromethane monosolvate","","- C37 H30 Cl2 N4 -","- C37 H30 Cl2 N4 -","- C148 H120 Cl8 N16 -","4","1","OX2009","Kubono, Koji; Tani, Keita; Kashiwagi, Yukiyasu","Synthesis and crystal structure of anti-10-(4-cyanophenyl)-10,11,22,23-tetrahydro-9H,21H-5,8:15,12-bis(metheno)[1,5,11]triazacyclohexadecino[1,16-a:5,6-a′]diindole dichloromethane monosolvate","Acta Crystallographica Section E Crystallographic Communications","2025","81","1","20","23","10.1107/S2056989024011782","","x-ray","1.54184","CuKα","","0.0374","0.0344","","","0.0884","0.0904","","","","","","1.053","","","","has coordinates","297028","2025-01-01","03:34:55",""
"2023341","9.0136","0.0001","8.1561","0.0001","10.8718","0.0001","90","","95.778","0.001","90","","795.189","0.015","294","2","294","2","","","","","","","","5","P 1 21 1","P 2yb","4","Luliconazole","(<i>E</i>)-[(4<i>R</i>)-4-(2,4-Dichlorophenyl)-1,3-dithiolan-2-ylidene](1<i>H</i>-imidazol-1-yl)acetonitrile","","- C14 H9 Cl2 N3 S2 -","- C14 H9 Cl2 N3 S2 -","- C28 H18 Cl4 N6 S4 -","2","1","VM2310","Ben, Anna; Chęcińska, Lilianna","Crystal structure of luliconazole","Acta Crystallographica Section E Crystallographic Communications","2025","81","1","24","28","10.1107/S2056989024011812","","x-ray","1.54184","CuKα","","0.0256","0.0249","","","0.0688","0.0693","","","","","","1.065","","","","has coordinates,has disorder","297029","2025-01-01","03:35:39",""
"2023342","7.9935","0.0006","8.3181","0.0006","12.1998","0.0009","108.308","0.007","102.767","0.007","99.145","0.006","727.87","0.11","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","<i>catena</i>-Poly[[(1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>^1^,<i>N</i>^4^,<i>N</i>^8^,<i>N</i>^11^)nickel(II)]-μ~2~-sulfato-κ^2^<i>O</i>^3^:<i>O</i>^4^]","","- C10 H24 N4 Ni O4 S -","- C10 H24 N4 Ni O4 S -","- C20 H48 N8 Ni2 O8 S2 -","2","1","HB8118","Tsymbal, Liudmyla V.; Andriichuk, Irina L.; Bahrin, Lucian G.; Lampeka, Yaroslaw D.","Syntheses and structures of two coordination polymers formed by Ni(cyclam)2+ cations and sulfate anions","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989024012337","","x-ray","0.71073","MoKα","","0.053","0.0379","","","0.0716","0.0795","","","","","","1.019","","","","has coordinates","297060","2025-01-04","02:37:28",""
"2023343","12.1299","0.0005","18.5163","0.0011","35.621","0.002","90","","94.777","0.004","90","","7972.7","0.7","293","2","293","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","<i>catena</i>-Poly[[[(1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>^1^,<i>N</i>^4^,<i>N</i>^8^,<i>N</i>^11^)nickel(II)]-μ~2~-sulfato-κ^2^<i>O</i>^3^:<i>O</i>^4^] hemi[4,4',4'',4'''-(2,2',4,4',6,6'-hexamethyl-[1,1'-biphenyl]-3,3',5,5'-tetrayl)tetrabenzoic acid] nonahydrate]","","- C66 H86 N8 Ni2 O16 S2 -","- C66 H86 N8 Ni2 O16 S2 -","- C264 H344 N32 Ni8 O64 S8 -","4","0.5","HB8118","Tsymbal, Liudmyla V.; Andriichuk, Irina L.; Bahrin, Lucian G.; Lampeka, Yaroslaw D.","Syntheses and structures of two coordination polymers formed by Ni(cyclam)2+ cations and sulfate anions","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989024012337","","x-ray","0.71073","MoKα","","0.1881","0.0769","","","0.096","0.1228","","","","","","0.985","","","","has coordinates,has disorder","297060","2025-01-04","02:37:29",""
"2023344","9.3527","0.0001","9.9701","0.0001","17.0496","0.0002","90","","90","","90","","1589.83","0.03","293","2","293","2","","","","","","","","5","A e a 2","A 2 -2ab","41","","Ooly[di-μ~2~-nitrato-μ~2~-urea-strontium(II)]","","- C H4 N4 O7 Sr -","- C H4 N4 O7 Sr -","- C8 H32 N32 O56 Sr8 -","8","1","TX2092","Bektursinova, Aysanem; Djumanazarova, Zulfiya; Uzakbergenova, Zamira; Ashurov, Jamshid; Khan, Akram A.; Kadirova, Shakhnoza; Torambetov, Batirbay","Synthesis, crystal structure and Hirshfeld surface analysis of [Sr(urea)(NO3)2] n","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989024012386","","x-ray","1.54184","CuKα","","0.0213","0.0209","","","0.0544","0.0548","","","","","","1.07","","","","has coordinates","297206","2025-01-08","02:36:43",""
"2023345","7.0105","0.0004","13.2765","0.0008","8.1311","0.0005","90","","114.808","0.003","90","","686.96","0.07","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Nitrobenzo[<i>c</i>][1,2,5]selenadiazole","","- C6 H3 N3 O2 Se -","- C6 H3 N3 O2 Se -","- C24 H12 N12 O8 Se4 -","4","1","VU2008","Gurbanov, Atash V.; Hökelek, Tuncer; Mammadova, Gunay Z.; Hasanov, Khudayar I.; Javadzade, Tahir A.; Belay, Alebel N.","Crystal structure, Hirshfeld surface analysis and crystal voids of 4-nitrobenzo[c][1,2,5]selenadiazole","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989024012398","","","0.71073","MoKα","","0.0507","0.0435","","","0.1013","0.1038","","","","","","1.172","","","","has coordinates","297207","2025-01-08","02:37:00",""
"2023346","11.413","0.0001","17.1627","0.0001","31.7109","0.0002","90","","90","","90","","6211.46","0.08","100","0.1","100","0.1","","","","","","","","6","P b c a","-P 2ac 2ab","61","","(2,9-Dimethyl-1,10-phenanthroline)bis[2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate","","- C36 H28 F6 Ir N4 P -","- C36 H28 F6 Ir N4 P -","- C288 H224 F48 Ir8 N32 P8 -","8","1","ZV2036","Gienau, Trevor J.; Clay, Malachi; Brennessel, William W.; Reed, Carly R.","(2,9-Dimethyl-1,10-phenanthroline)bis[2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate and (2,9-dimethyl-1,10-phenanthroline)bis[5-methyl-2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate–diethyl ether–acetonitrile (1/0.61/0.78)","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989024012039","","x-ray","1.54184","CuKα","","0.0245","0.0241","","","0.0595","0.0598","","","","","","1.164","","","","has coordinates","297318","2025-01-15","02:28:45",""
"2023347","9.17379","0.00007","13.10065","0.00009","16.55352","0.00014","74.8888","0.0006","78.9993","0.0007","88.7599","0.0006","1884.53","0.03","100","0.1","100","0.1","","","","","","","","7","P -1","-P 1","2","","(2,9-Dimethyl-1,10-phenanthroline)bis[5-methyl-2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate–diethyl ether–acetonitrile (1/0.61/0.78)","","- C42 H40.44 F6 Ir N4.78 O0.61 P -","- C42 H40.44 F6 Ir N4.78 O0.61 P -","- C84 H80.88 F12 Ir2 N9.56 O1.22 P2 -","2","1","ZV2036","Gienau, Trevor J.; Clay, Malachi; Brennessel, William W.; Reed, Carly R.","(2,9-Dimethyl-1,10-phenanthroline)bis[2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate and (2,9-dimethyl-1,10-phenanthroline)bis[5-methyl-2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate–diethyl ether–acetonitrile (1/0.61/0.78)","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989024012039","","x-ray","1.54184","CuKα","","0.027","0.0259","","","0.0661","0.0667","","","","","","1.039","","","","has coordinates,has disorder","297318","2025-01-15","02:28:46",""
"2023348","7.0317","0.0001","9.78938","0.00018","14.444","0.0003","87.5944","0.0015","84.7254","0.0013","72.0372","0.0014","941.7","0.03","100","0.2","100","0.2","","","","","","","","5","P -1","-P 1","2","","1-(4-Bromophenyl)-2,2-dichloroethan-1-one","","- C8 H5 Br Cl2 O -","- C8 H5 Br Cl2 O -","- C32 H20 Br4 Cl8 O4 -","4","2","NX2018","Gurbanov, Atash V.; Guseinov, Firudin I.; Samigullina, Aida I.; Hökelek, Tuncer; Hasanov, Khudayar I.; Javadzade, Tahir A.; Belay, Alebel N.","Syntheses, crystal structures, Hirshfeld surface analyses and crystal voids of 1-(4-bromophenyl)-2,2-dichloroethan-1-one and 2,2-dibromo-1-(p-tolyl)ethan-1-one","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S205698902500012X","","x-ray","1.54184","CuKα","","0.0313","0.031","","","0.0846","0.0848","","","","","","1.1","","","","has coordinates","297319","2025-01-15","02:29:09",""
"2023349","6.6243","0.0001","9.9574","0.0001","14.3804","0.0002","90","","92.52","0.001","90","","947.63","0.02","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2,2-Dibromo-1-(<i>p</i>-tolyl)ethan-1-one","2,2-Dibromo-1-(4-methylphenyl)ethan-1-one","","- C9 H8 Br2 O -","- C9 H8 Br2 O -","- C36 H32 Br8 O4 -","4","1","NX2018","Gurbanov, Atash V.; Guseinov, Firudin I.; Samigullina, Aida I.; Hökelek, Tuncer; Hasanov, Khudayar I.; Javadzade, Tahir A.; Belay, Alebel N.","Syntheses, crystal structures, Hirshfeld surface analyses and crystal voids of 1-(4-bromophenyl)-2,2-dichloroethan-1-one and 2,2-dibromo-1-(p-tolyl)ethan-1-one","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S205698902500012X","","x-ray","1.54184","CuKα","","0.0274","0.0268","","","0.0701","0.0705","","","","","","1.075","","","","has coordinates","297319","2025-01-15","02:29:10",""
"2023350","15.7143","0.0005","11.6386","0.0004","13.0138","0.0005","90","","115.227","0.002","90","","2153.12","0.14","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Chloridobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) perchlorate","","- C24 H16 Cl2 Cu N4 O4 -","- C24 H16 Cl2 Cu N4 O4 -","- C96 H64 Cl8 Cu4 N16 O16 -","4","0.5","WM5744","Plutenko, Maksym O.; Vynohradov, Oleksandr S.; Haukka, Matti; Golenya, Irina A.; Gaidai, Snizhana V.","Crystal structure and Hirshfeld surface analysis of a new polymorph of chloridobis(1,10-phenanthroline-κ2 N,N′)copper(II) perchlorate","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989025000209","","","0.71073","MoKα","","0.0614","0.0439","","","0.0965","0.1049","","","","","","1.06","","","","has coordinates","297320","2025-01-15","02:29:28",""
"2023351","7.5164","0.0005","7.8002","0.0005","15.1156","0.001","96.172","0.006","92.052","0.005","96.284","0.005","874.77","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Dichloridobis(isoquinoline <i>N</i>-oxide-κ<i>O</i>)zinc(II)","","- C18 H14 Cl2 N2 O2 Zn -","- C18 H14 Cl2 N2 O2 Zn -","- C36 H28 Cl4 N4 O4 Zn2 -","2","1","HB8119","Groneck, Erin N.; Peek, Nathan; Lynch, Will E.; Padgett, Clifford W.","Crystal structures of zinc(II) coordination complexes with isoquinoline N-oxide","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989025000180","","x-ray","0.71073","MoKα","","0.0747","0.0488","","","0.1087","0.1237","","","","","","1.062","","","","has coordinates","297321","2025-01-15","02:30:21",""
"2023352","17.1095","0.001","7.202","0.0006","14.9534","0.0011","90","","96.472","0.006","90","","1830.9","0.2","170","","170","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Dibromidobis(isoquinoline <i>N</i>-oxide-κ<i>O</i>)zinc(II)","","- C18 H14 Br2 N2 O2 Zn -","- C18 H14 Br2 N2 O2 Zn -","- C72 H56 Br8 N8 O8 Zn4 -","4","0.5","HB8119","Groneck, Erin N.; Peek, Nathan; Lynch, Will E.; Padgett, Clifford W.","Crystal structures of zinc(II) coordination complexes with isoquinoline N-oxide","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989025000180","","x-ray","0.71073","MoKα","","0.0604","0.0519","","","0.1335","0.1407","","","","","","1.027","","","","has coordinates","297321","2025-01-15","02:30:25",""
"2023353","7.7325","0.0003","8.9596","0.0004","14.8297","0.0009","93.205","0.004","99.873","0.004","104.852","0.004","972.98","0.09","170","","170","","","","","","","","","6","P -1","-P 1","2","","Diiodidobis(isoquinoline <i>N</i>-oxide-κ<i>O</i>)zinc(II)","","- C18 H14 I2 N2 O2 Zn -","- C18 H14 I2 N2 O2 Zn -","- C36 H28 I4 N4 O4 Zn2 -","2","1","HB8119","Groneck, Erin N.; Peek, Nathan; Lynch, Will E.; Padgett, Clifford W.","Crystal structures of zinc(II) coordination complexes with isoquinoline N-oxide","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989025000180","","x-ray","0.71073","MoKα","","0.0248","0.0201","","","0.0463","0.0481","","","","","","1.032","","","","has coordinates","297321","2025-01-15","02:30:34",""
"2023354","12.8217","0.0004","12.8217","0.0004","26.5684","0.0009","90","","90","","120","","3782.6","0.2","170","","170","","","","","","","","","6","R -3 :H","-R 3","148","","Hexakis(isoquinoline <i>N</i>-oxide-κ<i>O</i>)zinc(II) bis(perchlorate)","","- C54 H42 Cl2 N6 O14 Zn -","- C54 H42 Cl2 N6 O14 Zn -","- C162 H126 Cl6 N18 O42 Zn3 -","3","0.166667","HB8119","Groneck, Erin N.; Peek, Nathan; Lynch, Will E.; Padgett, Clifford W.","Crystal structures of zinc(II) coordination complexes with isoquinoline N-oxide","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989025000180","","x-ray","0.71073","MoKα","","0.0301","0.0277","","","0.075","0.0767","","","","","","1.063","","","","has coordinates","297321","2025-01-15","02:30:34",""
"2023355","9.736","0.0009","11.591","0.0009","14.6381","0.001","74.352","0.006","74.62","0.007","81.633","0.007","1528.8","0.2","170","","170","","","","","","","","","5","P -1","-P 1","2","","Pentaaqua(isoquinoline <i>N</i>-oxide-κ<i>O</i>)zinc(II) dinitrate–isoquinoline <i>N</i>-oxide (1/2)","","- C27 H31 N5 O14 Zn -","- C27 H31 N5 O14 Zn -","- C54 H62 N10 O28 Zn2 -","2","1","HB8119","Groneck, Erin N.; Peek, Nathan; Lynch, Will E.; Padgett, Clifford W.","Crystal structures of zinc(II) coordination complexes with isoquinoline N-oxide","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989025000180","","x-ray","0.71073","MoKα","","0.0673","0.0444","","","0.0953","0.1059","","","","","","1.039","","","","has coordinates","297321","2025-01-15","02:30:35",""
"2023356","8.9895","0.0003","11.8589","0.0003","17.6765","0.0005","90","","102.419","0.0011","90","","1840.32","0.09","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","4,4'-Methylenebis(2,6-diethylaniline)","4,4'-(Methanediyl)bis(2,6-diethylaniline)","","- C21 H30 N2 -","- C21 H30 N2 -","- C84 H120 N8 -","4","1","NY2009","Smirnov, Daniil E.; Morozov, Oleg S.; Afanasyeva, Ekaterina S.; Avdeev, Viktor V.","Synthesis and crystal structures of 4,4′-methylenebis(2,6-diethylaniline) and 4,4′-methylenebis(3-chloro-2,6-diethylaniline)","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989025000234","","","1.54178","CuKα","","0.0525","0.0495","","","0.132","0.1345","","","","","","1.026","","","","has coordinates,has disorder","297375","2025-01-18","02:35:16",""
"2023357","8.993","0.003","9.654","0.0013","12.216","0.004","69.352","0.011","77.257","0.012","87.67","0.008","967.2","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","4,4'-Methylenebis(3-chloro-2,6-diethylaniline)","4,4'-(MethAnediyl)bis(3-chloro-2,6-diethylaniline)","","- C21 H28 Cl2 N2 -","- C21 H28 Cl2 N2 -","- C42 H56 Cl4 N4 -","2","1","NY2009","Smirnov, Daniil E.; Morozov, Oleg S.; Afanasyeva, Ekaterina S.; Avdeev, Viktor V.","Synthesis and crystal structures of 4,4′-methylenebis(2,6-diethylaniline) and 4,4′-methylenebis(3-chloro-2,6-diethylaniline)","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989025000234","","","0.75268","synchrotron","","0.0643","0.0506","","","0.1375","0.1471","","","","","","1.05","","","","has coordinates,has disorder","297375","2025-01-18","02:35:19",""
"2023358","10.1221","0.0005","13.6533","0.0004","6.6248","0.0003","90","","90","","90","","915.55","0.07","295","","295","","","","","","","","","5","P b c m","-P 2c 2b","57","2-Methylquinazolin-4(3<i>H</i>)-one hydrochloride","2-Methyl-4-oxo-3,4-dihydroquinazolin-1-ium chloride","","- C9 H9 Cl N2 O -","- C9 H9 Cl N2 O -","- C36 H36 Cl4 N8 O4 -","4","0.5","WM5743","Davlatboev, Muzaffar; Allabergenova, Sevara; Zulpanov, Fazliddin; Yakubov, Ubaydullo; Tojiboev, Akmaljon; Sattarov, Tulkinjon","Crystal structure and Hirshfeld surface analysis of 2-methylquinazolin-4(3H)-one hydrochloride","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989025000258","","","1.54184","CuKα","","0.0503","0.0432","","","0.1251","0.1326","","","","","","1.0084","","","","has coordinates","297376","2025-01-18","02:35:41",""
"2023359","17.91596","0.00013","11.08917","0.00009","17.25666","0.00013","90","","90","","90","","3428.43","0.05","100.15","","100.15","","","","","","","","","5","P n a 21","P 2c -2n","33","","Poly[(acetic acid)bis(μ-5-carboxythiophene-2-carboxylato)bis(μ-thiophene-2,5-dicarboxylato)dicerium(III)]","","- C26 H14 Ce2 O18 S4 -","- C26 H14 Ce2 O18 S4 -","- C104 H56 Ce8 O72 S16 -","4","1","NX2017","Ruser, Niklas; Näther, Christian; Stock, Norbert","Syntheses and crystal structures of the cerium-based coordination polymers poly[(acetic acid)bis(μ-5-carboxythiophene-2-carboxylato)bis(μ-thiophene-2,5-dicarboxylato)dicerium(III)] and poly[(μ-acetato)aqua(μ4-thiophene-2,5-dicarboxylato)cerium(III)]","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989025000210","","x-ray","1.54184","CuKα","","0.0241","0.024","","","0.0673","0.0673","","","","","","1.054","","","","has coordinates","297377","2025-01-18","02:36:04",""
"2023360","10.031","0.0001","14.6755","0.0001","7.6765","0.0001","90","","102.354","0.001","90","","1103.89","0.02","99.99","0.1","99.99","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[(μ-acetato)aqua(μ~4~-thiophene-2,5-dicarboxylato)cerium(III)]","","- C8 H7 Ce O7 S -","- C8 H7 Ce O7 S -","- C32 H28 Ce4 O28 S4 -","4","1","NX2017","Ruser, Niklas; Näther, Christian; Stock, Norbert","Syntheses and crystal structures of the cerium-based coordination polymers poly[(acetic acid)bis(μ-5-carboxythiophene-2-carboxylato)bis(μ-thiophene-2,5-dicarboxylato)dicerium(III)] and poly[(μ-acetato)aqua(μ4-thiophene-2,5-dicarboxylato)cerium(III)]","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989025000210","","x-ray","1.54184","CuKα","","0.0266","0.0265","","","0.0771","0.0772","","","","","","1.153","","","","has coordinates","297377","2025-01-18","02:36:05",""
"2023361","8.5014","0.0002","12.8233","0.0003","13.6364","0.0003","107.689","0.002","107.067","0.002","92.749","0.002","1338.49","0.06","100","0.1","100.15","","","","","","","","","5","P -1","-P 1","2","","Tris(2-iodoethylammonium) hexaiodidobismuthate(III)","","- C6 H21 Bi I9 N3 -","- C6 H21 Bi I9 N3 -","- C12 H42 Bi2 I18 N6 -","2","1","WM5745","Kucheriv, Olesia I.; Ovdenko, Valeriia M.; Kuzevanova, Iryna S.; Golenya, Irina A.; Gural'skiy, Il'ya A.","Crystal structure and Hirshfeld surface analysis of the organic–inorganic hybrid compound tris(2-iodoethylammonium) hexaiodidobismuthate(III)","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989025000386","","","0.71073","MoKα","","0.0291","0.0247","","","0.0476","0.0491","","","","","","1.037","","","","has coordinates","297453","2025-01-24","03:09:54",""
"2023362","5.6812","0.00009","9.79735","0.00016","30.9679","0.0007","84.834","0.0016","86.9814","0.0016","83.8568","0.0014","1705.22","0.06","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","","2,2,2-Trichloroethyl <i>N</i>-{4-[6-(1-hydroxyethyl)-1,2,4,5-tetrazin-3-yl]benzyl}carbamate","","- C14 H14 Cl3 N5 O3 -","- C14 H14 Cl3 N5 O3 -","- C56 H56 Cl12 N20 O12 -","4","2","DJ2079","Voss, J.; Stammler, H.G.; Sewald, N.","Synthesis and crystal structure of 2,2,2-trichloroethyl N-{4-[6-(1-hydroxyethyl)-1,2,4,5-tetrazin-3-yl]benzyl}carbamate","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989025000441","","x-ray","1.54184","CuKα","","0.0715","0.0692","","","0.2018","0.2064","","","","","","1.046","","","","has coordinates,has disorder","297454","2025-01-24","03:10:09",""
"2023363","16.1416","0.0005","12.8991","0.0004","19.0656","0.0005","90","","107.416","0.001","90","","3787.71","0.19","100","2","100","2","","","","","","","","5","C 1 c 1","C -2yc","9","","5-Oxo-<i>N</i>-phenyl-3-(thiophen-2-yl)-2,3,4,5-tetrahydro-[1,1'-biphenyl]-4-carboxamide","","- C23 H19 N O2 S -","- C23 H19 N O2 S -","- C184 H152 N8 O16 S8 -","8","2","WM5747","Aliyeva, Khatira N.; Hökelek, Tuncer; Khrustalev, Victor N.; Rzayev, Rovnag M.; Bhattarai, Ajaya; Maharramov, Abel M.; Shikhaliyev, Namig G.","Synthesis, crystal structure and Hirshfeld surface analysis of 5-oxo-N-phenyl-3-(thiophen-2-yl)-2,3,4,5-tetrahydro-[1,1′-biphenyl]-4-carboxamide","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S205698902500057X","","","0.71073","MoKα","","0.0549","0.0495","","","0.1247","0.1285","","","","","","1.03","","","","has coordinates,has disorder","297518","2025-01-29","03:24:24",""
"2023364","17.2598","0.0003","10.0898","0.0001","13.181","0.0002","90","","90","","90","","2295.44","0.06","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","5,10-Bis(phenylsulfonyl)tetrahydrodibenzopentalene","8,16-Bis(benzenesulfonyl)tetracyclo[7.7.0.0^2,7^.0^10,15^]hexadeca-2,4,6,10(15),11,13-hexaene","","- C28 H22 O4 S2 -","- C28 H22 O4 S2 -","- C112 H88 O16 S8 -","4","1","OX2012","Sakami, Toshiki; Watanabe, Hikaru; Sato, Takuma; Okuda, Yasuhiro; Wakamatsu, Kan; Akashi, Haruo; Orita, Akihiro","Synthesis and crystal structure of 5,10-bis(phenylsulfonyl)tetrahydrodibenzopentalene","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S205698902500060X","","x-ray","0.71073","MoKα","","0.0346","0.0306","","","0.0796","0.0878","","","","","","1.125","","","","has coordinates","297519","2025-01-29","03:24:41",""
"2023365","7.4512","0.0005","14.7799","0.00012","15.8912","0.00011","90","","90","","90","","1750.07","0.12","99.9","0.4","99.9","0.4","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-Ethyl-1,3-dihydro-2<i>H</i>-benzo[<i>d</i>]imidazole-2-thione","","- C9 H10 N2 S -","- C9 H10 N2 S -","- C72 H80 N16 S8 -","8","2","PK2714","Gurbanov, Atash V.; Guseinov, Firudin I.; Samigullina, Aida I.; Hökelek, Tuncer; Hasanov, Khudayar I.; Javadzade, Tahir A.; Belay, Alebel N.","Synthesis and crystal structure analysis of 1-ethyl-1,3-dihydro-2H-benzo[d]imidazole-2-thione","Acta Crystallographica Section E Crystallographic Communications","2025","81","2","","","10.1107/S2056989025000519","","x-ray","1.54184","CuKα","","0.0258","0.0257","","","0.0689","0.069","","","","","","1.063","","","","has coordinates","297520","2025-01-29","03:24:55",""
"2023486","6.6576","0.0001","17.1463","0.0002","15.8105","0.0002","90","","98.935","0.001","90","","1782.92","0.04","160","0.1","160","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-(2-{3-[2-(2-Oxooxazolidin-3-yl)ethoxy]quinoxalin-2-yloxy}ethyl)oxazolidin-2-one","","- C18 H20 N4 O6 -","- C18 H20 N4 O6 -","- C72 H80 N16 O24 -","4","1","HB8134","Aboutofil, Fatima Ezzahra; Mustaphi, Nour El Hoda; Blacque, Olivier; Hökelek, Tuncer; Mazzah, Ahmed; El Ghayati, Lhoussaine; Sebbar, Nada Kheira","Synthesis and crystal structure of 3-(2-{3-[2-(2-oxooxazolidin-3-yl)ethoxy]quinoxalin-2-yloxy}ethyl)oxazolidin-2-one","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025003755","","x-ray","1.54184","CuKα","","0.0406","0.0379","","","0.0962","0.0994","","","","","","1.064","","","","has coordinates","299501","2025-05-03","01:46:50",""
"2023487","38.722","0.003","10.4622","0.0007","23.891","0.0016","90","","106.978","0.008","90","","9256.8","1.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Perethoxy-prism[6]arene 1,6-dichlorohexane disolvate","","- C102 H120 Cl4 O12 -","- C102 H120 Cl4 O12 -","- C408 H480 Cl16 O48 -","4","0.5","DX2066","Vinodh, Mickey; Abdeljaber, Nour O.; Alipour, Fatemeh H.; Al-Azemi, Talal F.","Crystal structures and supramolecular interactions of prism[6]arene-based host–guest systems with dihalohexanes","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025003767","","","0.71075","MoKα","","0.1611","0.0711","","","0.1532","0.1866","","","","","","0.996","","","","has coordinates,has disorder","299502","2025-05-03","01:47:31",""
"2023488","38.728","0.003","10.5427","0.0006","24.0234","0.0016","90","","106.814","0.008","90","","9389.4","1.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Perethoxy-prism[6]arene 1,6-diiodohexane disolvate","","- C102 H120 I4 O12 -","- C102 H120 I4 O12 -","- C408 H480 I16 O48 -","4","0.5","DX2066","Vinodh, Mickey; Abdeljaber, Nour O.; Alipour, Fatemeh H.; Al-Azemi, Talal F.","Crystal structures and supramolecular interactions of prism[6]arene-based host–guest systems with dihalohexanes","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025003767","","","0.71075","MoKα","","0.1402","0.0685","","","0.1633","0.1924","","","","","","1.016","","","","has coordinates","299502","2025-05-03","01:47:32",""
"2023489","10.0036","0.0005","15.8231","0.0007","6.9325","0.0003","90","","99.808","0.002","90","","1081.29","0.09","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[3,10-Bis(3-carboxypropyl)-1,3,5,8,10,12-hexaazacyclotetradecane-κ^4^<i>N</i>^1^,<i>N</i>^5^,<i>N</i>^8^,<i>N</i>^12^]dichloridocopper(II)","","- C16 H34 Cl2 Cu N6 O4 -","- C16 H34 Cl2 Cu N6 O4 -","- C32 H68 Cl4 Cu2 N12 O8 -","2","0.5","HB8137","Tsymbal, Liudmyla V.; Andriichuk, Irina L.; Stoica, Alexandru-Constantin; Lampeka, Yaroslaw D.","Synthesis and structural characterization of the dichloride complex formed by carboxy-functionalized Cu(diazacyclam)2+ cation and its heterometallic coordination polymer with CdCl2","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025003792","","","0.71073","MoKα","","0.0447","0.0292","","","0.0608","0.0667","","","","","","1.054","","","","has coordinates","299503","2025-05-03","01:47:56",""
"2023490","10.1565","0.0004","10.4249","0.0005","14.6531","0.0007","80.305","0.003","80.117","0.003","64.149","0.003","1367.82","0.11","273.15","","273.15","","","","","","","","","7","P -1","-P 1","2","","Poly[[aqua[μ~3~-3,10-bis(3-carboxypropyl)-1,3,5,8,10,12-hexaazacyclotetradecane-κ^4^<i>N</i>^1^,<i>N</i>^5^,<i>N</i>^8^,<i>N</i>^12^:κ^2^<i>O</i>,<i>O</i>':κ^2^<i>O</i>'',<i>O</i>''']-μ-chloridocopper(II)cadmium(II]] 1.25-hydrate]","","- C16 H36.5 Cd Cl2 Cu N6 O6.25 -","- C16 H36.5 Cd Cl2 Cu N6 O6.25 -","- C32 H73 Cd2 Cl4 Cu2 N12 O12.5 -","2","1","HB8137","Tsymbal, Liudmyla V.; Andriichuk, Irina L.; Stoica, Alexandru-Constantin; Lampeka, Yaroslaw D.","Synthesis and structural characterization of the dichloride complex formed by carboxy-functionalized Cu(diazacyclam)2+ cation and its heterometallic coordination polymer with CdCl2","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025003792","","","0.71073","MoKα","","0.0783","0.0496","","","0.1298","0.1487","","","","","","1.037","","","","has coordinates,has disorder","299503","2025-05-03","01:47:58",""
"2023491","10.6654","0.0012","13.5974","0.0015","15.7917","0.0017","109.206","0.002","101.687","0.002","107.789","0.002","1938.8","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","1,1'-[Oxybis(ethane-2,1-diyl)]bis(2-methylsulfanyl-1<i>H</i>-benzo[<i>d</i>]imidazole)","","- C20 H22 N4 O S2 -","- C20 H22 N4 O S2 -","- C80 H88 N16 O4 S8 -","4","2","VM2313","Moussaif, Ahmed; El Ghayati, Lhoussaine; Kalonji Mubengayi, Camille; Alsubari, Abdulsalam; Essassi, El Mokhtar; Mague, Joel T.; Ramli, Youssef","Synthesis, crystal structure and Hirshfeld surface analysis of 1,1′-[oxybis(ethane-2,1-diyl)]bis(2-methylsulfanyl-1H-benzo[d]imidazole)","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025003809","","","0.71073","MoKα","","0.1065","0.0678","","","0.1873","0.1987","","","","","","0.999","","","","has coordinates,has disorder","299504","2025-05-03","01:48:22",""
"2023492","15.9012","0.0003","11.0897","0.0002","18.9475","0.0005","90","","109.182","0.003","90","","3155.69","0.13","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetrakis(2-aminobenzoxazole-κ<i>N</i>^1^)bis(nitrato-κ<i>O</i>)cadmium(II)","","- C28 H24 Cd N10 O10 -","- C28 H24 Cd N10 O10 -","- C112 H96 Cd4 N40 O40 -","4","0.5","WM5756","Razzoqova, Surayyo; Ruzimov, Yodgor; Toshov, Akobir; Torambetov, Batirbay; Ibragimov, Aziz; Ashurov, Jamshid; Kadirova, Shakhnoza","Synthesis, crystal structure and Hirshfeld surface analysis of a coordination compound of cadmium nitrate with 2-aminobenzoxazole","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025004049","","x-ray","1.54184","CuKα","","0.0632","0.0486","","","0.1182","0.1278","","","","","","1.013","","","","has coordinates","299611","2025-05-10","01:49:57",""
"2023493","16.429","0.0002","8.05961","0.0001","13.72324","0.00016","90","","106.758","0.0014","90","","1739.94","0.04","299.99","0.1","299.99","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","<i>N</i>,<i>N</i>'-2,3,8,9-Bismethylsuccinimide-11,12-dihydrodibenzo[<i>c</i>,<i>g</i>][1,2]diazocine","8,19-Dimethyl-2,3,8,19-tetraazapentacyclo[13.7.0.0^4,12^.0^6,10^.0^17,21^]docosa-1(15),2,4(12),5,10,16,21-heptaene-7,9,18,20-tetrone","","- C20 H14 N4 O4 -","- C20 H14 N4 O4 -","- C80 H56 N16 O16 -","4","1","HB8139","Näther, Christian; Businski, Artjom; Herges, Rainer","Reversible phase transition in 8,19-dimethyl-2,3,8,19-tetraazapentacyclo[13.7.0.04,12.06,10.017,21]docosa-1(15),2,4(12),5,10,16,21-heptaene-7,9,18,20-tetrone","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025003998","","x-ray","1.54184","CuKα","","0.0411","0.0393","","","0.1074","0.109","","","","","","1.061","","","","has coordinates","299612","2025-05-10","01:50:18",""
"2023494","7.9465","0.0002","13.7201","0.0003","16.2592","0.0006","106.993","0.002","90.914","0.003","90.1121","0.0019","1695.04","0.09","90","2","90","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H14 N4 O4 -","- C20 H14 N4 O4 -","- C80 H56 N16 O16 -","4","2","HB8139","Näther, Christian; Businski, Artjom; Herges, Rainer","Reversible phase transition in 8,19-dimethyl-2,3,8,19-tetraazapentacyclo[13.7.0.04,12.06,10.017,21]docosa-1(15),2,4(12),5,10,16,21-heptaene-7,9,18,20-tetrone","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025003998","","x-ray","1.54184","CuKα","","0.0419","0.0413","","","0.1161","0.1167","","","","","","1.071","","","","has coordinates","299612","2025-05-10","01:50:20",""
"2023495","13.9944","0.0008","11.0371","0.0007","9.056","0.0005","90","","99.936","0.002","90","","1377.79","0.14","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-2-Cyano-<i>N</i>'-(3,4,5-trimethoxybenzylidene)acetohydrazide","","- C13 H15 N3 O4 -","- C13 H15 N3 O4 -","- C52 H60 N12 O16 -","4","1","TX2097","Maheswari, Subramani Uma; Senthilkumar, Srinivasan; Selvanayagam, Sivashanmugam","Crystal structure and Hirshfeld surface analysis of (E)-2-cyano-N′-(3,4,5-trimethoxybenzylidene)acetohydrazide","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025003913","","","0.71073","MoKα","","0.1228","0.053","","","0.115","0.1558","","","","","","1.054","","","","has coordinates","299613","2025-05-10","01:50:42",""
"2023496","10.5367","0.0004","10.9088","0.0005","14.1593","0.0007","92.782","0.004","109.796","0.004","104.077","0.004","1469.98","0.13","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","Bis(μ-thiosemicarbazide-κ^3^<i>N</i>^1^,<i>S</i>:<i>S</i>;κ^3^<i>S</i>:<i>N</i>^1^,<i>S</i>)bis[(dimethylformamide-κ<i>O</i>)(thiosemicarbazide-κ^2^<i>N</i>^1^,<i>S</i>)cadmium(II)] tetrakis(2,4,6-trinitrophenolate)","","- C34 H42 Cd2 N26 O30 S4 -","- C34 H42 Cd2 N26 O30 S4 -","- C34 H42 Cd2 N26 O30 S4 -","1","0.5","HB8138","Santhakumaria, R.; Ramamurthi, K.; Kaur, Manpreet; Jasinski, Jerry P.; Sagadevane, Suresh; Stoeckli-Evans, Helen","Bis(μ-thiosemicarbazide-κ3 N 1,S:S;κ3 S:N 1,S)bis[(dimethylformamide-κO)(thiosemicarbazide-κ2 N 1,S)cadmium(II)] tetrakis(2,4,6-trinitrophenolate): synthesis, crystal structure and Hirshfeld surface analysis","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025003974","","x-ray","1.54184","CuKα","","0.0421","0.0371","","","0.0913","0.0952","","","","","","1.019","","","","has coordinates,has disorder","299647","2025-05-14","01:56:36",""
"2023497","7.6956","0.0003","8.6895","0.0004","8.9468","0.0004","74.633","0.002","83.237","0.002","73.008","0.002","551.18","0.04","100","0.2","100","0.2","","","","","","","","5","P -1","-P 1","2","","1-(4-Fluorophenyl)-3,3-bis(methylsulfanyl)prop-2-en-1-one","","- C11 H11 F O S2 -","- C11 H11 F O S2 -","- C22 H22 F2 O2 S4 -","2","1","NX2025","Mohan Kumar, Thaluru M.; Bhaskar, Besagarahally L.; Bhavya, Papegowda; Divakara, Thayamma R.; Shankara Prasad, Holehundi J.; Yathirajan, Hemmige S.; Parkin, Sean","Crystal structure and Hirshfeld-surface analysis of 1-(4-fluorophenyl)-3,3-bis(methylsulfanyl)prop-2-en-1-one","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025004189","","","0.71073","MoKα","","0.0265","0.0247","","","0.0632","0.0645","","","","","","1.108","","","","has coordinates","299648","2025-05-14","01:56:52",""
"2023498","11.5409","0.0007","10.9018","0.0006","14.3799","0.0008","90","","103.427","0.002","90","","1759.78","0.17","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-3,4,5-Trihydroxy-<i>N</i>'-(3,4,5-trimethoxybenzylidene)benzohydrazide monohydrate","","- C17 H20 N2 O8 -","- C17 H20 N2 O8 -","- C68 H80 N8 O32 -","4","1","TX2096","Lo, Mamadou; Sene, Bineta; Pouye, Adji Fatou Fall; Lee, Arie van der; Gassama, Abdoulaye; Richeter, Sébastien","Synthesis and structure of (E)-3,4,5-trihydroxy-N′-(3,4,5-trimethoxybenzylidene)benzohydrazide monohydrate","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025004001","","","0.71073","MoKα","","0.055","0.0349","","","0.0551","0.0621","","","","","","1.084","","","","has coordinates,has disorder","299649","2025-05-14","01:57:35",""
"2023499","15.1487","0.0001","9.2389","0.0001","10.8661","0.0001","90","","94.242","0.001","90","","1516.62","0.02","299","2","299","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Chloromethyl 2-[2-(2,6-dichlorophenylamino)phenyl]acetate","","- C15 H12 Cl3 N O2 -","- C15 H12 Cl3 N O2 -","- C60 H48 Cl12 N4 O8 -","4","1","NU2009","Keydel, Tobias; Bandaru, Siva S. M.; Schulig, Lukas; Link, Andreas; Schulzke, Carola","Crystal structure of chloromethyl 2-[2-(2,6-dichlorophenylamino)phenyl]acetate","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025004074","","","1.54184","CuKα","","0.0319","0.0307","","","0.0799","0.0809","","","","","","1.071","","","","has coordinates","299650","2025-05-14","01:58:09",""
"2023500","12.4498","0.0005","14.5714","0.0006","22.1464","0.001","90","","97.726","0.001","90","","3981.1","0.3","100","2","100.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H33 F6 I P2 Pd -","- C44 H33 F6 I P2 Pd -","- C176 H132 F24 I4 P8 Pd4 -","4","1","JY2058","Bosch, Eric","Phenyl palladium(II) iodide complexes isolated after Sonogashira coupling of iodobenzenes with terminal alkynes","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025004025","","","0.71073","MoKα","","0.0301","0.0278","","","0.0661","0.0677","","","","","","1.0247","","","","has coordinates","299652","2025-05-14","01:59:27",""
"2023501","11.7692","0.0007","34.87","0.002","10.4381","0.0006","90","","99.92","0.001","90","","4219.7","0.4","100","2","100.15","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","(3,5-Dinitrophenyl)iodidobis(triphenylphosphane)palladium(II) ethyl acetate monosolvate","","- C46 H41 I N2 O6 P2 Pd -","- C46 H41 I N2 O6 P2 Pd -","- C184 H164 I4 N8 O24 P8 Pd4 -","4","1","JY2058","Bosch, Eric","Phenyl palladium(II) iodide complexes isolated after Sonogashira coupling of iodobenzenes with terminal alkynes","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025004025","","","0.71073","MoKα","","0.058","0.0446","","","0.0854","0.0911","","","","","","1.0549","","","","has coordinates","299652","2025-05-14","01:59:27",""
"2023502","11.6327","0.0005","12.8059","0.0005","23.4327","0.0009","90","","93.218","0.002","90","","3485.2","0.2","100","2","100.15","","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C42 H32 F3 I P2 Pd -","- C42 H32 F3 I P2 Pd -","- C168 H128 F12 I4 P8 Pd4 -","4","0.5","JY2058","Bosch, Eric","Phenyl palladium(II) iodide complexes isolated after Sonogashira coupling of iodobenzenes with terminal alkynes","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025004025","","","0.71073","MoKα","","0.0223","0.0214","","","0.0515","0.0522","","","","","","1.0523","","","","has coordinates,has disorder","299652","2025-05-14","01:59:27",""
"2023503","11.5608","0.0005","11.6437","0.0005","18.1311","0.0008","76.426","0.001","77.722","0.001","81.344","0.001","2305.16","0.17","100","2","100.15","","","","","","","","","7","P -1","-P 1","2","","","","- C44 H34 Cl4 F3 I3 P2 Pd -","- C44 H34 Cl4 F3 I3 P2 Pd -","- C88 H68 Cl8 F6 I6 P4 Pd2 -","2","1","JY2058","Bosch, Eric","Phenyl palladium(II) iodide complexes isolated after Sonogashira coupling of iodobenzenes with terminal alkynes","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025004025","","","0.71073","MoKα","","0.0417","0.0299","","","0.057","0.0618","","","","","","1.0564","","","","has coordinates,has disorder","299652","2025-05-14","01:59:28",""
"2023504","4.8393","0.0002","12.4928","0.0004","27.3101","0.0009","90","","90","","90","","1651.07","0.1","100","1","100","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3-{[(9<i>H</i>-Fluoren-9-ylmethoxy)carbonyl]amino}butanoic acid","","- C19 H19 N O4 -","- C19 H19 N O4 -","- C76 H76 N4 O16 -","4","1","VU2009","Abubakar Magaji, Mubarak; Chen, Beining; Robertson, Craig Collumbine","Synthesis, crystal structure and Hirshfeld surface analysis of Fmoc-β-amino butyric acid and Fmoc carbamate","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025003810","","","1.54178","CuKα","","0.0403","0.0324","","","0.0693","0.0731","","","","","","1.062","","","","has coordinates","299653","2025-05-14","02:00:09",""
"2023505","15.356","0.0003","5.04","0.0001","31.0254","0.0007","90","","90","","90","","2401.19","0.09","100","","100","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C15 H13 N O2 -","- C15 H13 N O2 -","- C120 H104 N8 O16 -","8","2","VU2009","Abubakar Magaji, Mubarak; Chen, Beining; Robertson, Craig Collumbine","Synthesis, crystal structure and Hirshfeld surface analysis of Fmoc-β-amino butyric acid and Fmoc carbamate","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025003810","","","1.54178","CuKα","","0.0345","0.0295","","","0.0647","0.0678","","","","","","1.047","","","","has coordinates","299653","2025-05-14","02:00:16",""
"2023506","5.1639","0.0002","11.1078","0.0003","14.8132","0.0005","90","","92.868","0.004","90","","848.61","0.05","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Dtdpe 1,8-diphenyl-3,6-dithiaoctane-1,8-dione","2-({2-[(2-oxo-2-phenylethyl)sulfanyl]ethyl}sulfanyl)-1-phenylethan-1-one","","- C18 H18 O2 S2 -","- C18 H18 O2 S2 -","- C36 H36 O4 S4 -","2","0.5","JY2055","O'Connor, Molly A.; Pavlishchuk, Anna V.; Butcher, Raymond J.; Pavlishchuk, Vitaly V.; Addison, Anthony W.","Some thioether-ketones and their related derivatives","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025004037","","","1.54184","CuKα","","0.0551","0.0462","","","0.1228","0.1305","","","","","","1.114","","","","has coordinates","299654","2025-05-14","02:05:40",""
"2023507","13.1307","0.0003","5.0945","0.0001","19.2847","0.0005","90","","93.167","0.002","90","","1288.07","0.05","100","2","100","2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","Mtdp, 1,5-diphenyl-3-thiapentane-1,5-dione","2-[(2-Oxo-2-phenylethyl)sulfanyl]-1-phenylethan-1-one","","- C16 H14 O2 S -","- C16 H14 O2 S -","- C64 H56 O8 S4 -","4","0.5","JY2055","O'Connor, Molly A.; Pavlishchuk, Anna V.; Butcher, Raymond J.; Pavlishchuk, Vitaly V.; Addison, Anthony W.","Some thioether-ketones and their related derivatives","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025004037","","","1.54184","CuKα","","0.0377","0.0312","","","0.0797","0.0836","","","","","","1.097","","","","has coordinates","299654","2025-05-14","02:05:51",""
"2023508","5.3442","0.0004","24.9746","0.0018","10.3552","0.0007","90","","99.789","0.003","90","","1361.98","0.17","102","2","102","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Prpsb, 1,10-bis(2'-pyridylhydrazono)-3,8-dithia-1,10-diphenyldecane","2-[(2<i>E</i>,12<i>E</i>)-3,12-Diphenyl-14-(pyridin-2-yl)-5,10-dithia-1,2,13,14-tetraazatetradeca-2,12-dien-1-yl]pyridine","","- C30 H32 N6 S2 -","- C30 H32 N6 S2 -","- C60 H64 N12 S4 -","2","0.5","JY2055","O'Connor, Molly A.; Pavlishchuk, Anna V.; Butcher, Raymond J.; Pavlishchuk, Vitaly V.; Addison, Anthony W.","Some thioether-ketones and their related derivatives","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025004037","","","0.71073","MoKα","","0.0745","0.0647","","","0.1669","0.1777","","","","","","1.031","","","","has coordinates","299654","2025-05-14","02:06:05",""
"2023509","9.1219","0.0003","8.6565","0.0002","17.7935","0.0007","90","","92.195","0.003","90","","1404.01","0.08","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(3<i>E</i>,8<i>Z</i>)-3,9-Dimethyl-1,11-dithia-4,5,7,8-tetraazacyclotetradeca-3,8-diene-6-thione","","- C10 H18 N4 S3 -","- C10 H18 N4 S3 -","- C40 H72 N16 S12 -","4","1","JY2055","O'Connor, Molly A.; Pavlishchuk, Anna V.; Butcher, Raymond J.; Pavlishchuk, Vitaly V.; Addison, Anthony W.","Some thioether-ketones and their related derivatives","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025004037","","","1.54184","CuKα","","0.0321","0.0307","","","0.0854","0.0865","","","","","","1.082","","","","has coordinates","299654","2025-05-14","02:06:15",""
"2023510","34.4957","0.0002","10.4262","0.0001","37.9992","0.0003","90","","115.604","0.001","90","","12324.7","0.2","100","2","100","2","","","","","","","","3","I 1 2/a 1","-I 2ya","15","Dhpk","2-((2<i>E</i>)-2-{(2<i>Z</i>)-2-Phenyl-2-[2-(pyridin-2-yl)hydrazin-1-ylidene]ethylidene}hydrazin-1-yl)pyridine","","- C18 H16 N6 -","- C18 H16 N6 -","- C576 H512 N192 -","32","4","JY2055","O'Connor, Molly A.; Pavlishchuk, Anna V.; Butcher, Raymond J.; Pavlishchuk, Vitaly V.; Addison, Anthony W.","Some thioether-ketones and their related derivatives","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025004037","","","1.54184","CuKα","","0.055","0.0411","","","0.1233","0.1384","","","","","","1.041","","","","has coordinates","299654","2025-05-14","02:06:26",""
"2023511","10.2352","0.0014","14.3939","0.0014","19.12","0.003","90","","98.121","0.012","90","","2788.6","0.6","173","","173","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1',4'-Diphenyl-1a,1',4',4'',5'',9b-hexahydro-2''<i>H</i>-dispiro[cyclopropa[l]phenanthrene-1,2'-[1,4]epoxynaphthalene-3',3''-thiophene]","","- C39 H30 O S -","- C39 H30 O S -","- C156 H120 O4 S4 -","4","1","HB8140","Wen, Yuewei; Thamattoor, Dasan M.","Synthesis and structure of 1′,4′-diphenyl-1a,1′,4′,4′′,5′′,9b-hexahydro-2′′H-dispiro[cyclopropa[l]phenanthrene-1,2′-[1,4]epoxynaphthalene-3′,3′′-thiophene]","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025004104","","x-ray","0.71073","MoKα","","0.0669","0.0482","","","0.1067","0.1169","","","","","","1.039","","","","has coordinates","299655","2025-05-14","02:07:03",""
"2023512","15.6136","0.0001","7.2214","0.0001","10.7929","0.0001","90","","104.622","0.001","90","","1177.51","0.02","99.98","0.1","99.98","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-[2,2-Dichloro-1-hydroxy-3-(4-methylphenyl)-3-oxopropyl]urea","","- C10 H9 Cl2 F N2 O3 -","- C10 H9 Cl2 F N2 O3 -","- C40 H36 Cl8 F4 N8 O12 -","4","1","HB8127","Guseinov, Firudin I.; Hökelek, Tuncer; Afanaseva, Ksenia A.; Shuvalova, Elena V.; Glukhov, Lev M.; Samigullina, Aida I.; Belay, Alebel N.","Syntheses and structures of 1-[2,2-dichloro-1-hydroxy-3-(4-methylphenyl)-3-oxopropyl]urea and 1-[2,2-dichloro-3-(4-fluorophenyl)-1-hydroxy-3-oxopropyl]urea","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025004359","","x-ray","1.54184","CuKα","","0.0321","0.0314","","","0.081","0.0815","","","","","","1.061","","","","has coordinates","299763","2025-05-21","02:05:24",""
"2023513","12.62183","0.00013","8.77585","0.00009","11.5993","0.00011","90","","94.8294","0.0009","90","","1280.26","0.02","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-[2,2-Dichloro-3-(4-fluorophenyl)-1-hydroxy-3-oxopropyl]urea","","- C11 H12 Cl2 N2 O3 -","- C11 H12 Cl2 N2 O3 -","- C44 H48 Cl8 N8 O12 -","4","1","HB8127","Guseinov, Firudin I.; Hökelek, Tuncer; Afanaseva, Ksenia A.; Shuvalova, Elena V.; Glukhov, Lev M.; Samigullina, Aida I.; Belay, Alebel N.","Syntheses and structures of 1-[2,2-dichloro-1-hydroxy-3-(4-methylphenyl)-3-oxopropyl]urea and 1-[2,2-dichloro-3-(4-fluorophenyl)-1-hydroxy-3-oxopropyl]urea","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025004359","","x-ray","1.54184","CuKα","","0.0374","0.0368","","","0.1031","0.1038","","","","","","1.055","","","","has coordinates","299763","2025-05-21","02:05:34",""
"2023514","8.4446","0.0002","14.0911","0.0002","13.588","0.0002","90","","96.133","0.001","90","","1607.63","0.05","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis[1,2-bis(3,5-dimethylphenyl)ethylene-1,2-dithiolato(1-)]nickel(II)","","- C36 H36 Ni S4 -","- C36 H36 Ni S4 -","- C72 H72 Ni2 S8 -","2","0.5","JY2060","Das Gupta, Titir; Guite, Jackson; Hirt, LiWen; Zhang, Xiaodong; Donahue, James P.","Bis[1,2-bis(3,5-dimethylphenyl)ethylene-1,2-dithiolato(1−)]nickel(II)","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025004293","","","1.54178","CuKα","","0.0428","0.0238","","","0.0641","0.066","","","","","","1.076","","","","has coordinates","299764","2025-05-21","02:06:04",""
"2023515","4.2126","0.0001","9.6687","0.0001","26.8628","0.0005","90","","94.186","0.001","90","","1091.21","0.03","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","5-Fluorocytosine–4-hydroxybenzaldehyde (1/1)","4-Amino-5-fluoro-1<i>H</i>-pyrimidin-2-one–4-hydroxybenzaldehyde (1/1)","","- C11 H10 F N3 O3 -","- C11 H10 F N3 O3 -","- C44 H40 F4 N12 O12 -","4","1","OI2017","Sangavi, Marimuthu; Mohana, Marimuthu; Butcher, Ray J.; McMillen, Colin D.","Crystal engineering of a 1:1 5-fluorocytosine–4-hydroxybenzaldehyde cocrystal: insights from X-ray crystallography and Hirshfeld analysis","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025004463","","","1.54184","CuKα","","0.0354","0.0342","","","0.0998","0.101","","","","","","1.041","","","","has coordinates","299807","2025-05-24","02:01:41",""
"2023516","7.6375","0.0005","11.0324","0.0006","30.2019","0.0008","90","","93.983","0.001","90","","2538.7","0.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dimethyl 3-methyl-8-{[4-(trifluoromethyl)phenyl]sulfonyl}-7,8-dihydro-4<i>H</i>-4,6a-epoxybenzo[<i>b</i>]naphtho[1,8-<i>de</i>]azepine-5,6-dicarboxylate","","- C29 H22 F3 N O7 S -","- C29 H22 F3 N O7 S -","- C116 H88 F12 N4 O28 S4 -","4","1","NX2026","Burkin, Gleb M.; Annadurdyyeva, Selbi; Kutasevich, Alexandra G.; Guliyeva, Narmina A.; Hasanov, Khudayar I.; Akkurt, Mehmet; Manahelohe, Gizachew Mulugeta","Crystal structure and Hirshfeld surface analysis of dimethyl 3-methyl-8-{[4-(trifluoromethyl)phenyl]sulfonyl}-7,8-dihydro-4H-4,6a-epoxybenzo[b]naphtho[1,8-de]azepine-5,6-dicarboxylate","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","","","10.1107/S2056989025004426","","","1.54184","CuKα","","0.0386","0.0368","","","0.1007","0.1028","","","","","","1.046","","","","has coordinates,has disorder","299808","2025-05-24","02:02:00",""
"2023517","12.9873","0.0003","13.2021","0.0003","17.91","0.0004","90","","95.796","0.001","90","","3055.14","0.12","173","2","173","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","<i>exo</i>-1,2,3,5-Tetraphenyl-1a',9b'-dihydrospiro[bicyclo[3.1.0]hexane-6,1'-cyclopropa[<i>l</i>]phenanthren]-2-en-4-one","","- C44 H30 O -","- C44 H30 O -","- C176 H120 O4 -","4","1","YY2017","Roth, Alexander D.; Thamattoor, Dasan M.","Crystal structure, computational study, and Hirshfeld analysis of exo-1,2,3,5-tetraphenyl-1a',9b'-dihydrospiro[bicyclo[3.1.0]hexane-6,1′-cyclopropa[l]phenanthren]-2-en-4-one","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","554","558","10.1107/S2056989025004414","","","0.71073","MoKα","","0.1193","0.0661","","","0.1575","0.208","","","","","","1.047","","","","has coordinates","299887","2025-05-31","02:13:27",""
"2023518","25.577","0.004","18.632","0.003","22.463","0.004","90","","94.335","0.006","90","","10674","3","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[[[[(pyridine-2,6-dicarboxylato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')zinc(II)]-μ-1,4-bis(1<i>H</i>-imidazol-1-ylmethyl)benzene-κ^2^<i>N</i>^1^:<i>N</i>^1'^] hemi{bis[μ-1,4-bis(1<i>H</i>-imidazol-1-ylmethyl)benzene-κ^2^<i>N</i>^1^:<i>N</i>^1'^]bis[(pyridine-2,6-dicarboxylato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')zinc(II)]}] nonahydrate]","","- C42 H52 N10 O17 Zn2 -","- C42 H34 N10 O17 Zn2 -","- C336 H272 N80 O136 Zn16 -","8","1","WM5758","Kummuang, Chanikarn; Chainok, Kittipong; Wannarit, Nanthawat","Crystal structure and characterization of a new chain-like polyrotaxane zinc(II) coordination polymer with mixed pyridine-2,6-dicarboxylate and 1,4-bis(1H-imidazol-1-ylmethyl)benzene ligands","Acta Crystallographica Section E Crystallographic Communications","2025","81","6","559","564","10.1107/S2056989025004608","","x-ray","0.71073","MoKα","","0.0659","0.055","","","0.1727","0.1852","","","","","","1.053","","","","has coordinates,has disorder","299888","2025-05-31","02:14:28",""
"2200000","8.506","0.0007","7.4661","0.0007","10.733","0.001","90","","102.626","0.002","90","","665.13","0.1","295","2","295","2","","","","","","","","3","P 1 21 1","P 2yb","4","ricciocarpin A","","","- C15 H20 O3 -","- C15 H20 O3 -","- C30 H40 O6 -","2","1","AC6193","Wang, Yanmei; Tan, Geok-Kheng; Koh, Lip-Lin; Harrison, Leslie J.","Ricciocarpin A","Acta Crystallographica Section E","2005","61","11","o3800","o3801","10.1107/S1600536805028011","","","0.71073","MoKα","","0.0654","0.0613","","","0.1441","0.1462","","","","","","1.192","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200001","8.92","0.004","16.282","0.008","18.504","0.009","90","","90","","90","","2687","2","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-Methyl 4-methyl-2-(1H-pyrrole-2-carboxamido)pentanoate","","- C12 H18 N2 O3 -","- C12 H18 N2 O3 -","- C96 H144 N16 O24 -","8","2","AC6205","Xiang-Chao Zeng; Po-Run Liu","(<i>S</i>)-Methyl 4-methyl-2-(1<i>H</i>-pyrrole-2-carboxamido)pentanoate","Acta Crystallographica Section E","2005","61","11","o3726","o3727","10.1107/S1600536805032393","","","0.71073","MoKα","","0.0758","0.0419","","","0.1013","0.1202","","","","","","1.015","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200002","18.564","0.003","10.6834","0.0017","28.51","0.004","90","","90","","90","","5654.3","1.5","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","2-(4-Chloro-3-methylphenoxy)-3-(4-chlorophenyl)-5-methyl- 8,9,10,11-tetrahydro-1-benzothieno[2',3':2,3]pyrido[4,5-d]pyrimidin-4(3H)-one","","- C28 H23 Cl4 N3 O2 S -","- C28 H23 Cl4 N3 O2 S -","- C224 H184 Cl32 N24 O16 S8 -","8","1","AC6207","Liu, Jian-Chao; He, Hong-Wu; Ding, Ming-Wu","2-(4-Chloro-3-methylphenoxy)-3-(4-chlorophenyl)-5-methyl-8,9,10,11-tetrahydro-1-benzothieno[2',3':2,3]pyrido[4,3-<i>d</i>]pyrimidin-4(3<i>H</i>)-one dichloromethane solvate","Acta Crystallographica Section E","2005","61","11","o3686","o3687","10.1107/S1600536805032381","","","0.71073","MoKα","","0.1142","0.087","","","0.195","0.2112","","","","","","1.101","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200003","12.613","0.007","6.701","0.004","22.383","0.012","90","","94.086","0.01","90","","1887","1.8","273","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","aqua{6,6'-dimethoxy-2,2'-[1,2-ethanediylbis(nitrilomethylidyne)]diphenolato- κ^2^N,O}oxovanadium(IV) monohydrate","","- C18 H22 N2 O7 V -","- C18 H22 N2 O7 V -","- C72 H88 N8 O28 V4 -","4","1","AC6209","Buqin Jing; Lianzhi Li; Daqi Wang; Tao Xu; Xinglin Guo","Aqua[<i>N</i>,<i>N</i>'-ethylenebis(<i>o</i>-vanillylideniminato-κ^2^<i>N</i>,<i>O</i>)]oxovanadium(IV) monohydrate","Acta Crystallographica Section E","2005","61","11","m2244","m2246","10.1107/S1600536805031843","","","0.71073","MoKα","","0.0965","0.0485","","","0.1021","0.1259","","","","","","1.007","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200004","5.419","0.002","7.438","0.002","17.814","0.003","90","","92.94","0.02","90","","717.1","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-Phenylalanine benzoic acid solvate","","- C16 H17 N O4 -","- C16 H17 N O4 -","- C32 H34 N2 O8 -","2","1","AT6033","J. Suresh; R. V. Krishnakumar; S. Natarajan","<small>L</small>-Phenylalanine‒benzoic acid (1/1)","Acta Crystallographica Section E","2005","61","11","o3625","o3627","10.1107/S1600536805031661","","","0.71073","MoKα","","0.112","0.071","","","0.164","0.187","","","","","","1.12","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200005","6.388","0.001","14.182","0.002","21.107","0.003","90","","90","","90","","1912.2","0.5","293","","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Cyproterone","6-chloro-1,2-dihydro-17-hydroxy-3'H-cyclopropa[a]pregna-1,4,6-triene- 3,20-dione","","- C22 H27 Cl O3 -","- C22 H27 Cl O3 -","- C88 H108 Cl4 O12 -","4","1","AT6034","de Ruyck, Jérôme; Henry de Hassonville, Sandrine; Liégeois, Jean-François; Wouters, Johan","Cyproterone and a comparison with its acetate ester","Acta Crystallographica Section E","2005","61","11","o3576","o3578","10.1107/S1600536805031673","","","1.54178","CuKα","","0.0367","0.036","","","0.1018","0.1027","","","","","","1.078","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200006","8.0749","0.0014","19.795","0.003","10.1321","0.0017","90","","98.28","0.002","90","","1602.7","0.5","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Z)-3-(2,6-Dichlorophenyl)-1-(pyridin-3-yl)-2-(1H-1,2,4-triazol-1-yl)prop- 2-en-1-one","","- C16 H10 Cl2 N4 O -","- C16 H10 Cl2 N4 O -","- C64 H40 Cl8 N16 O4 -","4","1","AT6036","Liu, Jian-Bing; Dai, Hong; Tao, Wei-Feng; Jin, Zhong; Fang, Jian-Xin","(<i>Z</i>)-3-(2,6-Dichlorophenyl)-1-(pyridin-3-yl)-2-(1<i>H</i>-1,2,4-triazol-1-yl)prop-2-en-1-one","Acta Crystallographica Section E","2005","61","11","o3599","o3601","10.1107/S1600536805031454","","","0.71073","MoKα","","0.0407","0.0314","","","0.0828","0.0868","","","","","","1.083","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200007","5.3054","0.0012","7.8287","0.0019","19.88","0.005","86.953","0.004","87.262","0.004","74.451","0.004","793.9","0.3","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","N-(2-Hydroxyethyl)pyrazine-2-carboxamide","","- C7 H9 N3 O2 -","- C7 H9 N3 O2 -","- C28 H36 N12 O8 -","4","2","AT6037","Zhang, Ming-Hua; Zheng, Shu-Ling; Zhou, Jian; Liu, Shang-Yuan; Zhao, Zeng-Guo","<i>N</i>-(2-Hydroxyethyl)pyrazine-2-carboxamide","Acta Crystallographica Section E","2005","61","11","o3568","o3570","10.1107/S1600536805031326","","","0.71073","MoKα","","0.094","0.049","","","0.116","0.134","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200008","6.9055","0.0014","7.0086","0.0014","10.074","0.002","71.62","0.03","76.09","0.03","71.93","0.03","434.34","0.18","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","3-Hydroxypyridinium-1-acetate dihydrate","","- C7 H11 N O5 -","- C7 H11 N O5 -","- C14 H22 N2 O10 -","2","1","AT6038","Zhu-Yan Zhang; Li-Hua Huo; Shan Gao; Jing-Gui Zhao","3-Hydroxypyridinium-1-acetate dihydrate","Acta Crystallographica Section E","2005","61","11","o3589","o3591","10.1107/S1600536805031442","","","0.71073","MoKα","","0.0518","0.0402","","","0.1066","0.1128","","","","","","1.093","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200009","5.2027","0.0002","17.8203","0.0007","19.0427","0.0007","90","","90","","90","","1765.52","0.12","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","catena-Poly[[aqua(2,2'-bipyridine)manganese(II)]-μ~2~-5-nitrobenzene- 1,3-dicarboxylato-κ^3^O:O',O'']","","- C18 H13 Mn N3 O7 -","- C18 H13 Mn N3 O7 -","- C72 H52 Mn4 N12 O28 -","4","1","AT6039","Xie, Gang; Zeng, Ming-Hua; Chen, San-Ping; Gao, Sheng-Li","<i>catena</i>-Poly[[aqua(2,2'-bipyridine)manganese(II)]-μ~2~-5-nitrobenzene-1,3-dicarboxylato-κ^3^<i>O</i>:<i>O</i>',<i>O</i>'']","Acta Crystallographica Section E","2005","61","11","m2273","m2275","10.1107/S1600536805031892","","","0.71073","MoKα","","0.0702","0.0451","","","0.0999","0.1133","","","","","","1.004","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200010","12.932","0.006","7.532","0.003","24.322","0.011","90","","101.236","0.009","90","","2323.6","1.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-Acetyl-4-methyl-2-phenylamino-1,3-thiazole","","- C12 H12 N2 O S -","- C12 H12 N2 O S -","- C96 H96 N16 O8 S8 -","8","2","AT6042","Kasim, Noor Azilah M.; Yamin, Bohari M.","5-Acetyl-4-methyl-2-phenylamino-1,3-thiazole","Acta Crystallographica Section E","2005","61","11","o3794","o3795","10.1107/S160053680503326X","","","0.71073","MoKα","","0.098","0.055","","","0.111","0.125","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200011","9.1978","0.0011","22.423","0.003","14.8597","0.0018","90","","103.287","0.002","90","","2982.7","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Triaqua(2,2'-bipyridine)copper(II) 7-oxadibenzofluorene-3,11-disulfonate dihydrate","","- C30 H28 Cu N2 O12 S2 -","- C30 H28 Cu N2 O12 S2 -","- C120 H112 Cu4 N8 O48 S8 -","4","1","BD6010","Guo, Li-Rong; Jiang, Long; Tan, Min-Yu","Triaqua(2,2'-bipyridine)copper(II) 7-oxadibenzofluorene-3,11-disulfonate dihydrate","Acta Crystallographica Section E","2005","61","11","m2259","m2261","10.1107/S1600536805031855","","","0.71073","MoKα","","0.0802","0.0474","","","0.1167","0.1381","","","","","","1.021","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200012","7.3671","0.0017","6.02","0.002","13.689","0.003","90","","105.551","0.012","90","","584.9","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","L-Tyrosinamide hydrochloride monohydrate","1-carbamoyl-2-(4-hydroxyphenyl)ethylammonium chloride monohydrate","","- C9 H15 Cl N2 O3 -","- C9 H15 Cl N2 O3 -","- C18 H30 Cl2 N4 O6 -","2","1","BH6029","Kolev, Tsonko; Spiteller, Michael; Sheldrick, William S.; Mayer-Figge, Heike; van Almsick, Tobias","<small>L</small>-Tyrosinamide hydrochloride monohydrate","Acta Crystallographica Section E","2005","61","11","o3819","o3821","10.1107/S1600536805033131","","","0.71073","MoKα","","0.0342","0.0292","","","0.076","0.0786","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200013","5.8623","0.0008","8.1322","0.001","30.674","0.004","90","","91.45","0.002","90","","1461.9","0.3","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(S)-2-[(1-benzyl-2-hydroxyethylimino)methyl]-4-nitrophenol","","- C16 H16 N2 O4 -","- C16 H16 N2 O4 -","- C64 H64 N8 O16 -","4","2","BH6033","Pradeep, Chullikkattil P.","Intramolecular hydrogen transfer in (<i>S</i>)-2-[(1-benzyl-2-hydroxyethylimino)methyl]-4-nitrophenol, a new chiral Schiff base","Acta Crystallographica Section E","2005","61","11","o3825","o3827","10.1107/S1600536805033581","","","0.71073","MoKα","","0.053","0.0414","","","0.1014","0.1081","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200014","14.565","0.003","16.839","0.003","20.092","0.004","90","","110.47","0.03","90","","4616.6","1.8","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","mer-Tris(isothiocyanato)tris(ethyldiphenylphosphine oxide)iron(III)","","- C45 H45 Fe N3 O3 P3 S3 -","- C45 H45 Fe N3 O3 P3 S3 -","- C180 H180 Fe4 N12 O12 P12 S12 -","4","1","BH6034","Olejnik, Zofia; Lis, Tadeusz; Ondrejkovičová, Iveta; Malo, Jozef; Galková, Sylvia","<i>mer</i>-Tris(ethyldiphenylphosphine oxide)tris(isothiocyanato)iron(III)","Acta Crystallographica Section E","2005","61","11","m2314","m2316","10.1107/S1600536805032319","","","0.71073","MoKα","","0.0884","0.047","","","0.1003","0.1139","","","","","","1.011","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200015","6.628","0.001","10.218","0.001","19.889","0.001","90","","90","","90","","1347","0.3","293","2","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H22 O -","- C15 H22 O -","- C60 H88 O4 -","4","1","BT6000","Yokochi, Alex F. T.; White, James D.; Sturtz, George","Vulgarone B","Acta Crystallographica Section E","2001","57","1","o99","o101","10.1107/S1600536800020079","","","1.54178","CuKα","","0.056","0.05","","","","0.132","","","","","","1.069","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200016","5.807","0.0012","8.097","0.0016","18.513","0.004","90","","98.35","0.03","90","","861.2","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N-Ethylenebis(p-toluenesulfonamide)","","- C16 H20 N2 O4 S2 -","- C16 H20 N2 O4 S2 -","- C32 H40 N4 O8 S4 -","2","0.5","BT6001","Gajadhar-Plummer, Alison S.; Kahwa, Ishenkumba A.; Mague, Joel T.","<i>N</i>,<i>N</i>'-Ethylenebis(<i>p</i>-toluenesulfonamide)","Acta Crystallographica Section E","2001","57","1","o68","o69","10.1107/S1600536800020298","","","0.71073","MoKα","","0.055","0.036","","","","0.11","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200017","18.2451","0.0016","18.2451","0.0016","10.6667","0.0008","90","","90","","90","","3550.8","0.5","240","","240","","","","","","","","","3","I 41/a :1","I 4bw -1bw","88","","","","- C8 H14 N2 -","- C8 H14 N2 -","- C128 H224 N32 -","16","1","CF6000","Foces-Foces, Concepción; Trofimenko, Swiatoslaw","5-<i>tert</i>-Butyl-3-methyl-1<i>H</i>-pyrazole at 240K","Acta Crystallographica Section E","2001","57","1","o32","o34","10.1107/S1600536800018511","","","1.54178","CuKα","","0.109","0.088","","0.138","","0.117","","","0.982","","","0.989","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200018","11.148","0.003","5.822","0.002","10.813","0.004","90","","110.39","0.02","90","","657.8","0.4","173","1","173","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","dl-homoproline, dl-pipecolic acid","","","- C6 H11 N O2 -","- C6 H11 N O2 -","- C24 H44 N4 O8 -","4","1","CF6001","Stapleton, Clynton P. D.; Tiekink, Edward R. T.","<small>DL</small>-Piperidine-2-carboxylic acid","Acta Crystallographica Section E","2001","57","1","o75","o76","10.1107/S1600536800020092","","","0.71069","MoKα","","0.05","0.035","","","","0.128","","","","","","0.98","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200019","11.609","0.005","18.907","0.005","9.878","0.005","90","","95.462","0.005","90","","2158.3","1.5","296","2","296","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C54 H56 N4 -","- C54 H56 N4 -","- C108 H112 N8 -","2","0.5","CF6002","Kubo, Kanji; Yamamoto, Emi; Sakurai, Tadamitsu; Mori, Akira","<i>N,N</i>',<i>N</i>'',<i>N</i>'''-Tetrakis(1-naphthylmethyl)-1,4,8,11-tetraazacyclotetradecane","Acta Crystallographica Section E","2001","57","1","o1","o3","10.1107/S1600536800017323","","","0.71073","MoKα","","0.29","0.052","","","","0.163","","","","","","0.87","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200020","6.648","0.004","5.119","0.0009","13.124","0.005","90","","99.36","0.02","90","","440.7","0.3","100","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Azidoacetamide","","- C2 H4 N4 O -","- C2 H4 N4 O -","- C8 H16 N16 O4 -","4","1","CF6003","Kumasaki, Mieko; Kinbara, Kazushi; Wada, Yuji; Arai, Mitsuru; Tamura, Masamitsu","Azidoacetamide, a neutral small organic azide","Acta Crystallographica Section E","2001","57","1","o6","o8","10.1107/S160053680001850X","","","0.71073","MoKα","","","0.05","","","","0.095","","","","","","1.14","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200021","7.9964","0.001","18.6031","0.001","10.9254","0.001","90","","101.274","0.005","90","","1593.9","0.3","293","2","293","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","6,7-dimethyl-3a,8a-dihydro-3H-8-oxa-cyclopenta[a]inden-5-yl benzoate","","- C20 H18 O3 -","- C20 H18 O3 -","- C80 H72 O12 -","4","1","CF6004","Czugler, Mátyás; Bombicz, Petra","6,7-Dimethyl-3a,8a-dihydro-3<i>H</i>-8-oxacyclopenta[<i>a</i>]inden-5-yl benzoate","Acta Crystallographica Section E","2001","57","1","o37","o38","10.1107/S1600536800018821","","","0.7107","MoKα","","0.131","0.052","","","","0.158","","","","","","0.97","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200022","10.1202","0.0003","9.9645","0.0003","13.8592","0.0005","90","","110.774","0.0011","90","","1306.73","0.07","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","8-(2-Phenylethylamino)quinoline","","- C17 H16 N2 -","- C17 H16 N2 -","- C68 H64 N8 -","4","1","CF6005","Lynch, Daniel E.; McClenaghan, Ian","8-(2-Phenylethylamino)quinoline","Acta Crystallographica Section E","2001","57","1","o4","o5","10.1107/S1600536800017864","","","0.71073","MoKα","","0.076","0.046","","","","0.126","","","","","","1.032","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200023","20.281","0.003","8.925","0.002","6.053","0.001","90","","93.112","0.012","90","","1094","0.3","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","oxazolidine disulfide","R,R-(+)-Bis[(3-benzyloxazolan-4-yl)methyl] disulfide","","- C22 H28 N2 O2 S2 -","- C22 H28 N2 O2 S2 -","- C44 H56 N4 O4 S4 -","2","0.5","CF6006","Schulz Lang, Ernesto; Burrow, Robert A.; Braga, Antonio Luiz; Appelt, Helmoz Roseniaim; Schneider, Paulo Henrique; Silveira, Claudio Cruz; Wessjohann, Ludger A.","<i>R</i>,<i>R</i>-(+)-Bis[(3-benzyloxazolan-4-yl)methyl] disulfide","Acta Crystallographica Section E","2001","57","1","o41","o42","10.1107/S160053680001878X","","","0.71073","MoKα","","0.066","0.034","","","","0.087","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200024","17.0355","0.0009","17.0355","0.0009","12.3934","0.0005","90","","90","","120","","3114.8","0.3","298","2","298","2","","","","","","","","4","R -3 :H","-R 3","148","","aqua(malonato)cadmium(II) hydrate","","- C3 H6 Cd O6 -","- C3 H6 Cd O6 -","- C54 H108 Cd18 O108 -","18","1","CF6007","Naumov, Pancě; Ristova, Mirjana; Sǒptrajanov, Bojan; Kim, Moon-Jib; Lee, Han-Jun; Ng, Seik Weng","A rhombohedral polymorph of aqua(malonato)cadmium(II) hydrate","Acta Crystallographica Section E","2001","57","1","m14","m16","10.1107/S1600536800018833","","","0.71073","MoKα","","0.034","0.03","","","","0.088","","","","","","1.15","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200025","17.473","0.005","5.916","0.002","10.346","0.003","90","","118.69","0.02","90","","938.2","0.5","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Bis(2-hydroxyethylammonium) oxalate","","- C6 H16 N2 O6 -","- C6 H16 N2 O6 -","- C24 H64 N8 O24 -","4","0.5","CF6008","Jordanovska, Vera; Naumov, Pancě; Kim, Moon-Jib; Lee, Han-Jun; Ng, Seik Weng","Bis(2-hydroxyethylammonium) oxalate","Acta Crystallographica Section E","2001","57","1","o45","o47","10.1107/S160053680001881X","","","0.71073","MoKα","","0.089","0.041","","","","0.114","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200027","7.3171","0.0003","10.6462","0.0006","21.0401","0.0014","90","","90","","90","","1639.01","0.16","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","9β,11β-Epoxy-3β-hydroxy-5α-androstan-17-one","","- C19 H28 O3 -","- C19 H28 O3 -","- C76 H112 O12 -","4","1","CF6010","Novoa de Armas, Héctor; Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J.; Ruíz Garcia, José A.; Reyes Moreno, Mayra; Alvarez Ginarte, Yoanna M.","9β,11β-Epoxy-3β-hydroxy-5α-androstan-17-one","Acta Crystallographica Section E","2001","57","1","o39","o40","10.1107/S1600536800018845","","","1.5418","CuKα","","0.037","0.036","","","","0.103","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200028","8.061","0.002","12.449","0.003","11.132","0.003","90","","109.73","0.01","90","","1051.5","0.5","168","2","168","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H9 N O2 -","- C14 H9 N O2 -","- C56 H36 N4 O8 -","4","1","CF6012","Taylor, Max R.; Thompson, Malcolm J.","4-Nitrophenanthrene","Acta Crystallographica Section E","2001","57","1","o9","o10","10.1107/S1600536800018766","","","0.71073","MoKα","","0.058","0.049","","0.12","","0.11","","","1.03","","","0.99","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200029","14.88","0.002","4.6251","0.0005","20.043","0.003","90","","100.963","0.019","90","","1354.2","0.3","180","2","180","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1-[(2-phenyl-1,3-oxazol-4-yl)methyl]-1H-1,2,3-benzotriazole","","- C16 H12 N4 O -","- C16 H12 N4 O -","- C64 H48 N16 O4 -","4","2","CF6013","Swaleh, Sauda, M.; Ziemer, Burkhard","2-[(2-Phenyl-1,3-oxazol-4-yl)methyl]-2<i>H</i>-1,2,3-benzotriazole","Acta Crystallographica Section E","2001","57","1","o35","o36","10.1107/S1600536800018808","","","0.71073","MoKα","","0.061","0.04","","","","0.082","","","","","","0.95","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200030","13.299","0.003","19.82","0.001","6.6531","0.0007","90","","90","","90","","1753.7","0.4","297","1","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C10 H24 Cl Co N6 O8 -","- C10 H24 Cl Co N6 O8 -","- C40 H96 Cl4 Co4 N24 O32 -","4","1","CF6015","Ohba, Shigeru; Yamada, Naoki; Eishima, Makoto","<i>trans</i>-Dinitro(1,4,8,11-tetraazacyclotetradecane-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')cobalt(III) perchlorate","Acta Crystallographica Section E","2001","57","1","m12","m13","10.1107/S1600536800018778","","","0.71073","MoKα","","","0.035","","","","0.108","","","","","","1.08","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200031","11.05","0.002","18.964","0.004","8.1307","0.0016","90","","108.87","0.03","90","","1612.2","0.6","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-Amino-6-imidium-1,3,5-dithiazol-4-ene iodide","","- C3 H6 I N3 S2 -","- C3 H6 I N3 S2 -","- C24 H48 I8 N24 S16 -","8","1","CF6017","Lynch, Daniel E.; McClenaghan, Ian","6-Amino-4-iminio-4<i>H</i>-1,3,5-dithiazole iodide","Acta Crystallographica Section E","2001","57","1","o70","o71","10.1107/S160053680002047X","","","0.71073","MoKα","","0.046","0.044","","","","0.109","","","","","","1.05","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200032","15.9111","0.0006","5.0374","0.0002","17.1233","0.0009","90","","113.933","0.0017","90","","1254.44","0.1","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","11H-Pyridinium[2,3h]-7,8,9,10-tetrahydrocarbazole chloride","","- C15 H15 Cl N2 -","- C15 H15 Cl N2 -","- C60 H60 Cl4 N8 -","4","1","CF6018","Lynch, Daniel E.; McClenaghan, Ian","7,8,9,10-Tetrahydro-11<i>H</i>-pyrido[2,3-<i>a</i>]carbazol-1-ium chloride","Acta Crystallographica Section E","2001","57","1","o43","o44","10.1107/S1600536800019644","","","0.71073","MoKα","","0.102","0.048","","","","0.105","","","","","","0.99","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200033","7.1704","0.0003","6.6685","0.0006","7.4937","0.0006","90","","99.555","0.005","90","","353.35","0.05","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","3-carboxypyridinium chloride","3-carboxypyridinium chloride","","- C6 H6 Cl N O2 -","- C6 H6 Cl N O2 -","- C12 H12 Cl2 N2 O4 -","2","0.5","CF6022","Slouf, Miroslav","3-Carboxypyridinium chloride","Acta Crystallographica Section E","2001","57","1","o61","o62","10.1107/S1600536800019632","","","0.7107","MoKα","","0.036","0.031","","","","0.077","","","","","","1.11","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200034","8.405","0.002","10.2633","0.0014","15.9652","0.0015","90","","90","","90","","1377.2","0.4","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","[N-(2-Aminoethyl)-N,N-bis(3-aminopropyl)amine]dichlorocobalt(III) chloride","","- C8 H22 Cl3 Co N4 -","- C8 H22 Cl3 Co N4 -","- C32 H88 Cl12 Co4 N16 -","4","1","CF6023","Fanshawe, Rachel L.; Clark, Charles R.; Blackman, Allan G.","[<i>N</i>-(2-Aminoethyl)-<i>N</i>,<i>N</i>-bis(3-aminopropyl)amine]dichlorocobalt(III) chloride, [Co(abap)Cl~2~]Cl","Acta Crystallographica Section E","2001","57","1","m17","m18","10.1107/S1600536800019656","","","0.71073","MoKα","","0.025","0.023","","","","0.051","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200035","15.787","0.003","14.359","0.003","9.163","0.0015","90","","111.59","0.02","90","","1931.4","0.7","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","{2,2'-[1,2-Phenylenebis(nitrilomethylidyne)]diphenolato}copper(II) dichloromethane solvate","","- C21 H16 Cl2 Cu N2 O2 -","- C21 H16 Cl2 Cu N2 O2 -","- C84 H64 Cl8 Cu4 N8 O8 -","4","1","CF6024","Baggio, Ricardo; Garland, Maria Teresa; Atria, Ana María; Hidalgo, Oscar; Solezi, Santiago","{2,2'-[1,2-Phenylenebis(nitrilomethylidyne)]diphenolato}copper(II) dichloromethane solvate","Acta Crystallographica Section E","2001","57","1","m19","m20","10.1107/S1600536800019668","","","0.71073","MoKα","","0.074","0.048","","","","0.108","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200036","10.287","0.0014","10.729","0.002","13.1233","0.0013","90","","112.423","0.013","90","","1338.9","0.4","150","2","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C13 H19 N O4 -","- C13 H19 N O4 -","- C52 H76 N4 O16 -","4","1","CF6025","Coles, Simon J.; Hibbs, David E.; Hursthouse, Michael B","5-<i>tert</i>-Butylperoxy-5-(oxiran-2-yl)-1-(prop-2-ynyl)pyrrolidin-2-one","Acta Crystallographica Section E","2001","57","1","o66","o67","10.1107/S1600536800020018","","","0.71069","MoKα","","","0.04","","","","0.096","","","","","","0.91","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200037","6.887","0.001","18.847","0.003","14.947","0.003","90","","105.08","0.01","90","","1873.3","0.6","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H14 Cl3 N3 -","- C20 H14 Cl3 N3 -","- C80 H56 Cl12 N12 -","4","1","CF6026","Camalli, Mercedes; Pifferi, Augusto; Costi, Roberta; Di Santo, Roberto; Massa, Silvio; Artico, Marino","1-{[4-(4-Chlorophenyl)-1<i>H</i>-pyrrol-3-yl](2,4-dichlorophenyl)methyl}-1<i>H</i>-imidazole (RDS 416)","Acta Crystallographica Section E","2001","57","1","o96","o98","10.1107/S1600536800020699","","","0.71069","MoKα","","0.041","0.041","","0.056","","0.056","","","0.9","","","0.9","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200038","12.3112","0.001","6.8401","0.0005","13.1658","0.001","90","","116.507","0.002","90","","992.14","0.13","295","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2-Naphthyloxyacetic acid","2-Naphthalenyloxyethanoic acid","","- C12 H10 O3 -","- C12 H10 O3 -","- C48 H40 O12 -","4","1","CF6027","Howie, R. Alan; Skakle, Janet M. S.; Wardell, Solange M. S. V.","Redetermination of 2-(naphthalen-2-yloxy)ethanoic acid","Acta Crystallographica Section E","2001","57","1","o72","o74","10.1107/S1600536800020080","","","0.71073","MoKα","","0.131","0.049","","","","0.126","","","","","","0.82","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200039","8.857","0.003","17.813","0.011","24.085","0.003","90","","90","","90","","3800","3","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","6,6'-Di(isobutanoato)-2,2',3,3',4,4'-hexaacetato-α,α-trehalose monohydrate","","- C32 H47.4 O19.7 -","- C32 H47.404 O19.702 -","- C128 H189.616 O78.808 -","4","1","CF6028","Clow, Simon M.; Cox, Philip J.; Gilmore, Graham I.; Wardell, James L.","2,2',3,3',4,4'-Hexaacetato-6,6'-bis(isobutanoyl)-α,α-trehalose 0.7-hydrate","Acta Crystallographica Section E","2001","57","1","o77","o78","10.1107/S1600536800020705","","","0.71073","MoKα","","0.243","0.04","","","","0.1","","","","","","0.39","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2200040","7.2926","0.0002","9.3642","0.0003","13.1208","0.0005","90","","90","","90","","896.01","0.05","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Thiazolidine-2,4-dione","","- C3 H3 N O2 S -","- C3 H3 N O2 S -","- C24 H24 N8 O16 S8 -","8","1","CF6032","Lynch, Daniel E.; McClenaghan, Ian; Light, Mark E.","Redetermination of 1,3-thiazolidine-2,4-dione","Acta Crystallographica Section E","2001","57","1","o79","o80","10.1107/S1600536800020717","","","0.71073","MoKα","","0.035","0.031","","","","0.083","","","","","","1.09","","","","has coordinates,has disorder,has Fobs","194444","2020-10-21","18:00:00",""
"2200041","4.8724","0.0003","15.2803","0.0009","10.694","0.0007","90","","101.84","0.003","90","","779.25","0.08","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","Moschamindole","{2-(3-methoxy-4-hydroxyphenyl)}-dihydrofuro[kl]-1H- pyrrolo[fg]-2-oxo-1,2,3,4,5,6-hexahydro-3-benzazocine","","- C20 H18 N2 O4 -","- C20 H18 N2 O4 -","- C40 H36 N4 O8 -","2","1","CF6033","Cox, Philip J.; Fergusson, Margot; Nahar, Lutfun; Sarker, Satyajit D.","Moschamindole","Acta Crystallographica Section E","2001","57","1","o81","o82","10.1107/S1600536800020730","","","0.71073","MoKα","","0.088","0.046","","","","0.097","","","","","","0.99","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200042","10.6185","0.0004","7.1517","0.0004","11.3701","0.0005","90","","111.523","0.003","90","","803.24","0.07","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-Methoxy-3-nitropyridinium chloride","","- C6 H7 Cl N2 O3 -","- C6 H7 Cl N2 O3 -","- C24 H28 Cl4 N8 O12 -","4","1","CF6034","Lynch, Daniel E.; McClenaghan, Ian","4-Methoxy-3-nitropyridinium chloride","Acta Crystallographica Section E","2001","57","1","o83","o84","10.1107/S1600536800020729","","","0.71073","MoKα","","0.078","0.043","","","","0.121","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200043","28.4777","0.0013","8.602","0.0003","14.2055","0.0005","90","","102.562","0.0013","90","","3396.5","0.2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Amino-4,6-bis(4-chlorophenylthio)pyrimidine","","- C32 H22 Cl4 N6 S4 -","- C32 H22 Cl4 N6 S4 -","- C128 H88 Cl16 N24 S16 -","4","1","NA6000","Lynch, Daniel E.; McClenaghan, Ian","2-Amino-4,6-bis(4-chlorophenylthio)pyrimidine","Acta Crystallographica Section E","2001","57","1","o11","o12","10.1107/S160053680001761X","","","0.71073","MoKα","","0.119","0.056","","","","0.148","","","","","","0.965","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200044","7.4145","0.0012","8.145","0.002","10.299","0.003","98.95","0.02","105.103","0.018","108.424","0.017","550.2","0.3","100","","100","","","","","","","","","4","P -1","-P 1","2","N,N'-diacetyl-1,13-diaza-24-crown-8","N,N'-Diacetyl-1,4,7,13,16,19-hexaoxa-10,22-diazacyclotetracosane","","- C20 H38 N2 O8 -","- C20 H38 N2 O8 -","- C20 H38 N2 O8 -","1","0.5","NA6001","Bryan, Jeffrey C.; Marchand, Alan P.; Hazlewood, Anna","<i>N</i>,<i>N</i>'-Diacetyl-1,13-diaza-24-crown-8","Acta Crystallographica Section E","2001","57","1","o13","o15","10.1107/S1600536800017852","","","0.71073","MoKα","","0.037","0.032","","","","0.087","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200045","16.397","0.003","10.819","0.002","7.6737","0.0015","90","","90","","90","","1361.3","0.4","150","2","150","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","8-(Isoindol-1,3-dione-2-yl)aminoquinoline","","- C17 H11 N3 O2 -","- C17 H11 N3 O2 -","- C68 H44 N12 O8 -","4","1","NA6002","Lynch, Daniel E.; McClenaghan, Ian","<i>N</i>-(8-Quinolylamino)phthalimide","Acta Crystallographica Section E","2001","57","1","o16","o17","10.1107/S1600536800018109","","","0.71073","MoKα","","0.066","0.048","","","","0.099","","","","","","1.184","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200046","8.0995","0.0005","11.7771","0.0004","24.3528","0.0016","90","","99.473","0.003","90","","2291.3","0.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Dibromo Zinc(tmeda)","Dibromo(N,N,N',N'-tetramethylethane-1,2-diamine)zinc(II)","","- C6 H16 Br2 N2 Zn -","- C6 H16 Br2 N2 Zn -","- C48 H128 Br16 N16 Zn8 -","8","2","NA6003","Citeau, Helene; Conrad, Olaf; Giolando, Dean M.","Dibromo(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethane-1,2-diamine)zinc(II)","Acta Crystallographica Section E","2001","57","1","m5","m6","10.1107/S1600536800018201","","","0.71073","MoKα","","0.08","0.045","","","","0.112","","","","","","0.981","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200047","7.4228","0.0002","10.146","0.0001","11.3559","0.0003","102.474","0.001","90.989","0.002","98.544","0.002","824.7","0.03","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","1-[4-(3,5-Dimethoxy-2-methylphenoxy)-2,6-dihydroxy-3-methylphenyl]ethanone","","- C18 H20 O6 -","- C18 H20 O6 -","- C36 H40 O12 -","2","1","NA6004","Karalai, Chatchanok; Saewon, Nisakorn; Chantrapromma, Kan; Chantrapromma, Suchada; Fun, Hoong-Kun; Razak, Ibrahim Abdul","1-[4-(3,5-Dimethoxy-2-methylphenoxy)-2,6-dihydroxy-3-methylphenyl]ethanone","Acta Crystallographica Section E","2001","57","1","o18","o19","10.1107/S1600536800018213","","","0.71073","MoKα","","0.115","0.084","","","","0.228","","","","","","1.006","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200048","10.796","0.0005","18.1687","0.0008","20.1886","0.001","90","","90","","90","","3960","0.3","200","3","200","3","","","","","","","","3","P b c a","-P 2ac 2ab","61","P2 I5 GaI4","1,1,1,2,2-Pentaiododiphosphanium tetraiodogallate(III)","","- Ga I9 P2 -","- Ga I9 P2 -","- Ga8 I72 P16 -","8","1","NA6005","Aubauer, Christoph; Klapötke, Thomas M.; Mayer, Peter","1,1,1,2,2-Pentaiododiphosphanium tetraiodogallate(III)","Acta Crystallographica Section E","2001","57","1","i1","i2","10.1107/S1600536800018419","","","0.71073","MoKα","","0.036","0.027","","","","0.076","","","","","","0.963","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200049","14.132","0.004","14.738","0.006","17.031","0.004","65.79","0.03","88.1","0.03","67.88","0.03","2966","2","193","","193","","","","","","","","","5","P -1","-P 1","2","Bis[1,2-bis(diphenylphosphino)ethane-P,P'](dithioformato-S,S')technetium tris(benzene) solvate","","","- C71 H67 P4 S2 Tc -","- C71 H67 P4 S2 Tc -","- C142 H134 P8 S4 Tc2 -","2","1","NA6006","Bryan, Jeffrey C.; Burrell, Anthony K.; Kubas, Gregory J.","Bis[1,2-bis(diphenylphosphino)ethane-<i>P</i>,<i>P</i>'](dithioformato-<i>S</i>,<i>S</i>')technetium tris(benzene) solvate","Acta Crystallographica Section E","2001","57","1","m1","m2","10.1107/S1600536800017840","","","0.71073","MoKα","","0.066","0.035","","","","0.104","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200050","10.3872","0.001","10.5518","0.0009","12.8953","0.0011","67.185","0.006","72.62","0.009","83.849","0.008","1243.3","0.2","203","","293","","","","","","","","","6","P -1","-P 1","2","chlorobis[1,2-ethanediylbis(diphenylphosphine)-P,P'](thiocarbonyl-C)technetium","","","- C59 H54 Cl P4 S Tc -","- C59 H54 Cl P4 S Tc -","- C59 H54 Cl P4 S Tc -","1","0.5","NA6007","Bryan, Jeffrey C.; Burrell, Anthony K.; Kubas, Gregory J.","[TcCl(CS)(dppe)~2~]·C~6~H~6~","Acta Crystallographica Section E","2001","57","1","m23","m24","10.1107/S1600536800019486","","","0.71073","MoKα","","0.04","0.032","","","","0.098","","","","","","1.24","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200051","13.687","0.002","15.856","0.001","7.7761","0.0009","90","0.007","97.936","0.009","90","0.007","1671.4","0.3","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaqua(1,4,7,10,14-pentaoxacyclopentadecane)manganese(II) dibromide","","- C10 H24 Br2 Mn O7 -","- C10 H24 Br2 Mn O7 -","- C40 H96 Br8 Mn4 O28 -","4","0.5","NA6008","Reid, Howard O. N.; Kahwa, Ishenkumba A.; Mague, Joel T.; McPherson, Gary L.","A linear supramolecular array of {[Mn(H~2~O)~2~(15-crown-5)]Br~2~}~<i>n~</i>","Acta Crystallographica Section E","2001","57","1","m3","m4","10.1107/S1600536800018110","","","0.71073","MoKα","","0.04","0.024","","","","0.086","","","","","","1.279","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2200052","10.3529","0.0001","16.1128","0.0001","15.04","0.0001","90","","107.025","0.001","90","","2398.94","0.03","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[(1RS,4RS)-5,5,7,13,15,15-Hexamethyl-1,4,8,12-tetraazacyclopentadeca- 7,12-diene-N^1^,N^4^,N^8^,N^12^]nickel(II) diperchlorate","","- C17 H34 Cl2 N4 Ni O8 -","- C17 H34 Cl2 N4 Ni O8 -","- C68 H136 Cl8 N16 Ni4 O32 -","4","1","NA6009","Curtis, Neil F.; Waters, Joyce M.; Rickard, Clifton E.","[(1<i>RS</i>,4<i>RS</i>)-5,5,7,13,15,15-Hexamethyl-1,4,8,12-tetraazacyclopentadeca-7,12-diene-<i>N</i>^1^,<i>N</i>^4^,<i>N</i>^8^,<i>N</i>^12^]nickel(II) diperchlorate","Acta Crystallographica Section E","2001","57","1","m48","m50","10.1107/S1600536800020559","","","0.71073","MoKα","","0.051","0.042","","0.112","","0.105","","","1.044","","","1.058","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2200054","4.797","0.001","11.886","0.002","23.775","0.005","90","","90","","90","","1355.6","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2R,3S,4S,5R)-4-Hydroxy-3-iodo-5-methyltetrahydro-2-furylmethyl benzoate","","- C13 H15 I O4 -","- C13 H15 I O4 -","- C52 H60 I4 O16 -","4","1","NA6012","Bew, Sean P.; Light, Mark E.; Hursthouse, Michael B.; Knight, David W.; Middleton, Robert J.","(2<i>R</i>,3<i>S</i>,4<i>S</i>,5<i>R</i>)-4-Hydroxy-3-iodo-5-methyltetrahydro-2-furylmethyl benzoate","Acta Crystallographica Section E","2001","57","1","o58","o60","10.1107/S1600536800018614","","","0.71073","MoKα","","","0.027","","","","0.063","","","","","","1.049","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200055","21.825","0.003","12.384","0.001","8.048","0.001","90","","90","","90","","2175.2","0.4","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Ethylenediammonium phthalate","","- C10 H14 N2 O4 -","- C10 H14 N2 O4 -","- C80 H112 N16 O32 -","8","1","NA6013","Edwards, Selvin H.; Kahwa, Ishenkumba A.; Mague, Joel T.","Ethylenediammonium phthalate","Acta Crystallographica Section E","2001","57","1","o20","o21","10.1107/S1600536800018420","","","0.71073","MoKα","","0.108","0.039","","","","0.108","","","","","","1.012","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200056","11.7634","0.0008","11.025","0.001","12.0322","0.0007","90","","115.378","0.001","90","","1409.89","0.18","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Diethylenetriamine dihdrophthalate","","- C12 H19 N3 O4 -","- C12 H19 N3 O4 -","- C48 H76 N12 O16 -","4","1","NA6014","Edwards, Selvin H.; Kahwa, Ishenkumba A.; Mague, Joel T.","2,2'-Iminobis(ethylammonium) phthalate","Acta Crystallographica Section E","2001","57","1","o22","o23","10.1107/S1600536800018432","","","0.71073","MoKα","","0.105","0.04","","","","0.119","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200057","11.7629","0.0002","34.5731","0.0006","5.3477","0.0002","90","","90","","90","","2174.8","0.1","120","","120","","","","","","","","","5","P 21 21 2","P 2 2ab","18","","N^α^(2-nitrobenzenesulfonyl)-N^ε^-benzyloxycarbonyl-L-lysine","","- C20 H23 N3 O8 S -","- C20 H23 N3 O8 S -","- C80 H92 N12 O32 S4 -","4","1","NA6015","Giraldés, José; McLaughlin, Mark L.; Fronczek, Frank R.","<i>N</i>^{ε^}-Benzyloxycarbonyl-<i>N</i>^{α^}-(2-nitrobenzenesulfonyl)-<small>L</small>-lysine","Acta Crystallographica Section E","2001","57","1","o48","o49","10.1107/S1600536800018961","","","0.71073","MoKα","","0.058","0.039","","","","0.077","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200058","7.492","0.002","7.797","0.002","19.877","0.005","90","","94.962","0.005","90","","1156.8","0.5","298","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-methylthio-N-(2-chlorophenyl)triazine-2-amine","","- C10 H9 Cl N4 S -","- C10 H9 Cl N4 S -","- C40 H36 Cl4 N16 S4 -","4","1","NA6016","Chen, Wei-Qiang; Weng, Lin-Hong; Jin, Gui-Yu","2-(2-Chlorophenylamino)-4-methylsulfanyl-1,3,5-triazine","Acta Crystallographica Section E","2001","57","1","o91","o93","10.1107/S1600536800020237","","","0.71073","MoKα","","","0.031","","","","0.096","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200059","9.3236","0.0005","14.5789","0.0014","13.6184","0.0006","90","","95.361","0.004","90","","1843","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tris(nitrato)(1,4,7,10,13-pentaoxacyclopentadecane)praseodymium(III)","","- C10 H20 N3 O14 Pr -","- C10 H20 N3 O14 Pr -","- C40 H80 N12 O56 Pr4 -","4","1","NA6017","McIntosh, Nadine N.; Kahwa, Ishenkumba A.; Mague, Joel T.","Rare earth crown ether complexes: (15-crown-5)tris(nitrato)praseodymium(III)","Acta Crystallographica Section E","2001","57","1","m21","m22","10.1107/S1600536800019036","","","0.71073","MoKα","","0.045","0.027","","","","0.075","","","","","","1.043","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200060","10.471","0.0004","9.37","0.0003","12.35","0.0004","90","","90","","90","","1211.7","0.07","150","","110","","","","","","","","","4","P n m a","-P 2ac 2n","62","","3-ethoxycarbonyl- 2,2,5,5-tetramethyl-1H-2,5-dihydropyrrol-1-yloxyl","","- C11 H18 N O3 -","- C11 H18 N O3 -","- C44 H72 N4 O12 -","4","0.5","NA6018","Duskova, Jarmila; Jiri Labsky; Jindrich Hasek; Ivana Cisarova","3-Ethoxycarbonyl-2,2,5,5-tetramethyl-1<i>H</i>-2,5-dihydropyrrol-1-yloxyl","Acta Crystallographica Section E","2001","57","1","o85","o86","10.1107/S1600536800019334","","","0.7107","MoKα","","0.056","0.044","","","","0.152","","","","","","1.215","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200061","6.8351","0.0009","7.6342","0.001","21.422","0.003","90","","96.447","0.003","90","","1110.7","0.3","160","2","160","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-2-(2-phenylethenyl)-1,3,2-benzodioxaborole","","- C14 H11 B O2 -","- C14 H11 B O2 -","- C56 H44 B4 O8 -","4","1","NA6019","Clegg, William; Marder, Todd B.; Scott, Andrew J.; Wiesauer, Christian; Weissensteiner, Walter","A 2-styrylboronate ester","Acta Crystallographica Section E","2001","57","1","o63","o65","10.1107/S1600536800019097","","","0.71073","MoKα","","0.042","0.037","","","","0.095","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200062","16.5665","0.001","16.78","0.0009","25.0342","0.001","90","","90","","90","","6959.2","0.6","293","2","293","2","","","","","","","","6","C m c a","-C 2ac 2","64","none","Tetrakis(hydroxonium) bis(tetrachlorogallate) dichloride cucurbituril decahydrate","","- C36 H68 Cl10 Ga2 N24 O26 -","- C36 H66 Cl10 Ga2 N24 O26 -","- C144 H264 Cl40 Ga8 N96 O104 -","4","","NA6021","Virovets, Alexander V.; Samsonenko, Denis G.; Sokolov, Maxim N.; Fedin, Vladimir P.","Supramolecular adduct of tetrachlorogallate with cucurbituril: (H~7~O~3~)~4~[GaCl~4~]~2~Cl~2~·C~36~H~36~N~24~O~12~·2H~2~O","Acta Crystallographica Section E","2001","57","1","m33","m34","10.1107/S1600536800019498","","","0.71073","MoKα","","0.072","0.051","","","","0.183","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200063","11.464","0.003","14.827","0.002","16.444","0.002","90","","90","","90","","2795.1","0.9","223","2","223","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","boc-Tyr-Tic","boc-tyrosyl-tetrahydroisoquinoline-3-carboxylic acid nitromethane solvate","","- C24.825 H30.475 N2.825 O7.65 -","- C24.825 H30.475 N2.825 O7.65 -","- C99.3 H121.9 N11.3 O30.6 -","4","1","NA6023","Deschamps, Jeffrey R.; Flippen-Anderson, Judith L.; George, Clifford","2-[<i>N</i>-(<i>tert</i>-Butoxycarbonyl)tyrosyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid nitromethane solvate","Acta Crystallographica Section E","2001","57","1","o87","o90","10.1107/S1600536800020109","","","1.54178","CuKα","","0.0794","0.0745","","0.2028","","0.1954","","","1.082","","","1.089","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200064","9.718","0.0002","10.1871","0.0002","11.8751","0.0003","95.586","0.001","92.978","0.001","99.142","0.001","1152.45","0.04","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Di(N-cyclohexyl-N-ethyldithiocarbamato)lead(II)","","- C18 H32 N2 Pb S4 -","- C18 H32 N2 Pb S4 -","- C36 H64 N4 Pb2 S8 -","2","1","NA6024","Baba, Ibrahim; Farina, Yang; Othman, A. Hamid; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Ng, Seik Weng","Bis(<i>N</i>-cyclohexyl-<i>N</i>-ethyldithiocarbamato-<i>S</i>,<i>S</i>')lead(II)","Acta Crystallographica Section E","2001","57","1","m35","m36","10.1107/S1600536800020146","","","0.71073","MoKα","","0.108","0.053","","","","0.146","","","","","","0.991","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200065","9.7249","0.0001","9.7249","0.0001","17.3867","0.0003","90","","90","","90","","1644.32","0.04","298","2","298","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","Tris(dimethyltin sulfide)","","- C6 H18 S3 Sn3 -","- C6 H18 S3 Sn3 -","- C24 H72 S12 Sn12 -","4","0.5","NA6025","Farina, Yang; Baba, Ibrahim; Othman, A. Hamid; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Ng, Seik Weng","Tetragonal modification of 1,1,3,3,5,5-hexamethylcyclo-1,3,5-tristannathiane","Acta Crystallographica Section E","2001","57","1","m37","m38","10.1107/S1600536800020134","","","0.71073","MoKα","","0.055","0.037","","","","0.08","","","","","","0.937","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200066","13.8948","0.0004","13.8948","0.0004","9.4868","0.0003","90","","90","","120","","1586.19","0.08","298","2","298","2","","","","","","","","5","P 63","P 6c","173","","Tris(N-cyclohexyl-N-methyldithiocarbamato)antimony(III)","","- C24 H42 N3 S6 Sb -","- C24 H42 N3 S6 Sb -","- C48 H84 N6 S12 Sb2 -","2","0.333333","NA6026","Baba, Ibrahim; Ibrahim, Sukeria; Farina, Yang; Othman, A. Hamid; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Ng, Seik Weng","Tris(<i>N</i>-cyclohexyl-<i>N</i>-methyldithiocarbamato-<i>S</i>)antimony(III)","Acta Crystallographica Section E","2001","57","1","m39","m40","10.1107/S1600536800020122","","","0.71073","MoKα","","0.035","0.026","","","","0.054","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200067","8.9931","0.0001","12.2068","0.0001","22.6703","0.0003","90","","92.507","0.001","90","","2486.29","0.05","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Diphenylbis[N-(2-hydroxyethyl)-N-methyldithiocarbamato]tin","","- C20 H26 N2 O2 S4 Sn -","- C20 H26 N2 O2 S4 Sn -","- C80 H104 N8 O8 S16 Sn4 -","4","1","NA6027","Farina, Yang; Baba, Ibrahim; Othman, A. Hamid; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Ng, Seik Weng","Bis[<i>N</i>-(2-hydroxyethyl)-<i>N</i>-methyldithiocarbamato-<i>S</i>,<i>S</i>']diphenyltin","Acta Crystallographica Section E","2001","57","1","m41","m42","10.1107/S1600536800020316","","","0.71073","MoKα","","0.089","0.054","","","","0.146","","","","","","0.98","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200068","9.0118","0.0002","12.4051","0.0001","12.6024","0.0002","86.889","0.001","69.575","0.001","88.293","0.001","1318.24","0.04","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Bis[N,N-bis(2-hydroxyethyl)dithiocarbamato-S,S']diphenyltin(IV)","","- C22 H30 N2 O4 S4 Sn -","- C22 H30 N2 O4 S4 Sn -","- C44 H60 N4 O8 S8 Sn2 -","2","1","NA6029","Farina, Yang; Baba, Ibrahim; Othman, A. Hamid; Ibrahim Abdul Razak; Fun, Hoong-Kun; Ng, Seik Weng","Bis[<i>N</i>,<i>N</i>-bis(2-hydroxyethyl)dithiocarbamato-<i>S</i>,<i>S</i>']diphenyltin(IV)","Acta Crystallographica Section E","2001","57","1","m46","m47","10.1107/S1600536800020407","","","0.71073","MoKα","","0.058","0.048","","","","0.112","","","","","","0.98","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200069","10.8646","0.0001","15.0517","0.0001","11.2934","0.0001","90","","101.419","0.001","90","","1810.26","0.03","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(μ-N-ethyl-N-isopropyldithiocarbamato-S:S')- bis[(N-ethyl-N-isopropyldithiocarbamato-S,S')zinc(II)]","","- C24 H48 N4 S8 Zn2 -","- C24 H48 N4 S8 Zn2 -","- C48 H96 N8 S16 Zn4 -","2","0.5","NA6030","Baba, Ibrahim; Farina, Yang; Othman, A. Hamid; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Ng, Seik Weng","Bis(μ-<i>N</i>-ethyl-<i>N</i>-isopropyldithiocarbamato-<i>S</i>:<i>S</i>')bis[(<i>N</i>-ethyl-<i>N</i>-isopropyldithiocarbamato-<i>S</i>,<i>S</i>')zinc(II)]","Acta Crystallographica Section E","2001","57","1","m51","m52","10.1107/S1600536800020390","","","0.71073","MoKα","","0.045","0.038","","","","0.094","","","","","","0.972","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200070","10.77","0.0011","11.1547","0.0011","15.941","0.003","91.088","0.011","102.471","0.011","116.993","0.007","1651.1","0.4","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C42.5 H36 O2 P2 -","- C42.5 H35.5 O2 P2 -","- C85 H71 O4 P4 -","2","1","NA6032","Ellis, Dianne D.; Spek, Anthony L.","[4-(Diphenylphosphino)-9,9-dimethylxanthen-5-yl]diphenylphosphine oxide toluene hemisolvate","Acta Crystallographica Section E","2001","57","1","o94","o95","10.1107/S1600536800020419","","","0.71073","MoKα","","0.094","0.058","","","","0.168","","","","","","1.012","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200071","7.5746","0.0015","11.878","0.002","14.519","0.003","90","","100.47","0.03","90","","1284.5","0.4","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2-Amino-5-(4-methoxybenzyl)-4-methyl-1,3-thiazolium chloride","","- C12 H15 Cl N2 O S -","- C12 H15 Cl N2 O S -","- C48 H60 Cl4 N8 O4 S4 -","4","1","OB6000","Lynch, Daniel E.; McClenaghan, Ian","2-Amino-5-(4-methoxybenzyl)-4-methyl-1,3-thiazolium chloride","Acta Crystallographica Section E","2001","57","1","o24","o25","10.1107/S1600536800017876","","","0.71073","MoKα","","0.071","0.05","","","","0.136","","","","","","1.009","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200072","8.7937","0.0018","8.3091","0.0017","21.148","0.004","90","","95.73","0.03","90","","1537.5","0.5","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Amino-4,6-bis(phenylthio)pyrimidine","","- C16 H13 N3 S2 -","- C16 H13 N3 S2 -","- C64 H52 N12 S8 -","4","1","OB6001","Lynch, Daniel E.; McClenaghan, Ian","2-Amino-4,6-bis(phenylthio)pyrimidine","Acta Crystallographica Section E","2001","57","1","o26","o27","10.1107/S1600536800017888","","","0.71073","MoKα","","0.077","0.046","","","","0.117","","","","","","1.004","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200073","19.515","0.001","23.667","0.002","6.541","0.002","90","","90","","90","","3021","1","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C34 H33 Br O7 -","- C34 H33 Br O7 -","- C136 H132 Br4 O28 -","4","1","OB6002","Timothy J. Brenstrum; Margaret A. Brimble; Peter Turner","<i>endo</i>-(1'<i>R</i>,2'<i>R</i>,5'<i>S</i>,7'<i>R</i>,9'<i>S</i>)-2-(9'-Benzyloxy-2'-phenyl-3',6'-dioxabicyclo[3.2.2]nonan-7'-yl)-7-bromo-5,8-dimethoxynaphthalen-1-yl acetate","Acta Crystallographica Section E","2001","57","1","o28","o29","10.1107/S1600536800018092","","","1.54178","CuKα","","0.0703","0.0356","","","","0.1139","","","","","","1.023","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200074","6.8206","0.0007","23.154","0.003","8.7018","0.0009","90","","105.38","0.002","90","","1325","0.3","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H28 P2 Se2 -","- C28 H28 P2 Se2 -","- C56 H56 P4 Se4 -","2","0.5","OB6003","Hundal, Rajbir; Lobana, Tarlok S.; Turner, Peter","1,4-Butylenebis(diphenylphosphine selenide)","Acta Crystallographica Section E","2001","57","1","o30","o31","10.1107/S1600536800018754","","","0.71073","MoKα","","0.031","0.026","","","","0.075","","","","","","1.018","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200075","10.222","0.001","12.594","0.002","17.301","0.003","79.05","0.011","85.982","0.014","74.883","0.009","2110.5","0.6","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","Tris(1,2-dimethoxyethane-O,O')sodium pentaphenylcyclopentadienide","","- C47 H55 Na O6 -","- C47 H55 Na O6 -","- C94 H110 Na2 O12 -","2","1","OB6005","Holl, Sven; Bock, Hans; Gharagozloo-Hubmann, Katayoun","Tris(1,2-dimethoxyethane-<i>O</i>,<i>O</i>')sodium pentaphenylcyclopentadienide","Acta Crystallographica Section E","2001","57","1","m31","m32","10.1107/S1600536800019619","","","0.71073","MoKα","","0.062","0.051","","","","0.152","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200076","6.2862","0.0003","6.8598","0.0002","9.2394","0.0004","96.511","0.003","104.929","0.002","113.692","0.003","341.77","0.03","123","2","123","2","","","","","","","","5","P -1","-P 1","2","trans-Bis(pyridine-4-carboxylate)tetraaquonickel(II)","trans-Bis(pyridine-4-carboxylate)tetraaquonickel(II)","","- C12 H16 N2 Ni O8 -","- C12 H16 N2 Ni O8 -","- C12 H16 N2 Ni O8 -","1","0.5","OB6007","Batten, Stuart R.; Harris, Alexander R.","<i>trans</i>-Tetraaquabis(pyridine-4-carboxylate-κ<i>N</i>)nickel(II)","Acta Crystallographica Section E","2001","57","1","m7","m8","10.1107/S1600536800018730","","","0.71073","MoKα","","0.028","0.025","","","","0.058","","","","","","1.147","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200077","14.0549","0.0007","6.817","0.0002","8.4359","0.0004","90","","118.137","0.002","90","","712.74","0.05","123","2","123","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","trans-Bis(pyridine-3-carboxylate)tetraaquonickel(II)","trans-Bis(pyridine-3-carboxylate)tetraaquonickel(II)","","- C12 H16 N2 Ni O8 -","- C12 H16 N2 Ni O8 -","- C24 H32 N4 Ni2 O16 -","2","0.25","OB6008","Batten, Stuart R.; Harris, Alexander R.","<i>trans</i>-Tetraaquabis(pyridine-3-carboxylate-κ<i>N</i>)nickel(II)","Acta Crystallographica Section E","2001","57","1","m9","m11","10.1107/S1600536800018742","","","0.71073","MoKα","","0.04","0.032","","","","0.058","","","","","","1.118","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200078","9.416","0.003","12.955","0.004","19.748","0.006","90","","103.792","0.003","90","","2339.5","1.3","298","2","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[bis(2-pyridyl)amine-N,N']copper(II) diperchlorate","","- C20 H18 Cl2 Cu N6 O8 -","- C20 H18 Cl2 Cu N6 O8 -","- C80 H72 Cl8 Cu4 N24 O32 -","4","0.5","OB6011","Du, Miao; Bu, Xian-He; Weng, Lin-Hong; Leng, Xue-Bing; Guo, Ya-Mei","Redetermination of [bis(2-pyridyl)amine-<i>N</i>,<i>N</i>']copper(II) diperchlorate","Acta Crystallographica Section E","2001","57","1","m25","m27","10.1107/S1600536800019103","","","0.71073","MoKα","","","0.043","","","","0.108","","","","","","1.04","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200079","15.559","0.003","9.3139","0.0019","16.493","0.003","90","","102.08","0.03","90","","2337.2","0.8","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-Amino-4-chloro-6-(4-carbamoylpyperidinyl)pyrimidine hemihydrate","","- C10 H15 Cl N5 O1.5 -","- C10 H15 Cl N5 O1.5 -","- C80 H120 Cl8 N40 O12 -","8","1","OB6014","Lynch, Daniel E.; McClenaghan, Ian","2-Amino-4-chloro-6-(4-carbamoylpiperidin-1-yl)pyrimidine hemihydrate","Acta Crystallographica Section E","2001","57","1","o50","o51","10.1107/S1600536800019589","","","0.71073","MoKα","","0.057","0.041","","","","0.116","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200080","10.148","0.002","14.251","0.003","18.103","0.004","90","","90","","90","","2618","1","150","2","150","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(E)-1-(2-Thienyl)ethanone 8-quinolylhydrozone","","- C15 H13 N3 S -","- C15 H13 N3 S -","- C120 H104 N24 S8 -","8","1","OB6015","Lynch, Daniel E.; McClenaghan, Ian","(<i>E</i>)-1-(2-Thienyl)ethanone 8-quinolylhydrozone","Acta Crystallographica Section E","2001","57","1","o52","o53","10.1107/S1600536800019607","","","0.71073","MoKα","","0.15","0.061","","","","0.17","","","","","","0.98","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200081","12.721","0.003","7.8961","0.0016","16.617","0.003","90","","90","","90","","1669.1","0.6","150","2","150","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-Chloro-4-methylquinoline","","- C10 H8 Cl N -","- C10 H8 Cl N -","- C80 H64 Cl8 N8 -","8","1","OB6016","Lynch, Daniel E.; McClenaghan, Ian","2-Chloro-4-methylquinoline","Acta Crystallographica Section E","2001","57","1","o54","o55","10.1107/S1600536800019590","","","0.71073","MoKα","","0.06","0.043","","","","0.115","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200082","19.3539","0.0008","6.8609","0.0003","19.3579","0.0008","90","","112.325","0.002","90","","2377.77","0.18","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-(4-Pyridyl)pyrrolo[3,2-h]quinoline","","- C32 H22 N6 -","- C32 H22 N6 -","- C128 H88 N24 -","4","1","OB6017","Lynch, Daniel E.; McClenaghan, Ian; Light, Mark E.","2-(4-Pyridyl)pyrrolo[3,2-<i>h</i>]quinoline","Acta Crystallographica Section E","2001","57","1","o56","o57","10.1107/S1600536800019620","","","0.71073","MoKα","","0.07","0.044","","","","0.109","","","","","","0.89","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200083","33.958","0.005","22.88","0.003","11.735","0.001","90","","90","","90","","9118","2","293","2","293","","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C20 H18 Cr2 N4 Ni O8 -","- C20 H18 Cr2 N4 Ni O8 -","- C320 H288 Cr32 N64 Ni16 O128 -","16","1","YA6000","Fernández-González, Nélida; González-Silgo, Cristina; González-Platas, Javier; Gili, Pedro; Martín-Zarza, Pedro","<i>cis</i>-Aquabis(2,2'-bipyridine-<i>N</i>,<i>N</i>')[dichromato(2‒)-<i>O</i>^1^]nickel(II)","Acta Crystallographica Section E","2001","57","1","m43","m45","10.1107/S1600536800020389","","","0.71073","MoKα","","0.046","0.029","","0.075","","0.075","","","1.08","","","1.08","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200084","3.6271","0.0003","3.6271","0.0003","18.972","0.002","90","","90","","120","","216.15","0.03","298","2","298","2","","","","","","","","2","R -3 m :H","-R 3 2""","166","","","","- Ca2 N -","- Ca2 N -","- Ca6 N3 -","3","0.0833333","BR6000","Baker, Charles F.; Barker, Marten G.; Blake, Alexander J.","Calcium nitride (Ca~2~N), a redetermination","Acta Crystallographica Section E","2001","57","2","i6","i7","10.1107/S1600536801000472","","","0.71073","MoKα","","0.018","0.017","","","","0.038","","","","","","1.28","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200085","7.056","0.001","16.376","0.003","5.585","0.001","90","","90","","90","","645.34","0.19","293","2","293","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","Dieuropium(III) silicodimonophosphatediphosphate","Dieuropium(III) silicodimonophosphatediphosphate","","- Eu2 O15 P4 Si -","- Eu2 O15 P4 Si -","- Eu4 O30 P8 Si2 -","2","0.5","BR6001","Bennazha, Jamal; Boukhari, Ali; Holt, Elizabeth M.","Dieuropium(III) silicodimonophosphatediphosphate","Acta Crystallographica Section E","2001","57","2","i12","i14","10.1107/S1600536801001519","","","0.71073","MoKα","","0.026","0.025","","","","0.064","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200086","4.8982","0.001","4.8982","0.001","9.014","0.003","90","","90","","120","","187.29","0.08","293","2","293","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Ba Li Sb -","- Ba Li Sb -","- Ba2 Li2 Sb2 -","2","0.0833333","BR6002","Monconduit, Laure; Belin, Claude","A new ternary antimonide phase, LiBaSb","Acta Crystallographica Section E","2001","57","3","i17","i18","10.1107/S160053680100201X","","","0.71069","MoKα","","0.0235","0.0219","","","","0.0546","","","","","","1.083","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2200087","5.2605","0.0004","8.9046","0.0006","9.7244","0.0007","75.685","0.001","77.487","0.002","73.489","0.001","417.89","0.05","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- H O8 P2 Rb Zn2 -","- H O8 P2 Rb Zn2 -","- H2 O16 P4 Rb2 Zn4 -","2","1","BR6003","Yule, Lisa J.; Harrison, William T. A.","Rubidium zinc phosphate, RbZn~2~(PO~4~)(HPO~4~)","Acta Crystallographica Section E","2001","57","2","i15","i16","10.1107/S1600536801001386","","","0.71073","MoKα","","","0.0537","","","","0.0626","","","","","","1.074","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2200088","6.7777","0.0002","7.0282","0.0001","8.097","0.0002","67.906","0.001","84.812","0.001","84.236","0.001","354.991","0.015","173","2","173","2","","","","","","","","4","P -1","-P 1","2","Calcium hydrogenphosphite monohydrate","","","- Ca H6 O7 P2 -","- Ca H6 O7 P2 -","- Ca2 H12 O14 P4 -","2","1","BR6004","Mahmoudkhani, Amir H.; Langer, Vratislav","Layered calcium hydrogenphosphite monohydrate at 173K","Acta Crystallographica Section E","2001","57","3","i19","i21","10.1107/S1600536801002665","","","0.71073","MoKα","","0.0308","0.0273","","","","0.0737","","","","","","1.05","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200089","6.0283","0.0004","8.7916","0.0006","9.1191","0.0006","69.486","0.001","81.508","0.001","83.017","0.001","446.41","0.05","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","tin(II)oxalate tetrasodium hexafluorate","","- C6 F6 Na4 O12 Sn4 -","- C6 F6 Na4 O12 Sn4 -","- C6 F6 Na4 O12 Sn4 -","1","0.5","BR6005","Salami, Tolulope O.; Zavalij, Peter Y.; Oliver, Scott R. J.","BING-1: a tin‒oxalate‒sodium‒fluoride framework, Na~4~Sn~4~(C~2~O~4~)~3~F~6~","Acta Crystallographica Section E","2001","57","3","m111","m113","10.1107/S1600536801002409","","","0.71073","MoKα","","0.0395","0.0335","","","","0.0869","","","","","","0.986","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200090","13.9969","0.0003","6.4803","0.0002","11.0211","0.0002","90","","105.596","0.0011","90","","962.85","0.04","120","","120","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","melanterite","","","- Fe H14 O11 S -","- Fe H14 O11 S -","- Fe4 H56 O44 S4 -","4","1","","Fronczek, Frank R.; Collins, Sibrina N.; Chan, Julia Y.","Refinement of ferrous sulfate heptahydrate (melanterite) with low-temperature CCD data","Acta Crystallographica, Section E","2001","57","","i26","i27","10.1107/S1600536801004202","","","","","","","","","","","","","","","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200091","4.8269","0.001","4.8269","0.001","4.866","0.001","90","","90","","120","","98.18","0.04","293","2","293","2","","","","","","","","3","P -3 1 m","-P 3 2","162","","","","- As2 Cd O6 -","- As2 Cd O6 -","- As2 Cd O6 -","1","0.0833333","","Matthias Weil","Cadmium(II) metaarsenate(V), CdAs~2~O~6~","Acta Crystallographica, Section E","2001","57","","i22","i23","10.1107/S1600536801003865","","","","","","","","","","","","","","","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200092","6.4818","0.0003","8.7975","0.0005","7.6367","0.0004","90","","98.753","0.001","90","","430.4","0.04","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- H4 Mg O5 Se -","- H4 Mg O5 Se -","- H16 Mg4 O20 Se4 -","4","1","","Johnston, Magnus G.; Harrison, William T. A.","Magnesium selenite dihydrate, MgSeO~3~.2H~2~O","Acta Crystallographica, Section E","2001","57","","i24","i25","10.1107/S1600536801004135","","","","","","","","","","","","","","","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200093","6.9446","0.0014","9.0365","0.0014","4.853","0.0008","90","","101.77","0.01","90","","298.15","0.09","293","2","293","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","Cadmium(II) diarsenate(V)","","","- As2 Cd2 O7 -","- As2 Cd2 O7 -","- As4 Cd4 O14 -","2","0.25","","Weil, Matthias","Cadmium(II) diarsenate(V), Cd~2~As~2~O~7~","Acta Crystallographica, Section E","2001","57","","i28","i29","10.1107/S1600536801004342","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2200094","10.9197","0.0007","4.9876","0.0006","9.964","0.001","90","","92.273","0.006","90","","542.24","0.09","180","2","180","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","sebacic acid","octane-1,8-dicarboxylic acid","","- C10 H18 O4 -","- C10 H18 O4 -","- C20 H36 O8 -","2","0.5","BT6002","Bond, Andrew D.; Edwards, Marc R.; Jones, William","Sebacic acid","Acta Crystallographica Section E","2001","57","2","o141","o142","10.1107/S1600536801000794","","","0.71069","MoKα","","0.09","0.051","","","","0.139","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200095","22.622","0.002","4.7348","0.0002","9.6864","0.0007","90","","110.559","0.003","90","","971.44","0.12","180","2","180","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","azelaic acid","heptane-1,7-dicarboxylic acid","","- C9 H16 O4 -","- C9 H16 O4 -","- C36 H64 O16 -","4","0.5","BT6003","Bond, Andrew D.; Edwards, Marc R.; Jones, William","Azelaic acid","Acta Crystallographica Section E","2001","57","2","o143","o144","10.1107/S1600536801000800","","","0.71073","MoKα","","0.047","0.037","","","","0.096","","","","","","1.091","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200096","19.141","0.004","3.8417","0.0004","11.564","0.002","90","","90","","90","","850.3","0.2","180","2","180","2","","","","","","","","3","P c a 21","P 2c -2ac","29","4,7-phenanthroline","4,7-phenanthroline","","- C12 H8 N2 -","- C12 H8 N2 -","- C48 H32 N8 -","4","1","BT6004","Bond, Andrew D.; Shan, Ning; Jones, William","4,7-Phenanthroline","Acta Crystallographica Section E","2001","57","2","o145","o146","10.1107/S1600536801000812","","","0.71073","MoKα","","0.093","0.063","","","","0.161","","","","","","1.093","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200097","11.031","0.005","16.639","0.005","6.813","0.005","95.381","0.005","94.53","0.005","104.686","0.005","1197.4","1.1","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H33 N O3 -","- C26 H33 N O3 -","- C52 H66 N2 O6 -","2","1","BT6005","Kubo, Kanji; Mori, Akira","4-Cyanophenyl 4-<i>n</i>-dodecanyloxybenzoate","Acta Crystallographica Section E","2001","57","2","o113","o115","10.1107/S1600536801000903","","","0.71073","MoKα","","0.257","0.059","","","","0.193","","","","","","0.911","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200098","8.345","0.0003","8.5536","0.0003","12.6875","0.0005","90","","105.482","0.003","90","","872.77","0.06","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","9α-chloro-3β,11β-dihydroxy-5α-androstan-17-one","","- C19 H29 Cl O3 -","- C19 H29 Cl O3 -","- C38 H58 Cl2 O6 -","2","1","BT6006","Novoa de Armas, Héctor; Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J.; Ruíz Garcia, José A.; Reyes Moreno, Mayra; Alvarez Ginarte, Yoanna M.","9α-Chloro-3β,11β-dihydroxy-5α-androstan-17-one","Acta Crystallographica Section E","2001","57","2","o166","o167","10.1107/S1600536801001490","","","1.5418","CuKα","","0.0335","0.0332","","","","0.099","","","","","","1.095","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200099","10.193","0.002","11.159","0.002","14.253","0.003","105.14","0.03","103.09","0.03","92.3","0.03","1515.7","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H30 Co N3 S6 -","- C27 H30 Co N3 S6 -","- C54 H60 Co2 N6 S12 -","2","1","BT6007","Ondrušová, Darina; Koman, Marian; Jóna, Eugen; Pajtášová, Maria; Glowiak, Tadeus","Tris(<i>N</i>-ethyl-<i>N</i>-phenyldithiocarbamato-<i>S</i>,<i>S</i>')cobalt(III)","Acta Crystallographica Section E","2001","57","4","m172","m173","10.1107/S1600536801005128","","","0.71073","MoKα","","0.1805","0.0579","","","","0.1849","","","","","","0.856","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200100","5.3169","0.0003","6.1524","0.0003","15.9722","0.0008","90","","92.5","0.01","90","","521.98","0.05","297","2","297","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Bis(methylperthiocarboxylato)nickel(II)","","","- C4 H6 Ni S6 -","- C4 H6 Ni S6 -","- C8 H12 Ni2 S12 -","2","0.5","BT6010","Mahmoudkhani, Amir H.; Langer, Vratislav","On the reaction of nickel(II) ions with thiolacetic acid","Acta Crystallographica Section E","2001","57","3","m92","m94","10.1107/S1600536801001994","","","0.71073","MoKα","","0.0394","0.0339","","","","0.0872","","","","","","1.023","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200101","7.3714","0.0004","12.9097","0.0008","15.7403","0.0009","90","","97.732","0.001","90","","1484.27","0.15","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(triethanolamine-N,O,O')nickel(II) bis(saccharinate)","","- C26 H38 N4 Ni O12 S2 -","- C26 H38 N4 Ni O12 S2 -","- C52 H76 N8 Ni2 O24 S4 -","2","0.5","BT6011","Topcu, Yildiray; Andac, Omer; Yilmaz, Veysel T.; Harrison, William T. A.","Bis(triethanolamine-<i>N</i>,<i>O</i>,<i>O</i>')nickel(II) bis(saccharinate)","Acta Crystallographica Section E","2001","57","2","m82","m84","10.1107/S1600536801001878","","","0.71069","MoKα","","0.0763","0.0483","","","","0.1427","","","","","","0.99","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200102","13.189","0.003","8.577","0.002","20.195","0.004","90","","90","","90","","2284.5","0.9","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4-Chloro-2-methylthio-6-(piperidin-1-yl)pyrimidine","","- C10 H14 Cl N3 S -","- C10 H14 Cl N3 S -","- C80 H112 Cl8 N24 S8 -","8","1","BT6012","Lynch, Daniel E.; McClenaghan, Ian","4-Chloro-2-methylthio-6-(1-piperidyl)pyrimidine","Acta Crystallographica Section E","2001","57","3","o200","o201","10.1107/S1600536801001982","","","0.71073","MoKα","","0.0525","0.0412","","","","0.1165","","","","","","1.056","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200103","7.982","0.002","10.492","0.002","19.95","0.003","90","","106.578","0.019","90","","1601.3","0.6","293","1","293","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-Dimethylamino-N,N-dimethyl-3-(4-pyridyl)-2,4-pentadieniminium tetrafluoroborate","","- C14 H20 B F4 N3 -","- C14 H20 B F4 N3 -","- C56 H80 B4 F16 N12 -","4","1","BT6013","Ferguson, George; Jennings, Michael C.; McAlees, Alan J.; McCrindle, Robert","5-Dimethylamino-<i>N</i>,<i>N</i>-dimethyl-3-(4-pyridyl)-2,4-pentadieniminium tetrafluoroborate","Acta Crystallographica Section E","2001","57","3","o202","o204","10.1107/S1600536801002008","","","0.71073","MoKα","","0.0927","0.0565","","","","0.1949","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200104","15.117","0.0013","11.6285","0.0006","19.9737","0.0016","90","","101.624","0.01","90","","3439.1","0.5","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H16 Cl12 N6 -","- C28 H16 Cl12 N6 -","- C112 H64 Cl48 N24 -","4","1","BT6014","Alfonso, Montserrat; Stoeckli-Evans, Helen","1,6,7,12,13,18-Hexaazatrinaphthylene tetrachloroform solvate","Acta Crystallographica Section E","2001","57","3","o242","o244","10.1107/S1600536801002938","","","0.71073","MoKα","","0.1813","0.0363","","","","0.0638","","","","","","0.569","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200105","8.985","0.0013","8.985","0.0013","12.265","0.003","90","","90","","90","","990.2","0.3","293","2","293","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C4 H8 I2 Pt S2 -","- C4 H8 I2 Pt S2 -","- C16 H32 I8 Pt4 S8 -","4","0.5","BT6015","Johansson, Maria H.; Engelbrecht, Hendrik P.","<i>cis</i>-(1,4-Dithiane-<i>S</i>,<i>S</i>')diiodoplatinum(II)","Acta Crystallographica Section E","2001","57","3","m114","m116","10.1107/S1600536801002951","","","0.71073","MoKα","","0.037","0.026","","","","0.049","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200106","7.467","0.002","16.217","0.003","19.318","0.004","90","","90","","90","","2339.3","0.9","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4,6-Dichloro-2-methylthio-5-phenylpyrimidine","","- C11 H8 Cl2 N2 S -","- C11 H8 Cl2 N2 S -","- C88 H64 Cl16 N16 S8 -","8","2","BT6016","Lynch, Daniel E.; McClenaghan, Ian","4,6-Dichloro-2-methylthio-5-phenylpyrimidine","Acta Crystallographica Section E","2001","57","3","o264","o265","10.1107/S1600536801003154","","","0.71073","MoKα","","0.0405","0.0338","","","","0.0865","","","","","","1.056","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200107","18.3035","0.0001","8.5629","0.0001","31.2876","0.0002","90","","94.7702","0.0004","90","","4886.75","0.07","200","","200","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H14 Ir2 O10 W2 -","- C22 H14 Ir2 O10 W2 -","- C176 H112 Ir16 O80 W16 -","8","2","BT6017","Lucas, Nigel T.; Notaras, Eleni G. A.; Humphrey, Mark G.","W~2~Ir~2~(CO)~10~(η^5^-C~5~H~4~Me)~2~","Acta Crystallographica Section E","2001","57","4","m132","m133","10.1107/S1600536801003750","","","0.7107","MoKα","","0.0586","0.0423","","0.0758","","0.0537","","","2.4","","","1.812","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200108","7.566","0.016","7.39","0.02","14.04","0.03","90","","90","","90","","785","3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C4 H4 Mo2 N2 O6 -","- C4 H4 Mo2 N2 O6 -","- C16 H16 Mo8 N8 O24 -","4","0.5","BT6019","Liang, Yucang; Hong, Maochun; Cao, Rong; Sun, Daofeng; Weng, Jiabao","Polymeric tri-μ-oxo(pyrazine)molybdenum(VI)","Acta Crystallographica Section E","2001","57","4","m159","m161","10.1107/S160053680100441X","","","0.71073","MoKα","","0.0391","0.0345","","","","0.0856","","","","","","1.238","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2200109","16.8073","0.0001","9.5849","0.0001","19.0626","0.0002","90","","90.8932","0.0006","90","","3070.54","0.05","200","","200","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H24 Ir2 O8 W2 -","- C34 H24 Ir2 O8 W2 -","- C136 H96 Ir8 O32 W8 -","4","1","BT6020","Lucas, Nigel T.; Notaras, Eleni G. A.; Humphrey, Mark G.","W~2~Ir~2~(μ~4~-η^2^-C~2~Ph~2~)(μ-CO)~4~(CO)~4~(η-C~5~H~4~Me)~2~","Acta Crystallographica Section E","2001","57","4","m143","m144","10.1107/S1600536801004123","","","0.7107","MoKα","","0.0344","0.0263","","0.0328","","0.0295","","","0.822","","","0.817","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200110","7.0512","0.0006","7.3853","0.0006","18.4652","0.0014","90.022","0.001","96.985","0.001","115.63","0.001","859.02","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Tetra(2,4-pyridinedicarboxylate)terazinc(II) octa-hydtate","","- C28 H28 N4 O24 Zn4 -","- C28 H28 N4 O24 Zn4 -","- C28 H28 N4 O24 Zn4 -","1","0.5","BT6022","Liang, Yucang; Hong, Maochun; Cao, Rong","Tetrakis(2,5-pyridinedicarboxylato)tetrazinc(II) octahydrate","Acta Crystallographica Section E","2001","57","4","m145","m147","10.1107/S1600536801004184","","","0.71073","MoKα","","0.0532","0.0408","","","0.1024","0.121","","","1.069","1.069","1.069","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2200111","13.311","0.001","13.5395","0.0011","8.8727","0.0007","90","","107.801","0.002","90","","1522.5","0.2","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Tetramethylammonium pentaiodide","","- C4 H12 I5 N -","- C4 H12 I5 N -","- C16 H48 I20 N4 -","4","0.5","BT6024","Filguieras, Carlos A. L.; Horn Jr, Adolfo; Skakle, Janet M. S.; Wardell, James L.","Tetramethylammonium pentaiodide","Acta Crystallographica Section E","2001","57","4","o338","o340","10.1107/S1600536801004536","","","0.71073","MoKα","","0.0679","0.0515","","","","0.1428","","","","","","1.049","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2200112","7.122","0.002","8.809","0.002","15.178","0.003","95.98","0.02","99.34","0.02","107.43","0.02","884.6","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-[3-(4-Chlorobenzylideneamino)-2-oxooxazolidin-5-ylmethyl]morpholinium chloride monohydrate","","- C15 H21 Cl2 N3 O4 -","- C15 H21 Cl2 N3 O4 -","- C30 H42 Cl4 N6 O8 -","2","1","BT6025","Bartczak, Tadeusz J.; Kruszynski, Rafal; Chilmonczyk, Zdzislaw; Cybulski, Jacek","4-[3-(4-Chlorobenzylideneamino)-2-oxooxazolidin-5-ylmethyl]morpholin-4-ium chloride monohydrate","Acta Crystallographica Section E","2001","57","4","o341","o343","10.1107/S1600536801004548","","","0.71073","MoKα","","0.049","0.043","","","","0.1202","","","","","","1.042","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200113","7.8975","0.0004","17.6323","0.0008","15.1057","0.0007","90","","96.36","0.001","90","","2090.54","0.17","302","2","302","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[(2,2'-bipyridine-N,N')cobalt(II)]- μ-4,4'-oxydibenzoato-O,O':O'',O''']","","- C24 H16 Co N2 O5 -","- C24 H16 Co N2 O5 -","- C96 H64 Co4 N8 O20 -","4","1","BT6026","Skakle, Janet M. S.; Foreman, Mark R. St J.; Plater, M. John","<i>catena</i>-Poly[[(2,2'-bipyridine-<i>N</i>,<i>N</i>')cobalt(II)]-μ-4,4'-oxydibenzoato-<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>''']","Acta Crystallographica Section E","2001","57","4","m169","m171","10.1107/S1600536801004949","","","0.71073","MoKα","","0.081","0.0416","","","","0.135","","","","","","0.936","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200114","6.8004","0.0003","13.8358","0.0005","10.8658","0.0004","90","","97.896","0.001","90","","1012.66","0.07","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C H13 Br K N O7 -","- C H13 Br K N O7 -","- C4 H52 Br4 K4 N4 O28 -","4","1","CF6016","Willett, Roger D.","Tetraaqua(nitromethane)potassium bromide monohydrate","Acta Crystallographica Section E","2001","57","2","m53","m54","10.1107/S1600536800020791","","","0.71073","MoKα","","0.04","0.037","","","","0.092","","","","","","1.1","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200115","8.7475","0.0002","15.553","0.001","20.359","0.001","90","","90","","90","","2769.8","0.2","298","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C32 H50 O -","- C32 H50 O -","- C128 H200 O4 -","4","1","CF6019","Auhmani, A.; Kossareva, E.; Eljamili, H.; Reglier, M.; Pierrot, M.; Benharref, A.","(1<i>S</i>,3<i>S</i>,8<i>R</i>,9<i>S</i>)-3,7,7,10-Tétraméthyl-9-[(1<i>S</i>,3<i>S</i>,8<i>R</i>,9<i>S</i>)-3,7,7-triméthyl-10-méthylènetricyclo[6,4,0,0^1,3^]dodéc-9-yloxy]tricyclo[6,4,0,0^1,3^]dodéc-10-ène","Acta Crystallographica Section E","2001","57","2","o102","o103","10.1107/S1600536800020547","","","0.71073","MoKα","","0.098","0.086","","0.06","","0.051","","","2.12","","","1.87","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200116","20.038","0.004","11.358","0.002","12.043","0.002","90","","92.03","0.03","90","","2739.2","0.9","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6-Chloro-2-methylthio-4-[(2-phenylethyl)amino]pyrimidine","","- C26 H28 Cl2 N6 S2 -","- C26 H28 Cl2 N6 S2 -","- C104 H112 Cl8 N24 S8 -","4","1","CF6020","Lynch, Daniel E.; McClenaghan, Ian","6-Chloro-2-methylthio-4-[(2-phenylethyl)amino]pyrimidine","Acta Crystallographica Section E","2001","57","3","o198","o199","10.1107/S1600536801001945","","","0.71073","MoKα","","0.0822","0.0477","","","","0.1232","","","","","","0.997","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200117","5.4856","0.0004","9.906","0.001","12.227","0.001","73.429","0.004","77.443","0.007","78.576","0.007","614.98","0.09","298","","","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H16 N2 O3 -","- C12 H16 N2 O3 -","- C24 H32 N4 O6 -","2","1","CF6029","Elmeslouhi, H.; Essassi, E. M.; Pierrot, M.","2-Carbamoyl-6-éthyl-3-phényl-2,3,5,6-tétrahydro-1,4,2-dioxazine","Acta Crystallographica Section E","2001","57","3","o205","o206","10.1107/S1600536801002203","","","0.71073","MoKα","","0.066","0.052","","0.064","","0.064","","","1.04","","","1.063","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2200118","7.224","0.002","15.521","0.002","20.404","0.001","90","","90","","90","","2287.8","0.7","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C25 H28 O8 -","- C25 H28 O8 -","- C100 H112 O32 -","4","1","CF6030","Ajees, A. Abdul; Sekar, K.; Parthasarathy, S.; Schenk, H.; Epe, B.; Mondon, A.","Tricoccin R6","Acta Crystallographica Section E","2001","57","2","o116","o117","10.1107/S1600536801000733","","","1.5418","CuKα","","0.038","0.033","","","","0.092","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200119","9.3","0.0005","15.2215","0.0005","9.7195","0.0005","90","","117.883","0.002","90","","1216.16","0.1","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H14 N2 O2 -","- C14 H14 N2 O2 -","- C56 H56 N8 O8 -","4","1","CF6031","Mustaphi, N. E.; Ferfra, S.; Essassi, E. M.; Pierrot, M.","1,4-Diallylquinoxaline-2,3(1<i>H</i>,4<i>H</i>)-dione","Acta Crystallographica Section E","2001","57","2","o176","o177","10.1107/S1600536801001076","","","0.71073","MoKα","","0.064","0.049","","0.064","","0.064","","","1.166","","","1.166","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200120","8.8987","0.0013","14.305","0.0016","10.1286","0.0011","90","","97.096","0.009","90","","1279.5","0.3","298","","298","","","","","","","","","5","P 1 21 1","P 2yb","4","","Bis(dimethylglyoximato)[2,2-(dimethylcarbamoyl)ethyl] [(R)-1-phenylethylamine]cobalt(III)","","- C21 H35 Co N6 O5 -","- C21 H35 Co N6 O5 -","- C42 H70 Co2 N12 O10 -","2","1","CF6035","Ohgo, Yoshiki; Ohashi, Yuji; Shida, Mitsuru; Hagiwara, Mieko; Arai, Yoshifusa; Takeuchi, Seiji; Ohgo, Yoshiaki","[2-(<i>N,N</i>-Dimethylcarbamoyl)ethyl]bis(dimethylglyoximato)[(<i>R</i>)-1-phenylethylamine]cobalt(III)","Acta Crystallographica Section E","2001","57","2","m62","m64","10.1107/S1600536801001088","","","0.71073","MoKα","","0.061","0.045","","","","0.122","","","","","","1.016","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200121","11.505","0.003","8.484","0.002","14.616","0.004","90","","99.42","0.03","90","","1407.4","0.6","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","fern-9(11)-en-6α-ol‒methanol (1/1)","","- C31 H54 O2 -","- C31 H54 O2 -","- C62 H108 O4 -","2","1","CF6036","Bhattacharyya, Kinkini; Kar, Tanusree; Bocelli, Gabriele; Righi, Lara; Venkateswarlu, Yenamandra; Reddy, V. L. Niranjan","Fern-9(11)-en-6α-ol‒methanol (1/1)","Acta Crystallographica Section E","2001","57","3","o228","o230","10.1107/S1600536801002215","","","1.54178","CuKα","","0.0552","0.0519","","","","0.1578","","","","","","1.123","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200122","17.174","0.005","7.38","0.005","11.393","0.005","90","","100.647","0.005","90","","1419.1","1.2","296","2","296","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C16 H14 N2 S -","- C16 H14 N2 S -","- C64 H56 N8 S4 -","4","1","CF6037","Mori, Akira; Kubo, Kanji; Yin, Bing Zhu; Takeshita, Hitoshi","2-(7-Isopropyl-2-methylcyclohepta[<i>b</i>]thiophen-8-ylidene)propanedinitrile","Acta Crystallographica Section E","2001","57","2","o118","o119","10.1107/S1600536801001064","","","0.71073","MoKα","","0.172","0.052","","","","0.143","","","","","","0.994","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200123","18.238","0.002","21.984","0.003","10.586","0.001","90","","94.051","0.006","90","","4233.8","0.8","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H24 O4 S2 Sn -","- C18 H24 O4 S2 Sn -","- C144 H192 O32 S16 Sn8 -","8","2","CF6038","Yahyi, Abderrahmane; Et-touhami, Abdelkader; Zidane, Ismail; Benchat, Nour-eddine; El-Bali, Brahim; Bolte, Michael","Di-<i>n</i>-butylbis(thiophene-2-carboxylato-<i>O</i>,<i>O</i>')tin(IV)","Acta Crystallographica Section E","2001","57","2","m65","m66","10.1107/S160053680100126X","","","0.71073","MoKα","","0.031","0.024","","","","0.061","","","","","","1.132","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200124","6.705","0.001","9.14","0.001","11.647","0.001","69.71","0.01","88.94","0.01","69.29","0.01","621.79","0.14","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- Eu H12 N3 O15 -","- Eu H12 N3 O15 -","- Eu2 H24 N6 O30 -","2","1","CF6039","Stumpf, Thorsten; Bolte, Michael","Tetraaquatrinitratoeuropium(III) dihydrate","Acta Crystallographica Section E","2001","57","2","i10","i11","10.1107/S1600536801001271","","","0.71073","MoKα","","0.018","0.016","","","","0.039","","","","","","1.125","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200125","3.9158","0.0008","10.021","0.002","10.698","0.002","113.92","0.03","95.16","0.03","96.06","0.03","377.5","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","4,4'-Bipyridylium(di-μ-chloro-tetrachloro-di-copper)","","","- C10 H10 Cl6 Cu2 N2 -","- C10 H10 Cl6 Cu2 N2 -","- C10 H10 Cl6 Cu2 N2 -","1","0.5","CF6040","Näther, Christian; Jeß, Inke; Bolte, Michael","4,4'-Bipyridylium di-μ-chlorotetrachlorodicuprate(II): a redetermination","Acta Crystallographica Section E","2001","57","2","m78","m79","10.1107/S1600536801001283","","","0.71073","MoKα","","0.05","0.028","","","","0.068","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200126","7.47","0.004","11.11","0.003","16.242","0.003","90","","90","","90","","1348","0.8","293","1","293","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","1,3-Bis(dimethylamino)-1-methyl-trimethinium hexafluorophosphate or N-[3-(Dimethylamino)-1-methyl-2-propenylidene]-N-methylmethanaminium hexafluorophosphate","","- C8 H17 F6 N2 P -","- C8 H17 F6 N2 P -","- C32 H68 F24 N8 P4 -","4","1","CF6041","Ferguson, George; McAlees, Alan J.; McCrindle, Robert","1,3-Bis(dimethylamino)-1-methyltrimethinium hexafluorophosphate","Acta Crystallographica Section E","2001","57","2","o168","o169","10.1107/S1600536801001507","","","0.71073","MoKα","","0.082","0.056","","","","0.185","","","","","","1.026","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200127","24.493","0.004","6.365","0.002","12.859","0.008","90","","117.24","0.003","90","","1782.4","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3-chloro-2-methylquinolin-4-one","","- C10 H8 Cl N O -","- C10 H8 Cl N O -","- C80 H64 Cl8 N8 O8 -","8","1","CF6042","Vasuki, G.; Parthasarathi, V.; Ramamurthi, K.; Jaisankar, P.; Varghese, B.","3-Chloro-2-methylquinolin-4(1<i>H</i>)-one","Acta Crystallographica Section E","2001","57","3","o234","o235","10.1107/S1600536801002574","","","1.5418","CuKα","","0.0548","0.0499","","","","0.1512","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200128","9.3854","0.0008","11.0958","0.0009","12.7495","0.0011","93.018","0.005","101.092","0.005","97.548","0.004","1287.47","0.19","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H36 Cl20 N4 Si -","- C30 H36 Cl20 N4 Si -","- C30 H36 Cl20 N4 Si -","1","0.5","CF6043","Stumpf, Thorsten; Bolte, Michael","Dihydridotetrakis(4-picoline-<i>N</i>)silicon dichloride chloroform hexasolvate","Acta Crystallographica Section E","2001","57","3","o209","o211","10.1107/S1600536801002239","","","0.71073","MoKα","","0.1005","0.0687","","","","0.1811","","","","","","1.194","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200129","9.506","0.001","11.337","0.002","12.96","0.002","92.28","0.01","104.06","0.01","98.2","0.01","1337","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H36 Br2 Cl18 N4 Si -","- C30 H36 Br2 Cl18 N4 Si -","- C30 H36 Br2 Cl18 N4 Si -","1","0.5","CF6044","Bolte, Michael; Faber, Alexander","Dihydridotetrakis(4-picoline-<i>N</i>)silicon dibromide chloroform hexasolvate","Acta Crystallographica Section E","2001","57","3","o207","o208","10.1107/S1600536801002227","","","0.71073","MoKα","","0.0654","0.0535","","","","0.1477","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200130","10.0849","0.0009","10.6081","0.0007","22.917","0.003","90","","90","","90","","2451.7","0.4","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C27 H26 Cl2 N P Pt -","- C27 H26 Cl2 N P Pt -","- C108 H104 Cl8 N4 P4 Pt4 -","4","1","CF6045","Ellis, Dianne D.; Spek, Anthony L.","Dichloro[2-(2-Diphenylphosphino)-<i>N</i>-(1-phenylethyl)benzylamine-<i>C</i>^{α^},<i>P</i>]platinum","Acta Crystallographica Section E","2001","57","3","m106","m108","10.1107/S1600536801002586","","","0.71073","MoKα","","0.0385","0.0309","","","","0.0646","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200131","14.3872","0.0018","8.2696","0.001","16.1442","0.0015","90","","108.327","0.007","90","","1823.4","0.4","296","1","296","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2,2'-(Cinnamylisoindolin-1,3-diylidene)bispropanedinitrile","2,2'-{2-[(E)-3-phenylprop-2-enyl]-2,3-dihydro-1H-isoindol-1,3-diylidene}- dimalononitrile","","- C23 H13 N5 -","- C23 H13 N5 -","- C92 H52 N20 -","4","1","CF6047","Crean, Colm; Gallagher, John F.; Pratt, Albert C.","2,2'-{2-[(<i>E</i>)-3-Phenylprop-2-enyl]-2,3-dihydro-1<i>H</i>-isoindol-1,3-diylidene}dimalononitrile, a π-deficient system for π···π (1:1) stacking investigations","Acta Crystallographica Section E","2001","57","3","o236","o238","10.1107/S1600536801002598","","","0.71073","MoKα","","0.059","0.042","","","","0.112","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200132","7.4634","0.0011","13.747","0.002","17.352","0.003","90","","94.862","0.012","90","","1773.9","0.5","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","Guggulsterone E","4,17(20)-(cis)-pregnadiene-3,16-dione","","- C21 H28 O2 -","- C21 H28 O2 -","- C84 H112 O8 -","4","2","CF6049","Sarkhel, Sanjay; Yadava, Umesh; Prakash, Prem; Jain, Girish K.; Singh, Satywan; Maulik, Prakash R.","Guggulsterone E, a lipid-lowering agent from <i>Commiphora mukul</i>","Acta Crystallographica Section E","2001","57","3","o285","o286","10.1107/S1600536801003142","","","0.71073","MoKα","","0.1106","0.0633","","","","0.2367","","","","","","0.921","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200133","20.9568","0.0012","10.6129","0.0006","14.7853","0.0009","90","","134.586","0.003","90","","2342","0.3","200","2","200","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","3-Hydroxy-1-(2-hydroxy-3,4-dimethoxyphenyl)-2-methylpropanone","","- C12 H16 O5 -","- C12 H16 O5 -","- C96 H128 O40 -","8","1","CF6050","Azim, Abul; Errington, William; Parmar, Virinder S.","3-Hydroxy-1-(2-hydroxy-3,4-dimethoxyphenyl)-2-methylpropanone","Acta Crystallographica Section E","2001","57","3","o266","o268","10.1107/S1600536801003518","","","0.71073","MoKα","","0.0492","0.0373","","","","0.1096","","","","","","1.064","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200134","8.3334","0.0009","8.08","0.002","27.274","0.006","90","","93.57","0.01","90","","1832.9","0.6","294","1","294","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H20 I3 N2 S2 -","- C10 H20 I3 N2 S2 -","- C40 H80 I12 N8 S8 -","4","1","CF6051","Hambley, Trevor W.; Jackson, Timothy W.; Kojima, Masaharu; Knott, Robert. B.; Lambrecht, Richard M.; Turner, Peter","6,6,9,9-Tetramethyl-1,2,5,6,9,9a-hexahydroimidazo[2,1-<i>d</i>][1,2,5]dithiazepin-1-ium triiodide","Acta Crystallographica Section E","2001","57","4","o315","o317","10.1107/S160053680100407X","","","0.7107","MoKα","","0.0921","0.0407","","0.0377","","0.0332","","","1.6","","","1.857","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200135","14.4908","0.0005","23.1755","0.0005","9.6971","0.0005","90","","91.899","0.002","90","","3254.8","0.2","90","0.1","90","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[(DEAS-bpy)Re(CO)3CL]","{4,4'-Bis[p-(diethylamino)-alfa-styryl]-2,2' -bipyridine}chlorotricarbonylrhenium(I)","","- C37 H38 Cl N4 O3 Re -","- C37 H38 Cl N4 O3 Re -","- C148 H152 Cl4 N16 O12 Re4 -","4","1","CF6052","Gerlits, O. O.; Coppens, P.","{4,4'-Bis[<i>p</i>-(diethylamino)-α-styryl]-2,2'-bipyridine}tricarbonylchlororhenium(I)","Acta Crystallographica Section E","2001","57","4","m164","m166","10.1107/S1600536801004573","","","0.71073","MoKα","","0.0421","0.0277","","","","0.0654","","","","","","0.972","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200136","10.9982","0.0017","14.85","0.002","6.7625","0.0006","96.864","0.009","93.694","0.009","81.945","0.012","1084.5","0.2","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","4-Cyanophenyl 4-n-decanyloxybenzoate","","- C24 H29 N O3 -","- C24 H29 N O3 -","- C48 H58 N2 O6 -","2","1","CF6054","Kubo, Kanji; Mori, Akira","4-Cyanophenyl 4-<i>n</i>-decanyloxybenzoate","Acta Crystallographica Section E","2001","57","4","o318","o320","10.1107/S1600536801004081","","","0.71073","MoKα","","0.2706","0.0711","","","","0.3029","","","","","","0.922","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200137","13.6308","0.0008","15.1336","0.0009","16.154","0.001","90","0.004","151.086","0.003","90","0.01","1611.2","0.2","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H17 N O4 S -","- C18 H17 N O4 S -","- C72 H68 N4 O16 S4 -","4","1","CF6057","Zerzouf, A.; El Meslouhi, H.; Salem, M.; Essassi, E. M.; Pierrot, M.","Methyl (3-hydroxy-4-oxo-2-phenyl-1,5-benzothiazepin-5-yl)acetate","Acta Crystallographica Section E","2001","57","4","o362","o363","10.1107/S1600536801004846","","","0.71073","MoKα","","0.065","0.045","","0.05","","0.048","","","1.51","","","1.364","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200138","6.8331","0.001","16.4997","0.0014","17.329","0.0013","90","","90.216","0.008","90","","1953.7","0.4","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Bis(4-nitrophenylsulfonyl)-1,3-phenylenediamine","N,N'-m-Phenylenebis(4-nitrobenzenesulfonamide)","","- C18 H14 N4 O8 S2 -","- C18 H14 N4 O8 S2 -","- C72 H56 N16 O32 S8 -","4","1","CI6000","Heigel, Erik; Bock, Hans","<i>N</i>,<i>N</i>'-<i>m</i>-Phenylenebis(4-nitrobenzenesulfonamide)","Acta Crystallographica Section E","2001","57","3","o239","o241","10.1107/S1600536801001775","","","0.71073","MoKα","","0.048","0.037","","","","0.1","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200139","8.851","0.002","11.435","0.004","5.831","0.001","94.42","0.02","92.79","0.02","107.65","0.02","559.1","0.3","173","","173","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H10 N2 O2 -","- C14 H10 N2 O2 -","- C28 H20 N4 O4 -","2","1","CI6001","Duthie, Andrew; Scammells, Peter; Katsifis, Andrew; Tiekink, Edward R. T.","(1,3-Benzo[<i>d</i>]dioxol-5-yl)(2-pyridyl)methyl cyanide","Acta Crystallographica Section E","2001","57","2","o104","o105","10.1107/S1600536801000198","","","0.7107","MoKα","","0.061","0.039","","","","0.139","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200140","9.4058","0.0005","7.7654","0.0004","10.2125","0.0006","90","","94.349","0.003","90","","743.77","0.07","291","1","291","1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H21 F O2 -","- C18 H21 F O2 -","- C36 H42 F2 O4 -","2","1","CI6002","Uerdingen, Marc; Schürmann, Markus; Preut, Hans; Krause, Norbert","3,17-Dioxo-11-fluoroandrosta-4,6-diene","Acta Crystallographica Section E","2001","57","2","o106","o107","10.1107/S1600536801000484","","","0.71073","MoKα","","0.094","0.042","","","","0.096","","","","","","0.99","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200141","19.457","0.002","6.442","0.001","24.619","0.001","90","","110.95","0.08","90","","2881.8","1.6","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","4-(p-toluidinomethylene)-2-phenyl-2-oxazolin-5-one","","- C17 H14 N2 O2 -","- C17 H14 N2 O2 -","- C136 H112 N16 O16 -","8","2","CI6003","Vasuki, G.; Parthasarathi, V.; Ramamurthi, K.; Singh, R. M; Srivastava, Ambika","2-Phenyl-4-(<i>p</i>-toluidinomethylene)-5-oxazolone","Acta Crystallographica Section E","2001","57","2","o120","o121","10.1107/S160053680100109X","","","1.5418","CuKα","","0.05","0.044","","","","0.125","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200142","17.7903","0.0015","5.5559","0.0005","18.032","0.0017","90","","94.815","0.008","90","","1776","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,5,13-trimethyl-8,10-dioxa-9-phenyl tetracyclo[7.7.1.0^2^7^0^11^16^] heptadeca-2,4,6,11,13,15-hexaene","","- C24 H22 O2 -","- C24 H22 O2 -","- C96 H88 O8 -","4","1","CI6004","Vijayalakshmi. L; Parthasarathi. V; Narasinh Dodia; Anamik Shah","1,5,13-Trimethyl-9-phenyl-8,10-dioxatetracyclo[7.7.1.0^2,7^.0^11,16^]heptadeca-2,4,6,11,13,15-hexaene","Acta Crystallographica Section E","2001","57","3","o212","o213","10.1107/S1600536801001970","","","0.71073","MoKα","","0.055","0.05","","","","0.134","","","","","","1.13","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200143","7.8683","0.0012","7.913","0.002","26.0869","0.0011","90","","90","","90","","1624.2","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","2-(3-cyano-6-methylcoumarin-4-yl)-1-(4-methoxyphenyl)ethene","3-cyano-4-[2-(4-methoxyphenyl)ethenyl]-6-methyl-2H-1-benzopyran-2-one","","- C20 H15 N O3 -","- C20 H15 N O3 -","- C80 H60 N4 O12 -","4","1","CI6005","Vijayalakshmi, L; Parthasarathi, V; Varu, Bharat; Shah, Anamik","3-Cyano-4-[2-(4-methoxyphenyl)ethenyl]-6-methyl-2<i>H</i>-1-benzopyran-2-one","Acta Crystallographica Section E","2001","57","3","o245","o246","10.1107/S1600536801002653","","","1.54175","CuKα","","0.057","0.051","","","","0.144","","","","","","1.17","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200144","10.473","0.002","24.303","0.005","3.8594","0.0008","90","","90","","90","","982.3","0.3","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","","1-(3-Chloro-4-methylphenyl)pyrroline-2,5-dione","","- C11 H8 Cl N O2 -","- C11 H8 Cl N O2 -","- C44 H32 Cl4 N4 O8 -","4","1","CI6006","Lynch, Daniel E.; McClenaghan, Ian","1-(3-Chloro-4-methylphenyl)-3-pyrroline-2,5-dione","Acta Crystallographica Section E","2001","57","2","o147","o148","10.1107/S1600536801001404","","","0.71073","MoKα","","0.078","0.052","","","","0.131","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200145","10.8071","0.0006","13.6951","0.0008","16.4285","0.0011","90","","102.78","0.004","90","","2371.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(N-benzophenoneimine) enea-carbonyl dirhenium(0)","","- C22 H11 N O9 Re2 -","- C22 H11 N O9 Re2 -","- C88 H44 N4 O36 Re8 -","4","1","CI6007","Cabeza, Javier A.; del Río, Ignacio; Zuñiga-Villarreal, Noé; García-Granda, Santiago","(Benzophenone imine-<i>N</i>)nonacarbonyldirhenium(0)(<i>Re</i>—<i>Re</i>)","Acta Crystallographica Section E","2001","57","3","m130","m131","10.1107/S1600536801003658","","","0.71073","MoKα","","0.117","0.034","","","","0.094","","","","","","0.995","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200146","13.281","0.003","11.161","0.002","17.756","0.003","90","","107.49","0.01","90","","2510.3","0.9","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-1-Benzyl-2-(p-methoxystyryl)-3-(p-tolyl)-1,2,3,4-tetrahydroquinazolin-4-one","","- C31 H28 N2 O2 -","- C31 H28 N2 O2 -","- C124 H112 N8 O8 -","4","1","CI6008","Mukherjee, Monika; Maiti, Susim; Chaudhuri, Gopeswar; Helliwell, Madeleine; Kundu, Nitya G.","(<i>E</i>)-1-Benzyl-2-(<i>p</i>-methoxystyryl)-3-(<i>p</i>-tolyl)-1,2,3,4-tetrahydroquinazolin-4-one","Acta Crystallographica Section E","2001","57","3","o247","o249","10.1107/S1600536801002811","","","1.5418","CuKα","","0.078","0.047","","","","0.182","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200147","14.072","0.002","17.617","0.002","14.84","0.002","90","","95.425","0.009","90","","3662.5","0.8","203","2","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(η^4^-cycloocta-1,5-diene)rhodium(I)trifluoromethanesulfonate","","- C17 H24 F3 O3 Rh S -","- C17 H24 F3 O3 Rh S -","- C136 H192 F24 O24 Rh8 S8 -","8","1","CI6009","Dahlenburg, Lutz; Osthoff, Nils; Heinemann, Frank","Bis(η^4^-cycloocta-1,5-diene)rhodium(I) trifluoromethanesulfonate","Acta Crystallographica Section E","2001","57","3","m117","m118","10.1107/S1600536801003208","","","0.71073","MoKα","","","0.058","","","","0.154","","","","","","1.02","","","","has coordinates,has Fobs","192333","2020-10-21","18:00:00",""
"2200148","8.6209","0.0002","13.9266","0.0004","16.4518","0.0006","90","","90","","90","","1975.2","0.1","200","1","200","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","6,9-Methano-4-methyl-3a,4,5a,6,9,10-hexahydro-5-oxa-1H,3H-furano[3,4-c]- isoindol-3-one","","- C11 H13 N O3 -","- C11 H13 N O3 -","- C88 H104 N8 O24 -","8","1","CI6010","Tam, William; Tranmer, Geoffrey K.; Lough, Alan J.","6,9-Methano-4-methyl-3a,4,5a,6,9,10-hexahydro-5-oxa-1<i>H</i>,3<i>H</i>-furano[3,4-<i>c</i>]isoindol-3-one","Acta Crystallographica Section E","2001","57","3","o269","o270","10.1107/S1600536801003270","","","0.71073","MoKα","","0.06","0.043","","","","0.112","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200149","12.379","0.003","9.389","0.002","12.995","0.003","90","","116.6","0.03","90","","1350.5","0.6","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Chloro-3-(4-methylpiperizino)-1,4-naphthoquinone","","- C15 H15 Cl N2 O2 -","- C15 H15 Cl N2 O2 -","- C60 H60 Cl4 N8 O8 -","4","1","CI6012","Lynch, Daniel E.; McClenaghan, Ian","2-Chloro-3-(4-methylpiperazino)-1,4-naphthoquinone","Acta Crystallographica Section E","2001","57","3","o287","o288","10.1107/S1600536801003634","","","0.71073","MoKα","","0.062","0.042","","","","0.116","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200150","10.074","0.001","18.139","0.002","11.3858","0.0009","90","","105.426","0.008","90","","2005.6","0.3","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","1-(dicyclohexylthiophosphinoyl)-N-phenylthioformamide","","","- C19 H28 N P S2 -","- C19 H28 N P S2 -","- C76 H112 N4 P4 S8 -","4","1","CI6013","Horn, E.; Kurosawa, K.; Tiekink, E. R. T.","Monoclinic form of 1-(dicyclohexylthiophosphinoyl)-<i>N</i>-phenylthioformamide","Acta Crystallographica Section E","2001","57","4","o321","o322","10.1107/S160053680100410X","","","0.7107","MoKα","","","0.04","","","","0.028","","","","","","1.688","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200151","13.495","0.002","17.324","0.003","13.471","0.002","90","","93.01","0.01","90","","3145","0.9","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","Bis[di-n-butylbis(thiophene-2-carboxylato-O,O')tin(VI) oxide]","octa-n-butyl-1κ^2^C,2κ^2^C,3κ^2^C,4κ^2^C-di-μ~3~-oxo- 1:2:3κ^3^O;2:3:4:κ^3^O-tetrakis(thiophene-2-carboxylate)- 1κO;1:2κ^2^O:O';3:4κ^2^O:O';4κO-tetratin(VI)","","- C52 H84 O10 S4 Sn4 -","- C52 H84 O10 S4 Sn4 -","- C104 H168 O20 S8 Sn8 -","2","1","CI6014","Yahyi, Abderrahmane; Et-touhami, Abdelkader; Zidane, Ismail; Benchat, Nour-eddine; El-Bali, Brahim; Bolte, Michael","Redetermination of bis[di-<i>n</i>-butylbis(thiophene-2-carboxylato-<i>O</i>,<i>O</i>')tin(VI) oxide] at low temperature","Acta Crystallographica Section E","2001","57","4","m148","m150","10.1107/S1600536801004214","","","0.71073","MoKα","","0.027","0.022","","","","0.049","","","","","","0.96","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200152","13.4255","0.0003","21.1335","0.0006","28.6552","0.0008","90","","90","","90","","8130.3","0.4","200","2","200","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","(Benzylamine-N)(η^5^-cyclopentadienyl)bis(triphenylphosphine-P)ruthenium(II) tetrafluoroborate","","- C48 H44 B F4 N P2 Ru -","- C48 H44 B F4 N P2 Ru -","- C384 H352 B8 F32 N8 P16 Ru8 -","8","1","CI6016","Cabeza, Javier A.; del Río, Ignacio; Navarro, M. Elena; García-Granda, Santiago","(Benzylamine-<i>N</i>)(η^5^-cyclopentadienyl)bis(triphenylphosphine-<i>P</i>)ruthenium(II) tetrafluoroborate","Acta Crystallographica Section E","2001","57","4","m162","m163","10.1107/S1600536801004469","","","1.54179","CuKα","","0.11","0.047","","","","0.133","","","","","","0.9","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200153","34.115","0.006","10.4377","0.0017","7.484","0.003","90","","90","","90","","2664.9","1.2","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C15 H14 N2 O S -","- C15 H14 N2 O S -","- C120 H112 N16 O8 S8 -","8","1","CI6018","Scammells, Peter J.; Tranberg, C. Elisabet; Tiekink, Edward R. T.","6,7-Dimethyl-5-phenyl-1<i>H</i>-thieno[2,3-<i>e</i>][1,4]diazepin-2(3<i>H</i>)-one","Acta Crystallographica Section E","2001","57","4","o344","o345","10.1107/S1600536801004585","","","0.7107","MoKα","","0.08","0.045","","","","0.152","","","","","","1.024","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200154","12.809","0.003","8.608","0.002","19.482","0.004","90","","95.81","0.02","90","","2137","0.8","293","2","293","2","","","","","","","","6","P 1 n 1","P -2yac","7","bis-clemizolchlorocopper(II)chloride","Dichloro[1-(p-chlorophenylmethyl)-2-(1-pyrrolidinylmethyl)benzimidazole- N,N'']copper(II) Ethanol Solvate","","- C40 H46 Cl4 Cu N6 O -","- C40 H46 Cl4 Cu N6 O -","- C80 H92 Cl8 Cu2 N12 O2 -","2","1","CV6000","Braitenbach, Kristin; Parvez, Masood","Chlorobis(clemizole)copper(II) chloride ethanol solvate","Acta Crystallographica Section E","2001","57","2","m67","m69","10.1107/S1600536801001039","","","1.54178","CuKα","","0.053","0.051","","","","0.142","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200155","11.2481","0.0004","7.1112","0.0003","16.1263","0.0007","90","","99.043","0.005","90","","1273.87","0.09","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,4-bis(dinitromethyl)cubane","1,4-bis(dinitromethyl)cubane","","- C10 H8 N4 O8 -","- C10 H8 N4 O8 -","- C40 H32 N16 O32 -","4","1","CV6001","Deschamps, Jeffrey R.; Moriarty, R. M.; Gilardi, Richard D.","1,4-Bis(dinitromethyl)cubane","Acta Crystallographica Section E","2001","57","2","o149","o150","10.1107/S1600536801001374","","","1.54178","CuKα","","0.054","0.05","","","","0.139","","","","","","1.026","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200156","7.494","0.001","7.974","0.002","10.303","0.002","100.58","0.03","98.38","0.03","107.98","0.03","562","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","1-(5-chloropyridin-2-yl)-isoindole-1,3-dione","","- C13 H7 Cl N2 O2 -","- C13 H7 Cl N2 O2 -","- C26 H14 Cl2 N4 O4 -","2","1","CV6002","Holband, Jolanta; Jurkin, Magdalena; Wójcik, Grażyna; Holband, Tomasz","2-(5-Chloropyridin-2-yl)-2,3-dihydro-1<i>H</i>-isoindole-1,3-dione","Acta Crystallographica Section E","2001","57","3","o250","o251","10.1107/S1600536801003026","","","0.71073","MoKα","","0.0414","0.0403","","","","0.1195","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200157","11.1046","0.0012","11.4205","0.0011","12.7004","0.0009","72.632","0.007","78.905","0.007","62.198","0.011","1357.1","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C32 H28 Si2 -","- C32 H28 Si2 -","- C64 H56 Si4 -","2","1","CV6003","Lee, Suk Joong; Han, Byung Hee; Sung, Chang-Keun; Kim, Jin-Gyu; Suh, Il-Hwan","(<i>E</i>)-1-Diphenylsilyl-2-triphenylsilylethene","Acta Crystallographica Section E","2001","57","3","o271","o272","10.1107/S1600536801003439","","","0.71069","MoKα","","0.1363","0.0627","","","","0.1461","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200158","5.392","0.0018","6.858","0.003","8.96","0.006","71.88","0.04","74.04","0.03","85.41","0.04","302.8","0.3","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H16 O4 S2 -","- C10 H16 O4 S2 -","- C10 H16 O4 S2 -","1","0.5","CV6004","Koskimies, Jorma; Näsäkkälä, Matti; Mutikainen, Ilpo","1,8-Dioxa-4,11-dithiacyclotetradecane-2,9-dione","Acta Crystallographica Section E","2001","57","3","o261","o263","10.1107/S1600536801003038","","","0.71073","MoKα","","0.0501","0.0484","","","","0.1294","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200159","9.0561","0.0004","11.533","0.0005","28.0118","0.0013","90","","90","","90","","2925.7","0.2","213","2","213","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(4SR,6SR)-6-(2-Phenylethyl)-4-phenyl-1,4,3-oxathiazin-2(6H)-one","","- C17 H17 N O2 S -","- C17 H17 N O2 S -","- C136 H136 N8 O16 S8 -","8","1","CV6005","Schlummer, Björn; Massa, Werner; Bach, Thorsten","A new heterocylic ring system in (4<i>SR</i>,6<i>SR</i>)-6-(2-phenylethyl)-4-phenyl-1,4,3-oxathiazin-2(6<i>H</i>)-one","Acta Crystallographica Section E","2001","57","3","o252","o253","10.1107/S160053680100304X","","","1.54178","CuKα","","0.0518","0.0385","","","","0.1055","","","","","","1.047","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200160","10.2648","0.0005","23.4667","0.0011","13.204","0.0006","90","","103.847","0.001","90","","3088.2","0.3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline tricarbonyl acetonitrile rhenium hexafluorophosphate","","- C31 H23 F6 N3 O3 P Re -","- C31 H23 F6 N3 O3 P Re -","- C124 H92 F24 N12 O12 P4 Re4 -","4","1","CV6006","Sun, Shih-Sheng; Zavalij, Peter Y.; Lees, Alistair J.","Acetonitriletricarbonyl(2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline)rhenium(I) hexafluorophosphate","Acta Crystallographica Section E","2001","57","3","m119","m121","10.1107/S1600536801003440","","","0.71073","MoKα","","0.0745","0.0419","","","","0.0998","","","","","","0.933","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200161","5.5475","0.0008","37.69","0.005","7.4742","0.0006","90","","96.462","0.009","90","","1552.8","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Eupatorin","5,3'-dihydroxy-6,7,4'-trimethoxyflavone","","- C18 H16 O7 -","- C18 H16 O7 -","- C72 H64 O28 -","4","1","CV6007","Parvez, Masood; Riaz, Muhammad; Malik, Abdul","Eupatorin","Acta Crystallographica Section E","2001","57","3","o289","o291","10.1107/S1600536801003609","","","1.54178","CuKα","","0.045","0.038","","","","0.121","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200162","9.2706","0.0013","10.4565","0.0008","15.094","0.003","90","","90","","90","","1463.2","0.4","300","","300","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","dihydroparthenolide diol","2,10-dihydroxy-1,6,10-trimethyl-4,14-dioxztricyclo[9.2.1.0^3,7^]tetradecan-5-one","","- C15 H24 O5 -","- C15 H24 O5 -","- C60 H96 O20 -","4","1","CV6008","Rugutt, Joseph K.; Fronczek, Frank R.; Franzblau, Scott G.; Warner, Isiah M.","Dihydroparthenolide diol, a novel sesquiterpene lactone","Acta Crystallographica Section E","2001","57","4","o323","o325","10.1107/S1600536801004111","","","1.54184","CuKα","","0.049","0.044","","","","0.128","","","","","","1.068","","","","has coordinates,has Fobs","211399","2020-10-21","18:00:00",""
"2200163","19.028","0.003","19.166","0.003","9.4466","0.0005","90","","90","","90","","3445.1","0.8","296","2","296","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Ethyl 4-(2,3,5,6-tetrahydro-3,3-dimethyl-5,6-dioxo-1,2-cycloheptapyrazol-2-yl)- benzoate","","- C19 H18 N2 O4 -","- C19 H18 N2 O4 -","- C152 H144 N16 O32 -","8","1","CV6009","Kubo, Kanji; Mori, Akira","Ethyl 4-(2,3,5,6-tetrahydro-3,3-dimethyl-5,6-dioxo-1,2-cycloheptapyrazol-2-yl)benzoate","Acta Crystallographica Section E","2001","57","4","o328","o329","10.1107/S1600536801004445","","","0.71073","MoKα","","0.285","0.0544","","","","0.1581","","","","","","0.89","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200164","8.1172","0.0011","22.523","0.004","12.5352","0.0013","90","","105.362","0.012","90","","2209.9","0.6","200","2","200","2","","","","","","","","3","P 1 21 1","P 2yb","4","bis Ketal","(-)-(4R,5R,4'''R,5'''R)-Dispiro[1,3-(4,5-dimethyl)- dioxalane-2,3'-[1',5'-(1'',8''-naphthalene)]- bicyclo[3.3.0]octane-7',2'''-[1,3]- (4''',5'''-dimethyl)-dioxalane]","","- C26 H30 O4 -","- C26 H30 O4 -","- C104 H120 O16 -","4","2","CV6010","Parvez, Masood; Simion, Dan V.; Sorensen, Ted S.","A chiral <i>C</i>~2~ axially symmetric naphthalene derivative of a bicyclooctane diketal","Acta Crystallographica Section E","2001","57","4","o346","o348","10.1107/S1600536801004457","","","0.71069","MoKα","","0.151","0.063","","","","0.239","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200165","9.799","0.003","19.331","0.005","9.054","0.003","90","","90","","90","","1715","0.9","200","2","200","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","bis Dioxane","(-)-(4R,5R,4''R,5''R)-4,5,4'',5''-Tetramethyldispiro[1,3-dioxalane- 2,1'(2'H)-acenaphthylene-2',2''-1,3-dioxalane]","","- C20 H22 O4 -","- C20 H22 O4 -","- C80 H88 O16 -","4","1","CV6011","Parvez, Masood; Simion, Dan V.; Sorensen, Ted S.","A novel chiral <i>C</i>~2~ axially symmetric acenaphthoquinone diketal","Acta Crystallographica Section E","2001","57","4","o366","o367","10.1107/S1600536801005049","","","0.71069","MoKα","","0.154","0.04","","","","0.167","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200166","9.338","0.0003","27.395","0.0008","7.457","0.0008","90","","90.568","0.001","90","","1907.5","0.2","290","1","290","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","n-pentylammonium dihydrogenarsenate","","- C5 H16 As N O4 -","- C5 H16 As N O4 -","- C40 H128 As8 N8 O32 -","8","2","CV6012","Fábry, Jan; Krupková, Radmila; Vaněk, Přemysl; Císařová, Ivana","Ferroelastic <i>n</i>-pentylammonium dihydrogenarsenate","Acta Crystallographica Section E","2001","57","4","o349","o352","10.1107/S160053680100472X","","","0.71073","MoKα","","0.0703","0.0355","","0.0454","","0.0454","","","2.02","1.63","1.63","2.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200167","7.6279","0.0009","8.4019","0.001","8.6291","0.0004","97.171","0.006","99.673","0.006","95.728","0.01","536.76","0.1","296","2","296","2","","","","","","","","5","P -1","-P 1","2","co-crystal with 1,4-bis[(4-pyridyl)ethynyl]benzene and chloranilic acid","1,4-bis[(4-pyridinium)ethynyl]benzene chloranilate","","- C26 H14 Cl2 N2 O4 -","- C26 H14 Cl2 N2 O4 -","- C26 H14 Cl2 N2 O4 -","1","0.5","CV6013","Akhtaruzzaman, Md.; Tomura, Masaaki; Yamashita, Yoshiro","One-dimensional hydrogen-bonded molecular tapes in 1,4-bis[(4-pyridinio)ethynyl]benzene chloranilate","Acta Crystallographica Section E","2001","57","4","o353","o355","10.1107/S1600536801004731","","","1.54178","CuKα","","0.1227","0.0534","","","","0.161","","","","","","0.994","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200168","16.827","0.002","14.1071","0.0016","16.76","0.004","90","","93.95","0.016","90","","3969","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H16 N4 O3 S4 -","- C16 H16 N4 O3 S4 -","- C128 H128 N32 O24 S32 -","8","2","CV6014","Cho, Nam Sook; Hong, Soon Il; Choo, Geum-Hong; Kim, Jin-Gyu; Suh, Il-Hwan","1,5-[5,5'-(1,3-Phenylenedimethylenedithio)bis(2,3-dihydro-2-oxo-1,3,4-thiadiazol-3-yl)]-3-oxapentane","Acta Crystallographica Section E","2001","57","4","o368","o369","10.1107/S1600536801005116","","","0.71069","MoKα","","0.1292","0.0607","","","","0.1423","","","","","","1.015","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200169","14.7301","0.0002","12.0254","0.0002","23.796","0.0001","90","","90","","90","","4215.11","0.09","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Bis(μ-N-butyl-N-ethyldithiocarbamato-S:S')bis[(N-butyl-N- ethyldithiocarbamato)zinc(II)]","","- C28 H56 N4 S8 Zn2 -","- C28 H56 N4 S8 Zn2 -","- C112 H224 N16 S32 Zn8 -","4","0.5","NA6028","Baba, Ibrahim; Farina, Yang; Kassim, Karimah; Othman, A. Hamid; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Ng, Seik Weng","Bis(μ-<i>N</i>-butyl-<i>N</i>-ethyldithiocarbamato-<i>S</i>:<i>S</i>')bis[(<i>N</i>-butyl-<i>N</i>-ethyldithiocarbamato)zinc(II)]","Acta Crystallographica Section E","2001","57","2","m55","m56","10.1107/S1600536800020808","","","0.71073","MoKα","","0.083","0.047","","","","0.144","","","","","","0.959","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200170","30.285","0.008","5.3022","0.0013","22.317","0.006","90","","102.263","0.004","90","","3501.8","1.6","150","2","150","2","","","","","","","","4","C 1 2 1","C 2y","5","","L-Phenylalanine nitrate (4/1)","","- C9 H11.25 N1.25 O2.75 -","- C9 H11.25 N1.25 O2.75 -","- C144 H180 N20 O44 -","16","4","NA6033","Görbitz, Carl Henrik","<small>L</small>-Phenylalanine nitrate (4/1)","Acta Crystallographica Section E","2001","57","2","o192","o194","10.1107/S1600536801000575","","","0.71073","MoKα","","0.134","0.113","","","","0.269","","","","","","1.629","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200171","4.1043","0.0007","7.453","0.0013","9.2875","0.0016","87.777","0.003","78.619","0.003","87.281","0.003","278.07","0.08","203","2","203","2","","","","","","","","5","P -1","-P 1","2","CrBr2.2THF","dibromobis(tetrahydrofuran-O)chromium(II)","","- C8 H16 Br2 Cr O2 -","- C8 H16 Br2 Cr O2 -","- C8 H16 Br2 Cr O2 -","1","0.5","NA6034","Twamley, Brendan; Zehnder, Ralph; Shapiro, Pamela J.","Solvated CrBr~2~(thf)~2~, a linear chain in the solid state","Acta Crystallographica Section E","2001","57","2","m80","m81","10.1107/S1600536801001660","","","0.71073","MoKα","","0.031","0.027","","","","0.071","","","","","","1.08","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200172","8.7856","0.0005","8.2058","0.0005","22.99","0.002","90","","95.513","0.006","90","","1649.7","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(2-Pyridyl)-8H-pyrrolo[2,1-c]-s-triazolo[4,3-a][1,4]benzodiazepinium chloride","","- C18 H14 Cl N5 -","- C18 H14 Cl N5 -","- C72 H56 Cl4 N20 -","4","1","NA6035","Kubicki, Maciej; Codding, Penelope W.","1-(2-Pyridyl)-8<i>H</i>-pyrrolo[2,1-<i>c</i>]-<i>s</i>-triazolo[4,3-<i>a</i>][1,4]benzodiazepinium chloride","Acta Crystallographica Section E","2001","57","2","o122","o124","10.1107/S1600536801000952","","","1.54178","CuKα","","0.048","0.048","","","","0.113","","","","","","1.257","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200173","8.6673","0.0002","14.6092","0.0003","14.4783","0.0005","90","","107.287","0.001","90","","1750.46","0.08","150","1","150","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-(4-bromophenyl)-3,7,7-trimethyl-4,7,8,9-tetrahydro-2H-pyrazolo[3,4-b] quinolin-5(6H)-one","","- C19 H20 Br N3 O -","- C19 H20 Br N3 O -","- C76 H80 Br4 N12 O4 -","4","1","NA6036","Cannon, Debbie; Quesada, Antonio; Quiroga, Jairo; Mejía, Diana; Insuasty, Braulio; Abonia, Rodrigo; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo; Low, John Nicolson","4-(4-Bromophenyl)-3,7,7-trimethyl-4,7,8,9-tetrahydro-2<i>H</i>-pyrazolo[3,4-<i>b</i>]quinolin-5(6<i>H</i>)-one","Acta Crystallographica Section E","2001","57","2","o151","o153","10.1107/S1600536801001453","","","0.71073","MoKα","","0.047","0.035","","","","0.096","","","","","","0.98","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200174","8.582","0.0003","14.7031","0.0005","14.5369","0.0008","90","","106.061","0.0015","90","","1762.7","0.13","150","1","150","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,7,7-Trimethyl-4-(4-methoxyphenyl)-4,7,8,9-tetrahydro-2H-pyrazolo[3,4-b]- quinolin-5(6H)-one (4).","","- C20 H23 N3 O2 -","- C20 H23.06 N3 O2 -","- C80 H92.24 N12 O8 -","4","1","NA6037","Cannon, Debbie; Quesada, Antonio; Quiroga, Jairo; Mejía, Diana; Insuasty, Braulio; Abonia, Rodrigo; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo; Low, John Nicolson","4-(4-Methoxyphenyl)-3,7,7-trimethyl-4,7,8,9-tetrahydro-2<i>H</i>-pyrazolo[3,4-<i>b</i>]quinolin-5(6<i>H</i>)-one","Acta Crystallographica Section E","2001","57","2","o154","o156","10.1107/S1600536801001465","","","0.71073","MoKα","","0.092","0.053","","","","0.141","","","","","","1.025","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200175","10.087","0.0005","14.1978","0.0005","11.1928","0.0008","90","","96.034","0.0014","90","","1594.08","0.15","150","1","150","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,7,7-Trimethyl-4-phenyl-4,7,8,9-tetrahydro-2H-pyrazolo[3,4-b]quinolin-5- (6H)-one","","- C19 H21 N3 O -","- C19 H21 N3 O -","- C76 H84 N12 O4 -","4","1","NA6038","Cannon, Debbie; Quesada, Antonio; Quiroga, Jairo; Mejía, Diana; Insuasty, Braulio; Abonia, Rodrigo; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo; Low, John Nicolson","3,7,7-Trimethyl-4-phenyl-4,7,8,9-tetrahydro-2<i>H</i>-pyrazolo[3,4-<i>b</i>]quinolin-5-(6<i>H</i>)-one","Acta Crystallographica Section E","2001","57","2","o157","o159","10.1107/S1600536801001477","","","0.71073","MoKα","","0.132","0.056","","","","0.148","","","","","","0.941","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200176","9.1222","0.0018","15.281","0.003","14.346","0.003","90","","106.13","0.03","90","","1921.1","0.7","150","1","150","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,7,7-Trimethyl-4-(β-naphthyl)-4,7,8,9-tetrahydro-2H-pyrazolo[3,4-b]- quinolin-5(6H)-one","","- C23 H23 N3 O -","- C23 H23 N3 O -","- C92 H92 N12 O4 -","4","1","NA6039","Cannon, Debbie; Quesada, Antonio; Quiroga, Jairo; Mejía, Diana; Insuasty, Braulio; Abonia, Rodrigo; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo; Low, John Nicolson","3,7,7-Trimethyl-4-(β-naphthyl)-4,7,8,9-tetrahydro-2<i>H</i>-pyrazolo[3,4-<i>b</i>]quinolin-5(6<i>H</i>)-one","Acta Crystallographica Section E","2001","57","2","o160","o162","10.1107/S1600536801001489","","","0.71073","MoKα","","0.086","0.051","","","","0.137","","","","","","1.029","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200177","8.948","0.001","27.128","0.003","9.045","0.001","90","","94.3","0.01","90","","2189.4","0.4","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C23 H30 O6 -","- C23 H30 O6 -","- C92 H120 O24 -","4","1","NA6040","Bolte, Michael; Degen, Alexander; Rühl, Stephan","2,2'-[(3-Hydroxyphenyl)methylene]bis(3-hydroxy-5,5-dimethyl-2-cyclohexen-1-one) hydrate","Acta Crystallographica Section E","2001","57","2","o170","o171","10.1107/S1600536801001593","","","0.71073","MoKα","","0.0503","0.0405","","","","0.115","","","","","","1.006","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200178","33.845","0.004","7.214","0.001","22.605","0.003","90","","128.82","0.01","90","","4300.1","1.1","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C24 H30 O5 -","- C24 H30 O5 -","- C192 H240 O40 -","8","1","NA6041","Bolte, Michael; Degen, Alexander; Rühl, Stephan","Redetermination of 3,3,6,6-tetramethyl-4a-hydroxy-9-(<i>ortho</i>-methoxyphenyl)-2,3,4,4a,5,6,7,8,9,9a-decahydro-1<i>H</i>-xanthene-1,8-dione at 173K","Acta Crystallographica Section E","2001","57","2","o172","o173","10.1107/S160053680100160X","","","0.71073","MoKα","","0.047","0.0407","","","","0.111","","","","","","1.039","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200179","10.7112","0.0003","10.8297","0.0003","23.6321","0.0005","90","","90","","90","","2741.3","0.12","150","1","150","1","","","","","","","","3","P b c a","-P 2ac 2ab","61","","6-(1H-1,2,3-Benzotriazol-1-yl)-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinoline","","- C17 H16 N4 -","- C17 H16 N4 -","- C136 H128 N32 -","8","1","NA6042","Quesada, Antonio; Cannon, Debbie; Quiroga, Jairo; .; Insuasty, Braulio; Abonia, Rodrigo; Albornoz, Andrea; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo; Low, John Nicolson","6-(1<i>H</i>-1,2,3-Benzotriazol-1-yl)-1,2,5,6-tetrahydro-4<i>H</i>-pyrrolo[3,2,1-<i>ij</i>]quinoline","Acta Crystallographica Section E","2001","57","2","o178","o179","10.1107/S1600536801001672","","","0.71073","MoKα","","0.0667","0.0446","","","","0.1115","","","","","","1.272","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200180","6.3459","0.0013","19.235","0.004","11.144","0.002","90","","103.07","0.03","90","","1325","0.5","150","1","150","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-(1,3-Benzothiazol-2-yliminomethyl)-2,2-dimethyl-1,3-dioxane-4,6-dione","","- C14 H12 N2 O4 S -","- C14 H12 N2 O4 S -","- C56 H48 N8 O16 S4 -","4","1","NA6043","Cannon, Debbie; Quesada, Antonio; Quiroga, Jairo; Insuasty, Braulio; Abonia, Rodrigo; Hernández, Pedro; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo; Low, John Nicolson","5-(1,3-Benzothiazol-2-yliminomethyl)-2,2-dimethyl-1,3-dioxane-4,6-dione","Acta Crystallographica Section E","2001","57","2","o180","o181","10.1107/S1600536801001684","","","0.71073","MoKα","","0.0671","0.0451","","","","0.1231","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200181","5.5421","0.0002","11.5858","0.0005","23.8057","0.0013","90","","90","","90","","1528.56","0.12","150","1","150","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","6-(2-Hydroxybenzoyl)-2-(4-nitrophenyl)pyrazolo[1,5-a]pyrimidine","","- C19 H12 N4 O4 -","- C19 H12 N4 O4 -","- C76 H48 N16 O16 -","4","1","NA6044","Cannon, Debbie; Quesada, Antonio; Quiroga, Jairo; Insuasty, Braulio; Abonia, Rodrigo; Mejía, Diana; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo; Low, John Nicolson","6-(2-Hydroxybenzoyl)-2-(4-nitrophenyl)pyrazolo[1,5-<i>a</i>]pyrimidine","Acta Crystallographica Section E","2001","57","2","o182","o184","10.1107/S1600536801001696","","","0.71073","MoKα","","0.0935","0.0469","","","","0.1243","","","","","","1.066","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200182","19.0427","0.0002","9.6024","0.0004","16.6135","0.0007","90","","90","","90","","3037.87","0.18","150","1","150","1","","","","","","","","4","P n a 21","P 2c -2n","33","","5,5-Dimethyl-3-[(5-phenyl-1H-pyrazol-3-yl)amino]cyclohex-2-en-1-one","","- C17 H19 N3 O -","- C17 H19 N3 O -","- C136 H152 N24 O8 -","8","2","NA6045","Quesada, Antonio; Cannon, Debbie; Quiroga, Jairo; Insuasty, Braulio; Abonia, Rodrigo; Mejía, Diana; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo; Low, John Nicolson","5,5-Dimethyl-3-[(5-phenyl-1<i>H</i>-pyrazol-3-yl)amino]cyclohex-2-en-1-one","Acta Crystallographica Section E","2001","57","2","o185","o186","10.1107/S1600536801001702","","","0.71073","MoKα","","0.0736","0.0516","","","","0.1228","","","","","","0.993","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200183","5.6606","0.0002","11.7048","0.0005","21.6815","0.001","90","","94.797","0.0015","90","","1431.5","0.1","150","1","150","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","6-(2-hydroxybenzoyl)-2-phenylpyrazolo[1,5-a]pyrimidine","","- C19 H13 N3 O2 -","- C19 H13 N3 O2 -","- C76 H52 N12 O8 -","4","1","NA6046","Quesada, Antonio; Cannon, Debbie; Quiroga, Jairo; Mejía, Diana; Insuasty, Braulio; Abonia, Rodrigo; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo; Low, John Nicolson","6-(2-Hydroxybenzoyl)-2-phenylpyrazolo[1,5-<i>a</i>]pyrimidine","Acta Crystallographica Section E","2001","57","2","o187","o188","10.1107/S1600536801001714","","","0.71073","MoKα","","0.0742","0.0458","","","","0.136","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200184","3.9972","0.0004","14.0618","0.0017","9.5477","0.0011","90","","100.6","0.007","90","","527.5","0.1","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","2-[4-(Dimethylamino)phenyl]ethylene-1,1-dinitrile","","- C12 H11 N3 -","- C12 H11 N3 -","- C24 H22 N6 -","2","1","NA6047","Wang, Kezhi; Wang, Zheming; Yan, Chunhua","2-[4-(Dimethylamino)phenyl]ethylene-1,1-dinitrile","Acta Crystallographica Section E","2001","57","3","o214","o215","10.1107/S1600536801001957","","","0.71073","MoKα","","0.0485","0.0386","","","","0.1057","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200185","7.5468","0.0015","9.874","0.002","20.378","0.004","95.2","0.03","91.64","0.03","110.15","0.03","1416.8","0.6","150","1","150","1","","","","","","","","3","P -1","-P 1","2","","Tetradecyl-triphenylstannane","","- C32 H44 Sn -","- C32 H44 Sn -","- C64 H88 Sn2 -","2","1","NA6048","Allan, Gillian, M.; Low, John Nicolson; Skakle, Janet M.S.; Wardell, James L.; Wardell, Solange M. S. V.","Triphenyltetradecylstannane","Acta Crystallographica Section E","2001","57","3","m95","m96","10.1107/S1600536801002331","","","0.71073","MoKα","","0.0531","0.0345","","","","0.0708","","","","","","0.998","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200186","6.564","0.0003","9.7316","0.0005","28.4686","0.0014","90","","90","","90","","1818.52","0.15","291","1","291","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H28 O4 -","- C20 H28 O4 -","- C80 H112 O16 -","4","1","NA6049","Zelder, Claudia; Schürmann, Markus; Preut, Hans; Krause, Norbert","Cyclodec-2'-ynyl (1<i>S</i>,1'<i>R</i>)-(‒)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate","Acta Crystallographica Section E","2001","57","3","o216","o217","10.1107/S1600536801002380","","","0.71073","MoKα","","0.1312","0.0395","","","","0.0846","","","","","","0.963","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200187","14.882","0.003","10.366","0.002","24.064","0.003","90","","121.987","0.011","90","","3148.6","1","293","1","293","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N-dimethyl-5-dimethylamino-3-(pyrrole)-2,4-pentadieniminium tetrafluoroborate","","- C13 H20 B F4 N3 -","- C13 H20 B F4 N3 -","- C104 H160 B8 F32 N24 -","8","2","NA6050","Ferguson, George; McAlees, Alan J.; McCrindle, Robert","<i>N</i>,<i>N</i>-Dimethyl-5-dimethylamino-3-(1-pyrrolyl)-2,4-pentadieniminium tetrafluoroborate","Acta Crystallographica Section E","2001","57","3","o295","o297","10.1107/S1600536801003166","","","0.71073","MoKα","","0.1429","0.0611","","","","0.2197","","","","","","1.09","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200188","16.909","0.003","6.525","0.001","9.622","0.002","90","","101.46","0.03","90","","1040.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","morpholinyl tert-butyl urea","N-tert-Butylmorpholine-4-carboxamide","","- C9 H18 N2 O2 -","- C9 H18 N2 O2 -","- C36 H72 N8 O8 -","4","1","NA6051","Kruszynski, Rafal; Bartczak, Tadeusz J.; Lach, Dariusz; Brandt, Krystyna","<i>N</i>-<i>tert</i>-Butylmorpholine-4-carboxamide","Acta Crystallographica Section E","2001","57","3","o273","o275","10.1107/S1600536801003282","","","0.71073","MoKα","","0.07","0.0649","","","","0.1722","","","","","","1.134","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200189","13.667","0.002","15.046","0.002","17.764","0.002","90","","100.32","0.01","90","","3593.8","0.8","297","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C36 H48 Br Co N2 O6 -","- C36 H48 Br Co N2 O6 -","- C144 H192 Br4 Co4 N8 O24 -","4","2","NA6052","Ohba, Shigeru; Nagata, Takushi; Yamada, Tohru","(‒)~D~-Aquabromo{3,3'-[(1<i>R</i>,2<i>R</i>)-1,2-bis(2,4,6-trimethylphenyl)ethane-1,2-diylbis(nitrilomethylidyne)]bis(pentane-2,4-dionato)-<i>N</i>,<i>N</i>',<i>O</i>,<i>O</i>'}cobalt(III) tetrahydrofuran solvate","Acta Crystallographica Section E","2001","57","3","m124","m126","10.1107/S1600536801003592","","","0.71073","MoKα","","","0.0638","","","","0.1859","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200190","6.277","0.0001","19.708","0.0004","11.9399","0.0001","90","","101.64","","90","","1446.67","0.04","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-(1-Acetamido-3-methyl)butyl-5methyl-2,4-imidazolidinedione","","- C11 H21 N3 O4 -","- C11 H21 N3 O4 -","- C44 H84 N12 O16 -","4","1","NA6053","SethuSankar, K.; Thennarasu, S.; Velmurugan, D.; Shanmuga Sundara Raj, S.; Fun, H.-K.; Perumal, P.T.","5-(1-Acetamido-3-methylbutyl)-5-methylimidazolidine-2,4-dione monohydrate","Acta Crystallographica Section E","2001","57","4","o377","o379","10.1107/S1600536801004561","","","0.71073","MoKα","","0.0815","0.0572","","","","0.1662","","","","","","0.941","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200191","9.8535","0.0007","14.888","0.001","12.5317","0.0008","90","","108.805","0.005","90","","1740.3","0.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Diethyl 2-(acridin-9-ylmethylene)malonate","","- C21 H19 N O4 -","- C21 H19 N O4 -","- C84 H76 N4 O16 -","4","1","NA6054","Senhaji, Fatima-Zahra; El-Bali, Brahim; Kerbal, Abdelali; Tajdine, Janati; Bitit, Najib; Bolte, Michael","Diethyl 2-(acridin-9-ylmethylene)malonate","Acta Crystallographica Section E","2001","57","3","o298","o299","10.1107/S160053680100366X","","","0.71073","MoKα","","0.0402","0.0358","","","","0.0863","","","","","","1.049","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200192","16.624","0.0005","26.0007","0.0016","8.2207","0.0007","90","","90","","90","","3553.3","0.4","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","4,8,9,10-Tetra(4-methoxyphenyl)-1,3-diazaadamantan-6-one-benzene solvate","","- C42 H42 N2 O5 -","- C42 H42 N2 O5 -","- C168 H168 N8 O20 -","4","0.5","NA6059","Krishnakumar, R. V.; Vijayakumar, V.; Sundaravadivelu, M.; Natarajan, S.; Perumal, S.; Selvaraj, S.","4,8,9,10-Tetrakis(4-methoxyphenyl)-1,3-diazaadamantan-6-one benzene solvate","Acta Crystallographica Section E","2001","57","4","o305","o306","10.1107/S1600536801003956","","","1.5418","CuKα","","0.1083","0.0662","","","","0.1913","","","","","","1.134","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200193","5.7818","0.0002","15.32","0.001","17.469","0.001","90","","97.476","0.001","90","","1534.2","0.14","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H17 N5 O -","- C15 H17 N5 O -","- C60 H68 N20 O4 -","4","1","NA6060","Wang, Ying; Jian, Fangfang; Yang, Xujie; Lu, Lude; Wang, Xin; Fun, Hoong-Kun; Chantrapromma, Suchada; Razak, Ibrahim Abdul","Diphenylcarbazide acetonitrile solvate","Acta Crystallographica Section E","2001","57","4","o312","o314","10.1107/S160053680100397X","","","0.71073","MoKα","","0.0834","0.0561","","","","0.1712","","","","","","1.008","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200194","5.1677","0.0006","7.1944","0.0009","11.6869","0.0015","90","","100.449","0.002","90","","427.3","0.09","183","2","183","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethanedithiol Diacetate","","- C6 H10 O2 S2 -","- C6 H10 O2 S2 -","- C12 H20 O4 S4 -","2","0.5","NA6061","Fleischer, Holger; Schollmeyer, Dieter","Ethanedithiol diacetate","Acta Crystallographica Section E","2001","57","4","o330","o331","10.1107/S1600536801004408","","","0.71069","MoKα","","0.0414","0.0399","","","0.1157","0.118","","","","","","1.095","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200195","6.6159","0.0007","8.507","0.001","9.468","0.001","88.57","0.06","72.53","0.09","80.89","0.04","501.7","0.3","298","","","","","","","","","","","4","P -1","-P 1","2","","","","- C11 H12 N2 S -","- C11 H12 N2 S -","- C22 H24 N4 S2 -","2","1","NA6062","Moussaif, A.; Essassi, E. M.; Pierrot, M.","2,3,4,5-Tetrahydro-1,3-thiazepino[3,2-<i>a</i>][1,3]benzimidazole","Acta Crystallographica Section E","2001","57","4","o364","o365","10.1107/S1600536801004913","","","0.71073","MoKα","","0.057","0.052","","0.091","","0.091","","","1.009","","","1.002","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200196","10.347","0.002","11.496","0.002","12.569","0.003","106.61","0.03","92.04","0.03","114.55","0.03","1282.6","0.6","296","1","23","1","","","","","","","","5","P -1","-P 1","2","","tetrakis-(N,N-di-(4-Cl-phenyl)formamidinato)dimolybdenum(II)","","- C52 H36 Cl8 Mo2 N8 -","- C52 H36 Cl8 Mo2 N8 -","- C52 H36 Cl8 Mo2 N8 -","1","0.5","OB6009","Lynn, Matthew A.; Selby, Hugh D.; Carducci, Michael D.; Bruck, Michael A.; Grittini, Carina; Lichtenberger, Dennis L.","Tetrakis[μ-<i>N</i>,<i>N</i>'-bis(4-chlorophenyl)formamidinato-<i>N</i>:<i>N</i>']dimolybdenum(II)","Acta Crystallographica Section E","2001","57","2","m57","m58","10.1107/S1600536800021139","","","0.71073","MoKα","","0.0266","0.0236","","","","0.0644","","","","","","1.081","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200197","10.437","0.002","11.61","0.002","12.801","0.003","107","0.03","92.56","0.03","113.31","0.03","1339.4","0.7","296","2","296","2","","","","","","","","5","P -1","-P 1","2","tetrakis-((4-Br-Ph)form) dimolybdenum(II)","Tetrakis[μ-N,N'-bis(4-bromophenyl)formamidinato-N:N']dimolybdenum(II)","","- C52 H36 Br8 Mo2 N8 -","- C52 H36 Br8 Mo2 N8 -","- C52 H36 Br8 Mo2 N8 -","1","0.5","OB6010","Matthew A. Lynn; Hugh D. Selby; Michael D. Carducci; Michael A. Bruck; Carina Grittini; Dennis L. Lichtenberger","Tetrakis[μ-<i>N</i>,<i>N</i>'-bis(4-bromophenyl)formamidinato-<i>N</i>:<i>N</i>']dimolybdenum(II)","Acta Crystallographica Section E","2001","57","2","m70","m71","10.1107/S160053680100071X","","","0.71073","MoKα","","0.174","0.064","","","","0.11","","","","","","1.004","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200198","13.32","0.006","7.253","0.002","9.42","0.003","90","","90","","90","","910.1","0.6","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","Sodium bromoaurate dihydrate","Sodium tetrabromoaurate(III) dihydrate","","- Au Br4 H4 Na O2 -","- Au Br4 H4 Na O2 -","- Au4 Br16 H16 Na4 O8 -","4","0.5","OB6012","Welter, Richard; Omrani, Hedi; Vangelisti, Rene","Sodium tetrabromoaurate(III) dihydrate","Acta Crystallographica Section E","2001","57","2","i8","i9","10.1107/S1600536800021140","","","0.5608","AgKα","","0.1","0.049","","","","0.097","","","","","","1.086","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2200199","11.6587","0.0009","7.2783","0.0006","27.9741","0.0016","90","","99.684","0.003","90","","2339.9","0.3","180","2","180","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Cyano-4-(N,N-dimethylamino)-6-phenyl-2H-pyran-2-one","","- C14 H12 N2 O2 -","- C14 H12 N2 O2 -","- C112 H96 N16 O16 -","8","2","OB6013","Errington, William; Malhotra, Sanjay; Parmar, Virinder S","3-Cyano-4-(<i>N</i>,<i>N</i>-dimethylamino)-6-phenyl-2<i>H</i>-pyran-2-one","Acta Crystallographica Section E","2001","57","2","o108","o110","10.1107/S1600536800021115","","","0.71073","MoKα","","0.096","0.048","","","","0.114","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200200","3.901","0.001","17.398","0.002","15.749","0.002","90","","94.51","0.01","90","","1065.6","0.3","173","1","173","1","","","","","","","","3","C 1 c 1","C -2yc","9","","2,3,4'-Trichlorobiphenyl","","- C12 H7 Cl3 -","- C12 H7 Cl3 -","- C48 H28 Cl12 -","4","1","OB6018","Lehmler, Hans-Joachim; Parkin, Sean; Robertson, Larry W.","2,3,4'-Trichlorobiphenyl","Acta Crystallographica Section E","2001","57","2","o111","o112","10.1107/S1600536800021127","","","0.71073","MoKα","","0.0287","0.0261","","","","0.0539","","","","","","1.07","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200201","12.78","0.003","16.931","0.003","7.8532","0.0016","90","","101.85","0.03","90","","1663","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Chloro-3-[4-(ethoxycarbonyl)-1-piperidyl]-1,4-naphthoquinone","","- C18 H18 Cl N O4 -","- C18 H18 Cl N O4 -","- C72 H72 Cl4 N4 O16 -","4","1","OB6020","Lynch, Daniel E.; McClenaghan, Ian; Coles, Simon J.","2-Chloro-3-[4-(ethoxycarbonyl)-1-piperidyl]-1,4-naphthoquinone","Acta Crystallographica Section E","2001","57","2","o125","o126","10.1107/S1600536801000708","","","0.71073","MoKα","","0.201","0.055","","","","0.154","","","","","","0.922","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200202","5.6592","0.0009","8.5549","0.0013","8.707","0.0014","87.454","0.003","85.36","0.003","85.004","0.003","418.27","0.11","293","2","","","","","","","","","","5","P -1","-P 1","2","","Diprotonated 3,6-di-2-pyridyl-1,2,4,5-tetrazine diperchlorate","","- C12 H10 Cl2 N6 O8 -","- C12 H10 Cl2 N6 O8 -","- C12 H10 Cl2 N6 O8 -","1","0.5","OB6021","Liu, He; Du, Miao; Bu, Xian-He","3,6-Di-2-pyridinio-1,2,4,5-tetrazine diperchlorate","Acta Crystallographica Section E","2001","57","2","o127","o128","10.1107/S1600536801000721","","","0.71073","MoKα","","","0.0371","","","","0.1165","","","","","","0.894","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200203","11.663","0.001","18.862","0.002","11.363","0.001","90","","94.882","0.006","90","","2490.6","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H31 N O6 S2 -","- C25 H31 N O6 S2 -","- C100 H124 N4 O24 S8 -","4","1","OB6022","Mori, Akira; Kubo, Kanji; Yin, Bing Zhu; Takeshita, Hitoshi","18-Isopropyl-15-(4-nitrophenyl)-5,8,11-trioxa-2,14-dithiabicyclo[14.4.1]henicosa-1(20),16,18-trien-21-one","Acta Crystallographica Section E","2001","57","2","o129","o130","10.1107/S1600536801001027","","","0.71073","MoKα","","0.194","0.055","","","","0.167","","","","","","1","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200204","7.663","0.001","9.693","0.001","12.877","0.001","86.56","0.01","78.56","0.01","76.3","0.02","910.71","0.19","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H17 Br O6 -","- C19 H17 Br O6 -","- C38 H34 Br2 O12 -","2","1","OB6023","Wallet, Jean-Claude; Espinosa, Enrique; Molins, Elies; Miravitlles, Carlos","2',6'-Dimethoxyflavone‒bromoacetic acid (1/1)","Acta Crystallographica Section E","2001","57","2","o174","o175","10.1107/S1600536801001295","","","0.71073","MoKα","","0.2508","0.0747","","","","0.2485","","","","","","0.955","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200205","6.451","0.003","9.2109","0.0009","26.558","0.008","90","","90","","90","","1578.1","0.9","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","5α-androst-3-en-one","","- C19 H28 O -","- C19 H28 O -","- C76 H112 O4 -","4","1","OB6025","Paixão, J. A.; Andrade, L. C. R.; de Almeida, M. J.; Tavares da Silva, E. J.; Fernandes Roleira, F. M.; Sá e Melo, M. L.; Campos Neves, A. S.","5α-Androst-3-en-17-one","Acta Crystallographica Section E","2001","57","2","o189","o191","10.1107/S1600536801001726","","","0.71073","MoKα","","0.0675","0.0402","","","","0.1094","","","","","","1.068","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200206","14.539","0.001","14.55","0.001","17.85","0.001","90","","94.55","0.001","90","","3764.1","0.4","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","ferrocenediylphosphinoplatinum","[Ferrocene-1,1'-diylbis(diphenylphosphine-P)](3,4-toluenethio)platinum(II) dichloromethane solvate","","- C42 H36 Cl2 Fe P2 Pt S2 -","- C42 H36 Cl2 Fe P2 Pt S2 -","- C168 H144 Cl8 Fe4 P8 Pt4 S8 -","4","1","OB6026","Bacsa, John; Darkwa, James; Maisela, Letladi L.","[Ferrocene-1,1'-diylbis(diphenylphosphine-<i>P</i>)](toluene-3,4-dithiolato)platinum(II) dichloromethane solvate","Acta Crystallographica Section E","2001","57","3","m109","m110","10.1107/S1600536801002264","","","0.71073","MoKα","","0.0873","0.0507","","","","0.1106","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200207","5.9247","0.0007","13.5925","0.0011","8.3407","0.0007","90","","95.452","0.008","90","","668.65","0.11","100","5","100","5","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-chloro-6-nitroso-2-norbornene dimer or 1,2-bis(5-chloronorbornen-6-yl)diazene 1,2-dioxide","","- C14 H16 Cl2 N2 O2 -","- C14 H16 Cl2 N2 O2 -","- C28 H32 Cl4 N4 O4 -","2","0.5","OB6027","Milovac, Srdjan; Šimunić-Mežnarić, Vesna; Vančik, Hrvoj; Višnjevac, Aleksandar; Kojić-Prodić, Biserka","5-Chloro-6-nitroso-2-norbornene dimer as a motif for supramolecular assembly","Acta Crystallographica Section E","2001","57","3","o218","o219","10.1107/S160053680100232X","","","0.71069","MoKα","","0.0568","0.0304","","","","0.0828","","","","","","1.017","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200208","8.554","0.003","9.201","0.003","17.036","0.005","74.903","0.005","78.792","0.005","69.739","0.005","1206.4","0.7","298","2","","","","","","","","","","6","P -1","-P 1","2","","Diazide[bis(2-pyridyl)amine] Co^III^ perchlorate","","- C20 H18 Cl Co N12 O4 -","- C20 H18 Cl Co N12 O4 -","- C40 H36 Cl2 Co2 N24 O8 -","2","1","OB6028","Du, Miao; Guo, Ya-Mei; Leng, Xue-Bing; Bu, Xian-He","Diazido[bis(2-pyridyl)amine-<i>N</i>,<i>N</i>']cobalt(III) perchlorate","Acta Crystallographica Section E","2001","57","3","m97","m99","10.1107/S160053680100263X","","","0.71073","MoKα","","","0.0451","","","","0.1205","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200209","10.9356","0.0002","11.9818","0.0002","12.4945","0.0003","104.888","0.001","93.268","0.001","113.402","0.001","1428.49","0.05","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Tetra-μ-benzoato-O:O'-bis[(benzoato-O,O')(1,10-phenanthroline-N,N')- lanthanum(III)]","","- C66 H46 La2 N4 O12 -","- C66 H46 La2 N4 O12 -","- C66 H46 La2 N4 O12 -","1","0.5","OB6029","Shi, Qian; Hu, Maolin; Cao, Rong; Liang, Yucang; Hong, Maochun","Tetra-μ-benzoato-<i>O</i>:<i>O</i>'-bis[(benzoato-<i>O</i>,<i>O</i>')(1,10-phenanthroline-<i>N</i>,<i>N</i>')lanthanum(III)]","Acta Crystallographica Section E","2001","57","3","m122","m123","10.1107/S1600536801002963","","","0.71073","MoKα","","0.028","0.0237","","","","0.0597","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200210","7.38","0.006","13.515","0.006","28.189","0.014","90","","90","","90","","2812","3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C28 H42 B2 P2 -","- C28 H42 B2 P2 -","- C112 H168 B8 P8 -","4","1","OB6030","Lebel, Hélène; Berthod, Michael; Bélanger-Gariépy, Francine","(+)-(<i>RR</i>)-{μ-<i>m</i>-Phenylenedimethylenebis[<i>tert</i>-butyl(phenyl)phosphine]}bis(borane)","Acta Crystallographica Section E","2001","57","3","o282","o284","10.1107/S160053680100294X","","","1.54056","CuKα","","0.0388","0.0351","","0.0899","","0.0884","","","0.983","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200211","8.481","0.002","9.1928","0.0009","12.898","0.0014","90","","96.89","0.02","90","","998.3","0.3","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","pyrazinotetrathiafulvalene","2-(1,3-dithiol-2-ylidene)-2,3-dihydro-1,3-dithia-4,7-diazaindene","","- C8 H4 N2 S4 -","- C8 H4 N2 S4 -","- C32 H16 N8 S16 -","4","1","OB6031","Tomura, Masaaki; Yamashita, Yoshiro","Tetrathiafulvalene with a fused pyrazine ring","Acta Crystallographica Section E","2001","57","4","o307","o308","10.1107/S1600536801003701","","","1.54178","CuKα","","0.2738","0.0794","","","","0.1984","","","","","","1.072","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200212","14.231","0.008","15.663","0.0014","8.206","0.004","90","","103.044","0.008","90","","1781.9","1.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C21 H24 N2 O2 -","- C21 H24 N2 O2 -","- C84 H96 N8 O8 -","4","0.5","OB6032","Hökelek, Tuncer; Kaya, Elif Ece; Kılıç, Zeynel","2,7-Dioxa-15,19-diazatricyclo[19,4,0,0^8,13^]pentacosa-8,10,12,21,23,25(1)-hexaene","Acta Crystallographica Section E","2001","57","4","o309","o311","10.1107/S1600536801003889","","","0.71073","MoKα","","0.0461","0.0362","","","","0.106","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200213","8.174","0.002","8.76","0.002","11.793","0.002","75.68","0.02","85.77","0.02","84.98","0.02","813.9","0.3","290","2","290","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 4-butylamino-2-chloroquinoline-3-carboxylate","","- C16 H19 Cl N2 O2 -","- C16 H19 Cl N2 O2 -","- C32 H38 Cl2 N4 O4 -","2","1","OM6000","Baumer, Vyacheslav N.; Shishkin, Oleg V.; Ukrainets, Igor V.; Taran, Svetlana G.; Amin, Jaradat Nidal","Ethyl 4-butylamino-2-chloroquinoline-3-carboxylate","Acta Crystallographica Section E","2001","57","3","o254","o255","10.1107/S1600536801002276","","","0.71073","MoKα","","0.052","0.038","","","","0.072","","","","","","0.91","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200214","11.9992","0.0008","14.623","0.0009","15.0146","0.0013","75.182","0.003","89.959","0.003","89.793","0.002","2546.9","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C41 H78 O11 Si8 -","- C41 H74 O11 Si8 -","- C82 H148 O22 Si16 -","2","1","OM6001","Arnold, Polly L.; Blake, Alexander J.","Selective reduction in ring size of silsesquioxane oligomers mediated by potassium metal","Acta Crystallographica Section E","2001","57","2","o131","o133","10.1107/S1600536801000745","","","0.71073","MoKα","","0.123","0.06","","","","0.163","","","","","","1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200215","15.3582","0.0015","11.6957","0.0012","14.8253","0.0012","90","","90","","90","","2663","0.4","153","2","153","2","","","","","","","","7","P c c a","-P 2a 2ac","54","","","","- C25 H18.8 Ag F3 N4 O4.4 S -","- C25 H18 Ag F3 N4 O4.4 S -","- C100 H72 Ag4 F12 N16 O17.6 S4 -","4","0.5","OM6002","Vallina, Ana Tesouro; Stoeckli-Evans, Helen","<i>catena</i>-Poly[[silver(I)-μ-{bis[4-(2-pyridylmethyleneamino)phenyl] ether}] trifluoromethanesulfonate 0.4-hydrate]: a zigzag coordination polymer","Acta Crystallographica Section E","2001","57","2","m59","m61","10.1107/S1600536800020869","","","0.71073","MoKα","","0.124","0.042","","","","0.095","","","","","","0.74","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200216","7.9833","0.0006","14.6168","0.0008","18.744","0.002","107.18","0.005","96.514","0.005","99.57","0.005","2029.7","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C29 H21 N O2 -","- C29 H21 N O2 -","- C116 H84 N4 O8 -","4","2","OM6003","Senhaji, Fatima-Zahra; El-Bali, Brahim; Kerbal, Abdelali; Zenkouar, Mohammed; Tajdine, Janati; Bitit, Najib; Bolte, Michael","10-[2-(9-Anthryloxy)ethyl]-9-acridone","Acta Crystallographica Section E","2001","57","2","o134","o135","10.1107/S1600536801000782","","","0.71073","MoKα","","0.104","0.052","","","","0.125","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200217","8.3141","0.0008","14.6625","0.0013","9.067","0.0009","90","","115.154","0.002","90","","1000.5","0.17","298","2","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H9 Co N9 O6 -","- C18 H9 Co N9 O6 -","- C36 H18 Co2 N18 O12 -","2","1","OM6006","Liu, He; Du, Miao; Ge, Xiao-Jing; Bu, Xian-He; Yang, Ming","A novel heptacoordinated cobalt(II) complex of 6,7-dicyanodipyridoquinoxaline (dcdpq): [Co(NO~3~)~2~(CH~3~CN)(dcdpq)]","Acta Crystallographica Section E","2001","57","3","m100","m102","10.1107/S1600536801002422","","","0.71073","MoKα","","","0.028","","","","0.07","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200218","7.5403","0.001","13.6498","0.0019","14.4042","0.0011","90","","101.958","0.008","90","","1450.4","0.3","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N,N-diisopropyl-1-naphthamide","N,N-diisopropyl-1-naphthamide","","- C17 H21 N O -","- C17 H21 N O -","- C68 H84 N4 O4 -","4","1","OM6007","Bond, Andrew D.; Clayden, J.; Wheatley, Andrew E. H.","<i>N</i>,<i>N</i>-Diisopropyl-1-naphthamide","Acta Crystallographica Section E","2001","57","3","o292","o294","10.1107/S1600536801003580","","","0.71073","MoKα","","0.1025","0.0652","","","","0.1477","","","","","","1.071","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200219","7.4432","0.0002","10.9094","0.0002","13.2137","0.0004","90","","90","","90","","1072.96","0.05","120","2","120","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1-(2-propynyloxy)-tricyclo[3.3.1.1^3,7^]decane","","- C13 H18 O -","- C13 H18 O -","- C52 H72 O4 -","4","1","OM6008","Mague, Joel T.; Alworth, William L.; Foroozesh, Maryam","1-Adamantyl propargyl ether","Acta Crystallographica Section E","2001","57","3","o220","o221","10.1107/S1600536801002628","","","0.71073","MoKα","","0.05","0.039","","","","0.092","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200220","9.244","0.0018","19.239","0.004","10.682","0.002","90","","93.37","0.03","90","","1896.5","0.6","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H24 O2 S2 -","- C20 H24 O2 S2 -","- C80 H96 O8 S8 -","4","1","OM6010","Kansikas, Jarno; Sipilä, Kaija","(1<i>S</i>*,2<i>R</i>*,2'<i>R</i>*)-2-Phenyl-1-phenylthio-1-(tetrahydropyran-2-ylthio)propan-2-ol at 193K","Acta Crystallographica Section E","2001","57","4","o335","o337","10.1107/S160053680100438X","","","0.71073","MoKα","","0.078","0.046","","","","0.1069","","","","","","1.046","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200221","5.7702","0.0005","11.321","0.001","22.39","0.001","90","","91.47","0.01","90","","1462.13","0.19","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","9-(Cyclohexylmethyl)-6-(dimethylamino)-9H-purine","","- C14 H21 N5 -","- C14 H21 N5 -","- C56 H84 N20 -","4","1","OM6012","Kubicki, Maciej; Codding, Penelope W.","9-(Cyclohexylmethyl)-6-(dimethylamino)-9<i>H</i>-purine","Acta Crystallographica Section E","2001","57","4","o332","o334","10.1107/S1600536801004329","","","1.54178","CuKα","","0.074","0.0567","","","","0.1244","","","","","","1.025","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200222","11.908","0.003","8.2396","0.0014","13.925","0.004","90","","103.14","0.03","90","","1330.5","0.6","180","2","180","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","2-(Toluene-4-sulfonylamino)benzoyl fluoride","","- C14 H12 F N O3 S -","- C14 H12 F N O3 S -","- C56 H48 F4 N4 O12 S4 -","4","1","TK6000","Ziemer, Burkhard; Surygina, Oxana; Ehwald, Max","2-(Toluene-4-sulfonylamino)benzoyl fluoride","Acta Crystallographica Section E","2001","57","2","o139","o140","10.1107/S1600536801001040","","","0.71073","MoKα","","0.037","0.03","","","","0.082","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200223","9.3725","0.0002","10.7012","0.0002","23.0919","0.0004","90","","90","","90","","2316.05","0.08","120","","120","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(E)-3-methoxy-3-methylsulfanylisothiochroman-4-one oxime","","- C11 H13 N O2 S2 -","- C11 H13 N O2 S2 -","- C88 H104 N8 O16 S16 -","8","1","TK6001","Coustard, Jean-Marie; Le Toquin, Ronan; Leo, Roland; Paulus, Werner; Cousson, Alain","(<i>E</i>)-3-Methoxy-3-methylsulfanylisothiochroman-4-one oxime","Acta Crystallographica Section E","2001","57","3","o256","o257","10.1107/S1600536801002707","","","0.71073","MoKα","","","0.036","","","","0.043","","","","","","1.055","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2200224","9.6233","0.0009","10.2686","0.0008","16.272","0.002","90","","97.672","0.011","90","","1593.6","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tricarbonylbis(4-methyl-1,3-thiazole-2(3H)-thionato-N,S^2^)tungsten(II)","","- C11 H8 N2 O3 S4 W -","- C11 H8 N2 O3 S4 W -","- C44 H32 N8 O12 S16 W4 -","4","1","TK6003","Esterhuysen, Catharine; Kruger, Gert J.; Olivier, Denise K.; Raubenheimer, Helgard G.; Retief, Lizette; Cronje, Stephanie","Tricarbonylbis(4-methyl-1,3-thiazole-2(3<i>H</i>)-thionato-<i>N</i>,<i>S</i>^2^)tungsten(II)","Acta Crystallographica Section E","2001","57","2","m72","m74","10.1107/S1600536801001179","","","0.71073","MoKα","","0.048","0.036","","","","0.119","","","","","","1.07","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200225","4.998","0.002","5.22","0.002","34.853","0.002","90","","92.04","0.02","90","","908.7","0.5","298","","298","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","1,18-octadecanediol","","","- C18 H38 O2 -","- C18 H38 O2 -","- C36 H76 O4 -","2","0.5","TK6004","Nakamura, Naotake; Watanabe, Ryoji","Octadecane-1,18-diol","Acta Crystallographica Section E","2001","57","2","o136","o138","10.1107/S1600536801001052","","","1.5418","CuKα","","0.078","0.045","","0.072","","0.065","","","1.671","","","1.936","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200226","23.908","0.005","7.6861","0.0015","22.947","0.005","90","","114.31","0.03","90","","3842.8","1.7","150","2","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C46 H58 N4 O -","- C46 H56 N4 O -","- C184 H224 N16 O4 -","4","0.5","TK6005","Camiolo, Salvatore; Coles, Simon J.; Gale, Philip A.; Hursthouse, Michael B.; Paver, Michael A.","<i>meso</i>-Octacyclopropylcalix[4]pyrrole ethanol solvate","Acta Crystallographica Section E","2001","57","3","o258","o260","10.1107/S1600536801002719","","","0.71073","MoKα","","","0.088","","","","0.267","","","","","","1.575","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2200227","12.8585","0.0014","10.7092","0.0011","8.3657","0.0014","90","","103.052","0.011","90","","1122.2","0.3","296","2","296","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C11 H11 N O5 -","- C11 H11 N O5 -","- C44 H44 N4 O20 -","4","1","TK6006","Kubo, Kanji; Tsuruta, Tetsuya; Mori, Akira","2-Butanoyloxy-5-nitrotropone","Acta Crystallographica Section E","2001","57","4","o326","o327","10.1107/S1600536801003749","","","0.71073","MoKα","","0.212","0.055","","","","0.168","","","","","","0.954","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200228","15.428","0.001","9.346","0.002","22.506","0.005","90","","90","","90","","3245.1","1","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Ethyl 7-chloro-2,3-dihydro-2-oxo-5-phenyl-1H-1,4-benzodiazepine-3-carboxylate","","- C18 H15 Cl N2 O3 -","- C18 H15 Cl N2 O3 -","- C144 H120 Cl8 N16 O24 -","8","1","TK6008","Višnjevac, Aleksandar; Kojić-Prodić, Biserka","Ethyl 7-chloro-2,3-dihydro-2-oxo-5-phenyl-1<i>H</i>-1,4-benzodiazepine-3-carboxylate","Acta Crystallographica Section E","2001","57","4","o356","o357","10.1107/S1600536801004093","","","0.7107","MoKα","","0.392","0.075","","","","0.214","","","","","","0.835","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200229","7.4194","0.0012","19.044","0.003","46.943","0.007","90","","90","","90","","6632.8","1.8","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","Triaqua(1,10-phenanthroline-2,9-dicarboxylato)magnesium(II) dihydrate","","- C14 H16 Mg N2 O9 -","- C14 H12 Mg N2 O9 -","- C224 H192 Mg16 N32 O144 -","16","0.5","TK6009","Park, Ki-Min; Yoon, Il; Seo, Joobeom; Lee, Yoon Hee; Lee, Shim Sung","A magnesium(II) complex of 1,10-phenanthroline-2,9-dicarboxylate","Acta Crystallographica Section E","2001","57","4","m154","m156","10.1107/S1600536801004317","","","0.71073","MoKα","","0.085","0.055","","","","0.186","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200230","8.778","0.002","15.3778","0.0019","8.442","0.002","90","","113.59","0.018","90","","1044.3","0.4","296","2","296","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C13 H13 N O -","- C13 H13 N O -","- C52 H52 N4 O4 -","4","1","TK6011","Kubo, Kanji; Tsujimoto, Teppei; Kato, Nobuo; Mori, Akira","2,3-Cyclohexanopyrrolo[2,3-<i>b</i>]tropone","Acta Crystallographica Section E","2001","57","4","o370","o371","10.1107/S1600536801005001","","","0.7107","MoKα","","0.257","0.062","","","","0.194","","","","","","0.939","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200231","7.969","0.001","9.111","0.001","13.076","0.002","94.34","0.01","96.83","0.01","115.16","0.01","844.8","0.2","288","2","288","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H40 Mn2 N12 O8 S4 -","- C16 H40 Mn2 N12 O8 S4 -","- C16 H40 Mn2 N12 O8 S4 -","1","0.5","WN6000","Liu, Qi; Li, Baolong; Sun, Xiaoqiang; Xu, Zheng; Yu, Kaibei","Diaquabis(hexamethylenetetramine-<i>N</i>)bis(isothiocyanato)manganese(II) tetraaquabis(isothiocyanato)manganese(II) dihydrate","Acta Crystallographica Section E","2001","57","4","m151","m153","10.1107/S1600536801004068","","","0.71073","MoKα","","0.0293","0.0236","","","","0.0622","","","","","","1.058","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200232","7.17","0.002","10.241","0.003","10.729","0.003","77.25","0.03","74.89","0.03","73.47","0.03","719.9","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C28 H32 N16 -","- C28 H32 N16 -","- C28 H32 N16 -","1","0.5","WN6001","Butler, Richard N.; McGinley, John M. G.; Mahon, Mary F.; Molloy, Kieran C.; NíBhrádaigh, Eithne P.","Diorthobenzenotetra(5',2'-tetrazolo)[5'-(2)-2'-(6)]cyclophane","Acta Crystallographica Section E","2001","57","2","o195","o197","10.1107/S1600536801001398","","","0.71069","MoKα","","0.0574","0.037","","0.1047","","0.0983","","","1.08","","","1.191","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200233","4.9745","0.0002","5.3035","0.0002","6.7548","0.0002","89.733","0.002","102.717","0.002","99.6012","0.0013","171.305","0.011","110","2","110","2","","","","","","","","5","P 1","P 1","1","Lithium orotate monohydrate","lithium 1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinecarboxylate monohydrate","","- C5 H5 Li N2 O5 -","- C5 H5 Li N2 O5 -","- C5 H5 Li N2 O5 -","1","1","WN6002","Lutz, Martin","Lithium orotate monohydrate","Acta Crystallographica Section E","2001","57","3","m103","m105","10.1107/S1600536801002392","","","0.71073","MoKα","","0.0319","0.0298","","","","0.0789","","","","","","1.089","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200234","7.6864","0.0005","9.5175","0.0003","18.348","0.0012","90","","90","","90","","1342.25","0.13","180","2","180","2","","","","","","","","3","C m c a","-C 2ac 2","64","Pentafluorobenzonitrile","Pentafluorobenzonitrile","","- C7 F5 N -","- C7 F5 N -","- C56 F40 N8 -","8","","WN6003","Bond, Andrew D.; Davies, John E.; Griffiths, Joanne; Rawson, Jeremy M.","Pentafluorobenzonitrile","Acta Crystallographica Section E","2001","57","3","o231","o233","10.1107/S1600536801002641","","","0.71073","MoKα","","0.044","0.0365","","0.1357","","0.1076","","","1.118","","","1.147","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200235","8.84","0.001","10.059","0.001","13.33","0.001","97.65","0.01","90.68","0.01","108.63","0.01","1111.3","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H34 Br2 Cl12 N4 Si -","- C28 H34 Br2 Cl12 N4 Si -","- C28 H34 Br2 Cl12 N4 Si -","1","0.5","WN6005","Bolte, Michael; Faber, Alexander","Dihydridotetrakis(3-picoline)silicon dibromide chloroform tetrasolvate","Acta Crystallographica Section E","2001","57","3","o276","o278","10.1107/S1600536801003415","","","0.71073","MoKα","","0.1339","0.0926","","","","0.2682","","","","","","1.113","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200236","11.6838","0.0009","9.922","0.0006","16.7493","0.0014","90","","90.542","0.006","90","","1941.6","0.2","297","1","297","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","ferrocenylmethyl(chlorophenyl)benzimidazole","2-(3-Chlorophenyl)-1-ferrocenylmethyl-1H-1,3-benzimidazole","","- C24 H19 Cl Fe N2 -","- C24 H19 Cl Fe N2 -","- C96 H76 Cl4 Fe4 N8 -","4","1","WN6006","Gallagher, John F.; Hanlon, Keith; Howarth, Joshua; Thomas, Jean-Luc","2-(3-Chlorophenyl)-1-ferrocenylmethyl-1<i>H</i>-1,3-benzimidazole: an electroactive agent for anion sensor and malarial parasite studies","Acta Crystallographica Section E","2001","57","4","m134","m136","10.1107/S1600536801003804","","","0.71073","MoKα","","0.058","0.041","","","","0.105","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200237","27.307","0.002","4.6228","0.0004","12.5888","0.0011","90","","90","","90","","1589.1","0.2","296","2","296","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","1-methylethyl 2-bromo-4-(N-phthalimido)butanoate","","- C15 H16 Br N O4 -","- C15 H16 Br N O4 -","- C60 H64 Br4 N4 O16 -","4","1","WN6007","Skakle, Janet M. S.; Smyth, Gregory; Wardell, Solange M. S. V.","Isopropyl 2-bromo-4-(<i>N</i>-phthalimido)butanoate","Acta Crystallographica Section E","2001","57","4","o300","o302","10.1107/S1600536801003816","","","0.71073","MoKα","","0.1485","0.0735","","","","0.196","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200238","6.7475","0.001","12.5446","0.0016","6.9788","0.0017","90","","116.43","0.014","90","","528.98","0.18","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Zn(1-aza-4-azinium-bicyclo[2.2.2]octane)trichloride","","- C6 H13 Cl3 N2 Zn -","- C6 H13 Cl3 N2 Zn -","- C12 H26 Cl6 N4 Zn2 -","2","1","WN6008","Wei, Mingyi; Willett, Roger D.","(1-Aza-4-aziniobicyclo[2.2.2]octane-<i>N</i>^1^)trichlorozinc(II)","Acta Crystallographica Section E","2001","57","4","m167","m168","10.1107/S1600536801004822","","","0.71073","MoKα","","0.0328","0.0312","","","","0.0773","","","","","","1.079","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200239","11.307","0.001","9.475","0.001","14.919","0.002","90","","99.34","0.01","90","","1577.1","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Amino-7,7-dimethyl-4-benzyl-5-oxo-4,5,6,8-tetrahydro-7H-chromene -3-carbornitrile","","- C18 H18 N2 O2 -","- C18 H18 N2 O2 -","- C72 H72 N8 O8 -","4","1","WN6009","Tu, Shu-Jiang; Deng, Xu; Fang, Ya-Yin; Guo, Ya-Mei; Du, Miao; Liu, Xiao-Hong","2-Amino-7,7-dimethyl-5-oxo-4-phenyl-5,6,7,8-tetrahydro-4<i>H</i>-chromene-3-carbonitrile","Acta Crystallographica Section E","2001","57","4","o358","o359","10.1107/S1600536801004755","","","0.71073","MoKα","","0.0581","0.0381","","","","0.1023","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200240","8.901","0.003","21.075","0.004","22.721","0.005","90","","97.22","0.02","90","","4228.4","1.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","doxylamine hydrogensuccinate","Dimethylammoniumethoxy(methyl)benzylpyridine hydrogensuccinate","","- C21 H28 N2 O5 -","- C21 H28 N2 O5 -","- C168 H224 N16 O40 -","8","2","YA6001","Parvez, Masood; Dalrymple, Sean; Cote, Adrien","Doxylamine hydrogen succinate","Acta Crystallographica Section E","2001","57","2","o163","o165","10.1107/S160053680100085X","","","0.71069","MoKα","","0.284","0.067","","","","0.243","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200241","24.334","0.002","20.954","0.002","32.936","0.003","90","","104.706","0.002","90","","16244","3","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Bert*GaCl2.pyridine + 0.5C6H6","","","- C44 H57 Cl2 Ga N -","- C44 H57 Cl2 Ga N -","- C704 H912 Cl32 Ga16 N16 -","16","4","YA6002","Twamley, Brendan; Power, Philip P.","A donor‒acceptor adduct: sterically encumbered terphenyl dichloro[2,6-bis(2,4,6-triisopropylphenyl)phenyl]dichloro(pyridine)gallium benzene hemisolvate","Acta Crystallographica Section E","2001","57","2","m88","m91","10.1107/S1600536801001787","","","0.71073","MoKα","","0.189","0.078","","","","0.228","","","","","","1.13","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2200242","11.5695","0.001","8.568","0.003","12.976","0.002","81.58","0.02","104.804","0.01","96.85","0.02","1225.7","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","[Na(DB18C6)]~2~[Pd(SCN)~4~]","bis[(dibenzo-18-crown-6)sodium] palladium(II)tetrathiocyanate","","- C44 H48 N4 Na2 O12 Pd S4 -","- C44 H48 N4 Na2 O12 Pd S4 -","- C44 H48 N4 Na2 O12 Pd S4 -","1","0.5","YA6003","Yong, Wei; Dou, Jian-Min; Zhu, De-Zhong; Liu, Ying; Li, Xue; Zheng, Pei-Ju; bis[(dibenzo-18-crown-6)sodium] palladium(II)tetrathiocyanate","Cation‒π interactions in [Na(dibenzo-18-crown-6)]~2~[Pd(SCN)~4~]","Acta Crystallographica Section E","2001","57","3","m127","m129","10.1107/S1600536801001416","","","0.71073","MoKα","","0.061","0.028","","","","0.08","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200243","5.729","0.001","10.079","0.002","19.622","0.004","90","","90","","90","","1133","0.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1R,5R,8S)-8-benzyloxy-2,6-dioxabicyclo[3.2.1]octane-3-one","","- C13 H14 O4 -","- C13 H14 O4 -","- C52 H56 O16 -","4","1","YA6004","Koman, Marian; Babjak Matej; Gracza Tibor; Glowiak Tadeusz","Absolute configuration of the newly formed asymmetric centre in (1<i>R</i>,5<i>R</i>,8<i>S</i>)-8-benzyloxy-2,6-dioxabicyclo[3.2.1]octan-3-one","Acta Crystallographica Section E","2001","57","4","o360","o361","10.1107/S1600536801004196","","","1.5418","CuKα","","0.043","0.033","","0.091","","0.088","","","1.09","","","1.13","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200244","11.8068","0.0004","23.3389","0.0009","12.365","0.0005","90","","111.537","0.001","90","","3169.4","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","trans-Chloro(methyl)bis(triphenylphosphine)palladium(II)","","- C37 H33 Cl P2 Pd -","- C37 H33 Cl P2 Pd -","- C148 H132 Cl4 P8 Pd4 -","4","1","YA6005","Otto, Stefanus","<i>trans</i>-Chloro(methyl)bis(triphenylphosphine)palladium(II)","Acta Crystallographica Section E","2001","57","2","m75","m77","10.1107/S1600536801000848","","","0.71073","MoKα","","0.121","0.038","","","","0.071","","","","","","0.85","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200245","5.126","0.0002","8.565","0.0004","18.754","0.0009","90","","91.996","0.003","90","","822.88","0.06","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(S)-O-Succinimidyl N-[2-(tert-butoxycarbonylamino)propyl]carbamate","","- C13 H21 N3 O6 -","- C13 H21 N3 O6 -","- C26 H42 N6 O12 -","2","1","YA6006","Menschise, Valeria; Didierjean, Claude; Semetey, Vincent; Guichard, Gilles; Briand, Jean-Paul; Aubry, Andre","(<i>S</i>)-<i>O</i>-Succinimidyl <i>N</i>-[2-(<i>tert</i>-butoxycarbonylamino)propyl]carbamate","Acta Crystallographica Section E","2001","57","3","o222","o224","10.1107/S1600536801002410","","","0.7107","MoKα","","0.053","0.037","","","","0.097","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200246","19.7328","0.0009","9.1088","0.0004","13.3636","0.0006","90","","117.884","0.001","90","","2123.12","0.17","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","poly[[diaquacadmium(II)]-μ^3^-(1-carboxybenzene-3,5-dicarboxylato- O^1^:O^3^,O^3'^:O^5^,O^5'^)]","","- C9 H8 Cd O8 -","- C9 H8 Cd O8 -","- C72 H64 Cd8 O64 -","8","1","YA6007","Skakle, J. M. S.; Foreman, M. R. St J.; Plater, M. J.; Griffin, C.","Poly[[diaquacadmium(II)]-μ^3^-(1-carboxybenzene-3,5-dicarboxylato)]","Acta Crystallographica Section E","2001","57","2","m85","m87","10.1107/S160053680100188X","","","0.71073","MoKα","","0.036","0.028","","","","0.071","","","","","","0.97","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200247","7.6119","0.0005","8.846","0.0004","15.611","0.001","90","","101.321","0.005","90","","1030.71","0.11","293","","293","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","N-ethyldithiophthalimide","","- C10 H9 N S2 -","- C10 H9 N S2 -","- C40 H36 N4 S8 -","4","1","YA6008","Meden, Anton; Huskić, Miroslav; Bele, Marjan","<i>N</i>-Ethyldithiophthalimide, the first structure of a dithiophthalimide derivative","Acta Crystallographica Section E","2001","57","4","o303","o304","10.1107/S1600536801003828","","","0.71073","MoKα","","0.062","0.045","","0.055","","0.048","","","0.595","","","0.9","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200248","14.2145","0.001","7.7681","0.0005","10.3928","0.0006","90","","101.98","0.005","90","","1122.58","0.13","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Phenylpyrrolo[2,3-b]tropone","","- C15 H11 N O -","- C15 H11 N O -","- C60 H44 N4 O4 -","4","1","YA6009","Kubo, Kanji; Tsujimoto, Teppei; Mori, Akira","3-Phenylpyrrolo[2,3-<i>b</i>]tropone","Acta Crystallographica Section E","2001","57","3","o225","o227","10.1107/S1600536801002021","","","0.71073","MoKα","","0.074","0.042","","","","0.116","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200249","24.698","0.004","7.106","0.001","18.538","0.002","90","","99.59","0.01","90","","3208","0.8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[2(Fopygu.2HCl)][trans-Ni(H2O)4Cl2]*4H2O","Bis(2-pyridiniomethyleneaminoguanidinium) trans-tetraaquadichloronickel(II) dichloride tetrahydrate","","- C14 H38 Cl6 N10 Ni O8 -","- C14 H38 Cl6 N10 Ni O8 -","- C56 H152 Cl24 N40 Ni4 O32 -","4","0.5","YA6010","Valdés-Martínez, Jesús; Alstrum-Acevedo, James H.; Toscano, Rubén A.; Espinosa-Pérez, Georgina; Helfrich, Brian A.; West, Douglas X.","Bis(2-pyridiniomethyleneaminoguanidinium) <i>trans</i>-tetraaquadichloronickel(II) dichloride tetrahydrate","Acta Crystallographica Section E","2001","57","4","m137","m139","10.1107/S1600536801003725","","","0.71073","MoKα","","0.097","0.044","","","","0.142","","","","","","1.02","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200250","10.754","0.0004","13.9616","0.0005","8.9464","0.0004","90","","104.946","0.0012","90","","1297.8","0.09","296","2","296","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","2-Amino-5-hexyloxytropone","","- C13 H19 N O2 -","- C13 H19 N O2 -","- C52 H76 N4 O8 -","4","1","YA6011","Yamamoto, Emi; Kubo, Kanji; Kato, Nobuo; Mori, Akira","2-Amino-5-hexyloxytropone","Acta Crystallographica Section E","2001","57","3","o279","o281","10.1107/S1600536801003294","","","0.71073","MoKα","","0.165","0.071","","","","0.244","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200251","5.0414","0.0004","18.878","0.002","8.6814","0.0011","90","","99.349","0.007","90","","815.25","0.15","180","2","180","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Co(MTT)2(MeOH)2","Bis[3-hydroxy-4-methylthiazole-2(3H)-thiolato-S^2^,O]bis(methanol-O)- cobalt(II)","","- C10 H16 Co N2 O4 S4 -","- C10 H16 Co N2 O4 S4 -","- C20 H32 Co2 N4 O8 S8 -","2","0.5","YA6012","Bond, Andrew D.; Jones, William","Bis[3-hydroxy-4-methyl-2(3<i>H</i>)-thiazolethiolato-<i>S</i>^2^,<i>O</i>]bis(methanol-<i>O</i>)cobalt(II)","Acta Crystallographica Section E","2001","57","4","m140","m142","10.1107/S1600536801003737","","","0.71073","MoKα","","0.054","0.034","","","","0.078","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200252","15.4466","0.0007","16.6228","0.0008","13.5016","0.0006","90","","90","","90","","3466.7","0.3","297","2","297","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","tris(acetylacetonato)-vanadium(III) (alpha form)","Tris(2,4-pentanedionato-O,O')-vanadium(III) (alpha form)","","- C15 H21 O6 V -","- C15 H21 O6 V -","- C120 H168 O48 V8 -","8","1","YA6013","Filgueiras, Carlos A. L.; Horn Jr, Adolfo; Howie, R. Alan; Skakle, Janet M. S.; Wardell, James L.","α-Form of tris(2,4-pentanedionato-<i>O</i>,<i>O</i>')vanadium(III), re-refinement against new intensity data","Acta Crystallographica Section E","2001","57","4","m157","m158","10.1107/S1600536801004391","","","0.71073","MoKα","","0.126","0.044","","","","0.139","","","","","","0.94","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200253","16.138","0.0013","7.2682","0.0006","18.0257","0.0015","90","","104.344","0.002","90","","2048.4","0.3","298","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,3-bis(2-pyridinio)-5,8-dimethoxyquinoxaline dinitrate","","- C20 H18 N6 O8 -","- C20 H18 N6 O8 -","- C80 H72 N24 O32 -","4","1","YA6015","He Liu; Miao Du; Ya-Mei Guo; Xian-He Bu","2,3-Bis(2-pyridinio)-5,8-dimethoxyquinoxaline dinitrate","Acta Crystallographica Section E","2001","57","4","o372","o374","10.1107/S1600536801004834","","","0.71073","MoKα","","","0.042","","","","0.11","","","","","","0.97","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200254","8.927","0.001","10.2311","0.0009","9.776","0.002","90","","106.04","0.02","90","","858.1","0.2","173","","173","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C11 H10 O2 -","- C11 H10 O2 -","- C44 H40 O8 -","4","1","YA6016","Avery, Thomas D.; Taylor, Dennis K.; Tiekink, Edward R. T.","(±)-(3a<i>R</i>,4<i>R</i>,4a<i>S</i>)-4-Phenyl-3,3a,4,4a-tetrahydro-1<i>H</i>-cyclopropa[<i>c</i>]furan-1-one","Acta Crystallographica Section E","2001","57","4","o375","o376","10.1107/S1600536801004998","","","0.71073","MoKα","","0.088","0.039","","","","0.144","","","","","","0.93","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200255","10.838","0.004","10.838","0.004","8.41","0.003","90","","90","","120","","855.5","0.5","150","2","150","2","","","","","","","","3","P 63 m c","P 6c -2c","186","barium oxide iodide","","","- Ba4 I6 O -","- Ba4 I6 O -","- Ba8 I12 O2 -","2","0.166667","BR6008","Marten G. Barker; Francesconi, M. Grazia; Claire Wilson","Barium oxide iodide","Acta Crystallographica Section E","2001","57","6","i41","i43","10.1107/S1600536801006614","","","0.71069","MoKα","","0.0245","0.0223","","","","0.0506","","","","","","1.086","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200256","10.747","0.001","10.747","0.001","7.8678","0.0009","90","","90","","120","","787","0.3","150","2","150","2","","","","","","","","3","P 63 m c","P 6c -2c","186","strontium oxide iodide","","","- I6 O Sr4 -","- I6 O Sr4 -","- I12 O2 Sr8 -","2","0.166667","","Barker, Marten G.; Francesconi, M. Grazia; Shutt, Thomas H.; Wilson, Claire","Strontium oxide iodide","Acta Crystallographica, Section E: Structure Reports Online","2001","57","6","i44","i45","10.1107/s1600536801006626","","","","","","","","","","","","","","","","","","","","","has coordinates","210325","2020-10-21","18:00:00",""
"2200257","9.338","0.0002","9.338","0.0002","12.817","0.0003","90","","90","","120","","967.89","0.04","293","2","293","2","","","","","","","","4","P -3 c 1","-P 3 2""c","165","","","","- C3 Na4 O11 U -","- C3 Na4 O11 U -","- C12 Na16 O44 U4 -","4","0.333333","","Císařová, Ivana; Skála, Roman; Ondruš, Petr; Drábek, Milan","Trigonal Na~4~[UO~2~(CO~3~)~3~]","Acta Crystallographica, Section E","2001","57","","i32","i34","10.1107/S1600536801005992","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2200258","26.1127","0.0018","10.1535","0.0006","14.6165","0.0009","90","","92.367","0.007","90","","3872","0.4","293","2","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H28 Ba Cr2 N4 O22 -","- C32 H28 Ba Cr2 N4 O22 -","- C128 H112 Ba4 Cr8 N16 O88 -","4","0.5","BR6013","Larsson, Krister","Infinite chain of [Ba{Cr(ox)~2~(phen)}~2~]~<i>n~</i>","Acta Crystallographica Section E","2001","57","5","m195","m197","10.1107/S1600536801005931","","","0.71073","MoKα","","","0.044","","","","0.1254","","","","","","1.005","","","","has coordinates,has Fobs","194538","2020-10-21","18:00:00",""
"2200259","7.4116","0.0004","7.6542","0.0003","9.4486","0.0006","90","","112.194","0.005","90","","496.3","0.05","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Ni3 O14 P4 Sr -","- Ni3 O14 P4 Sr -","- Ni6 O28 P8 Sr2 -","2","0.5","","Bolte, Michael","SrNi~3~(P~2~O~7~)~2~","Acta Crystallographica, Section E","2001","57","","i30","i31","10.1107/S1600536801005700","","","","","","","","","","","","","","","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200260","6.8","0.0007","8.6443","0.0008","8.9244","0.0009","84.512","0.01","79.866","0.009","77.834","0.009","503.87","0.09","291","1","291","1","","","","","","","","6","P -1","-P 1","2","","Diaquadichloride-Bis(2,4'-Bipyridyl) Manganese(II)","","- C20 H20 Cl2 Mn N4 O2 -","- C20 H20 Cl2 Mn N4 O2 -","- C20 H20 Cl2 Mn N4 O2 -","1","0.5","BR6016","Kruszynski, Rafal; Bartczak, Tadeusz J.; Adamczyk, Anna; Czakis-Sulikowska, Danuta; Kałużna, Joanna; .","Diaquabis(2,4'-bipyridyl-<i>N</i>')dichloromanganese(II)","Acta Crystallographica Section E","2001","57","5","m183","m185","10.1107/S1600536801005840","","","0.71073","MoKα","","0.0625","0.0616","","","","0.1627","","","","","","1.185","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200261","6.1121","0.0005","6.1121","0.0005","11.42","0.0014","90","","90","","120","","369.47","0.06","293","","293","2","","","","","","","","3","P 63 c m","P 6c -2","185","","","","- Er Mn O3 -","- Er Mn O3 -","- Er6 Mn6 O18 -","6","0.5","","Aken, Bas B. van; Meetsma, Auke; Palstra, Thomas T. M.","Hexagonal ErMnO~3~","Acta Crystallographica, Section E","2001","57","","i38","i40","10.1107/S160053680100811X","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2200262","5.101","0.001","20.098","0.004","10.461","0.002","90","","90.31","0.03","90","","1072.4","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl (4-formyl-2-methoxycarbonyl-1-pyrrolyl)acetate","","- C10 H11 N O5 -","- C10 H11 N O5 -","- C40 H44 N4 O20 -","4","1","BT6023","Ján Lokaj; Viktor Kettmann; Viktor Milata; Jarmila Štetinová; Ognyan Petrov","Methyl (4-formyl-2-methoxycarbonylpyrrol-1-yl)acetate","Acta Crystallographica Section E","2001","57","5","o404","o405","10.1107/S1600536801005645","","","0.71073","MoKα","","0.092","0.0581","","0.1184","","0.1057","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200263","8.728","0.003","12.087","0.004","8.672","0.003","108.22","0.03","113.43","0.02","91.24","0.03","786.1","0.5","296","2","296","2","","","","","","","","5","P -1","-P 1","2","dioxypyrido[2,3-d]pyrimidine","7-(4-bromophenyl)-5-cyanomethyl-1,3-dimethyl-2,4-dioxypyrido[2,3-d]pyrimidine","","- C17 H13 Br N4 O2 -","- C17 H13 Br N4 O2 -","- C34 H26 Br2 N8 O4 -","2","1","BT6027","Sarkhel, Sanjay; Srivastava, Prativa; Saxena, Abhishek S.; Ram, Vishnu J.; Prasad Onkar; Shiro, Motoo; Maulik, Prakas R.","7-(4-Bromophenyl)-5-cyanomethyl-1,3-dimethylpyrido[2,3-<i>d</i>]pyrimidine-2,4-dione","Acta Crystallographica Section E","2001","57","5","o408","o410","10.1107/S1600536801004986","","","0.71073","MoKα","","0.099","0.0426","","0.1565","","0.12","","","1.026","","","1.076","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200264","15.061","0.005","6.2184","0.0019","13.908","0.004","90","","114.398","0.005","90","","1186.2","0.6","298","2","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","2,3,7,8-Tetrakis(2-pyridyl)pyrazino-[2,3-g]quinoxaline","","- C30 H18 N8 -","- C30 H18 N8 -","- C60 H36 N16 -","2","0.5","BT6028","Fang, Ya-Yin; Guo, Ya-Mei; Du, Miao; Liu, He; Leng, Xue-Bing; Zhang, Ruo-Hua","2,3,7,8-Tetrakis(2-pyridyl)pyrazino[2,3-<i>g</i>]quinoxaline","Acta Crystallographica Section E","2001","57","5","o380","o382","10.1107/S1600536801005153","","","0.71073","MoKα","","","0.0406","","","","0.1036","","","","","","0.935","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200265","14.125","0.003","14.118","0.003","10.719","0.002","90","","90","","90","","2137.5","0.8","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","9-(4-Chlorophenyl)-3,3,6,6-tetramethyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine- 1,8-dione","","- C23 H26 Cl N O2 -","- C23 H26 Cl N O2 -","- C92 H104 Cl4 N4 O8 -","4","1","BT6029","Tu, Shu-Jiang; Deng, Xu; Du, Miao; Fang, Ya-Yin; Guo, Ya-Mei; Liu, Xiao-Hong","9-(4-Chlorophenyl)-3,3,6,6-tetramethyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione","Acta Crystallographica Section E","2001","57","5","o383","o385","10.1107/S1600536801005189","","","0.71073","MoKα","","0.092","0.0507","","","","0.2076","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200266","6.4808","0.0007","9.9636","0.0009","12.2753","0.0011","91.6","0.009","101.048","0.01","106.114","0.012","744.62","0.14","291","1","291","1","","","","","","","","5","P -1","-P 1","2","5-morpholinemethyl-3-(4-fluoridebenzylideamin)-2-oxazolidinone","4-{3-[(4-Fluorobenzylidene)amino]-2-oxo-1,3-oxazolidin-5-ylmethyl}morpholine","","- C15 H18 F N3 O3 -","- C15 H18 F N3 O3 -","- C30 H36 F2 N6 O6 -","2","1","BT6030","Kruszynski, Rafal; Bartczak, Tadeusz J.; Chilmonczyk, Zdzislaw; Cybulski, Jacek","4-{3-[(4-Fluorobenzylidene)amino]-2-oxo-1,3-oxazolidin-5-ylmethyl}morpholine","Acta Crystallographica Section E","2001","57","5","o386","o388","10.1107/S1600536801005487","","","0.71073","MoKα","","0.0956","0.0752","","","","0.177","","","","","","1.202","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200267","8.7369","0.0008","15.741","0.003","13.3967","0.0012","90","","103.833","0.008","90","","1789","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H16 N4 O4 S4 -","- C12 H16 N4 O4 S4 -","- C48 H64 N16 O16 S16 -","4","0.5","BT6031","Cho, Nam Sook; Hong, Soon Il; Kim, Jin-Gyu; Suh, Il-Hwan","1,5-[5,5'-(3-Oxa-1,5-pentylenedithio)bis(2,3-dihydro-2-oxo-1,3,4-thiadiazol-3-yl)]-3-oxapentane","Acta Crystallographica Section E","2001","57","5","o434","o435","10.1107/S1600536801006250","","","0.71069","MoKα","","0.0521","0.0351","","","","0.0885","","","","","","1.018","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200268","10.7902","0.0006","11.7031","0.0006","16.1857","0.0009","90","","90","","90","","2043.91","0.19","120","","120","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","bis(2,2'-bipyridine-N,N')-dicyano-iron(III) nitrate","","- C22 H16 Fe N7 O3 -","- C22 H16 Fe N7 O3 -","- C88 H64 Fe4 N28 O12 -","4","1","BT6032","Damgaard Poulsen, Rasmus; Hazell, Alan","Bis(2,2'-bipyridine-<i>N</i>,<i>N</i>')dicyanoiron(III) nitrate","Acta Crystallographica Section E","2001","57","5","m186","m187","10.1107/S1600536801005918","","","0.71073","MoKα","","","0.031","","","","0.038","","","","","","1.203","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200269","9.274","0.002","9.641","0.001","20.746","0.003","90","","94.17","0.02","90","","1850","0.5","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Diethyl-N,N'-diphenyl-3-oxapentanediamide","","- C20 H24 N2 O3 -","- C20 H24 N2 O3 -","- C80 H96 N8 O12 -","4","1","BT6033","Zhang, Yan-Ling; Wang, Ya-Wen; Li, Yi-Zhi; Liu, Wei-Sheng; Yu, Kai-Bei; Wang, Liu-Fang","<i>N</i>,<i>N</i>'-Diethyl-<i>N</i>,<i>N</i>'-diphenyl-3-oxapentanediamide","Acta Crystallographica Section E","2001","57","6","o483","o484","10.1107/S1600536801006274","","","0.71073","MoKα","","0.0569","0.0452","","","","0.089","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200270","7.1501","0.0014","13.185","0.003","8.4979","0.0017","90","","106.45","0.03","90","","768.3","0.3","150","2","150","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","RhCl~2~(Cp^*^)(pyridine)","Dichloro(η^5^-pentamethylcyclopentadienyl)(pyridine-N)rhodium","","- C15 H20 Cl2 N Rh -","- C15 H20 Cl2 N Rh -","- C30 H40 Cl4 N2 Rh2 -","2","0.5","BT6035","Therrien, Bruno; Burrell, Anthony K.","Dichloro(η^5^-pentamethylcyclopentadienyl)(pyridine-<i>N</i>)rhodium","Acta Crystallographica Section E","2001","57","6","m259","m260","10.1107/S160053680100736X","","","0.71073","MoKα","","0.0179","0.0165","","","","0.0456","","","","","","1.111","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200271","9.139","0.002","11.083","0.002","16.411","0.003","90","","95.838","0.002","90","","1653.6","0.6","298","2","298","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","N,N-dimethylphosphoramidic acid bis(4-nitrophenyl) ester","","- C14 H14 N3 O7 P -","- C14 H14 N3 O7 P -","- C56 H56 N12 O28 P4 -","4","1","BT6036","Gholivand, Khodayar; Tadjarodi, Azadeh; Taeb, Abbas; Garivani, Gholamhossein; Ng, Seik Weng","Bis(4-nitrophenyl) <i>N</i>,<i>N</i>-dimethylphosphoramidate","Acta Crystallographica Section E","2001","57","5","o472","o473","10.1107/S1600536801006766","","","0.71073","MoKα","","0.0989","0.0456","","","","0.1344","","","","","","0.922","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200272","7.55","0.002","13.66","0.003","12.85","0.003","90","","102.9","0.03","90","","1291.8","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Triaquatris[tetraoxorhenio(VII)]neodymium(III)","","- H6 Nd O15 Re3 -","- H6 Nd O15 Re3 -","- H24 Nd4 O60 Re12 -","4","1","BT6037","Guido J. Reiß","Triaquatris[tetraoxorhenato(VII)]neodymium(III)","Acta Crystallographica Section E","2001","57","5","i35","i37","10.1107/S1600536801006869","","","0.71073","MoKα","","0.0293","0.0238","","","","0.0546","","","","","","1.016","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200273","7.5693","0.0007","9.562","0.0009","11.3908","0.0011","79.203","0.002","76.735","0.002","77.514","0.002","775.19","0.13","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","4,6-Dimethyl-2-(o-tolyliminomethyl)quinoline","","- C19 H18 N2 -","- C19 H18 N2 -","- C38 H36 N4 -","2","1","BT6038","Mehmet Akkurt; Sema Öztürk; Feray Aydog̃an","4,6-Dimethyl-2-(<i>o</i>-tolyliminomethyl)quinoline","Acta Crystallographica Section E","2001","57","5","o454","o455","10.1107/S1600536801006705","","","0.71073","MoKα","","0.1446","0.0731","","0.2363","0.1868","","","","1.018","1.162","1.162","","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200274","9.1639","0.0002","9.973","0.0002","11.1913","0.0002","90","","90","","90","","1022.79","0.04","293","2","293","2","","","","","","","","3","A b a 2","A 2 -2ab","41","","","","- Mo7.7 Nd O14 -","- Mo7.698 Nd O14 -","- Mo30.792 Nd4 O56 -","4","","BT6039","Barrier, N.; Gougeon, P.","NdMo~7.7~O~14~ containing Mo~6~, Mo~7~ and Mo~8~ clusters","Acta Crystallographica Section E","2001","57","6","i46","i48","10.1107/S1600536801007103","","","0.7107","MoKα","","0.0391","0.0355","","","","0.084","","","","","","1.107","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2200275","14.1406","0.0001","15.2215","0.0001","17.8879","0.0002","90","","90","","90","","3850.21","0.06","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","α,α-trehalose octaacetate ethyl acetate solvate","2,3,4,6-tetra-O-acetyl-1-O-(2,3,4,6-tetra-O-acetyl-α-D-glucopyranosyl) -α-D-glucopyranose ethyl acetate solvate","","- C32 H46 O21 -","- C32 H46 O21 -","- C128 H184 O84 -","4","1","BT6040","Thomas C. Baddeley; Simon M. Clow; Philip J. Cox; Anna M. McLaughlin; James L. Wardell","α,α-Trehalose octaacetate ethyl acetate solvate","Acta Crystallographica Section E","2001","57","5","o456","o457","10.1107/S1600536801006857","","","0.71073","MoKα","","0.0787","0.0396","","","","0.0958","","","","","","1.001","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200276","12.011","0.003","20.234","0.004","8.625","0.002","90","","90.35","0.01","90","","2096.1","0.8","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-Diiodobis(triphenylphosphine)palladium(II) bis(tetrahydrofuran) solvate","","- C44 H46 I2 O2 P2 Pd -","- C44 H46 I2 O2 P2 Pd -","- C88 H92 I4 O4 P4 Pd2 -","2","0.5","BT6043","Batsanov, Andrei S.; Howard, Judith A. K.; Robertson, Graham S.; Kilner, Melvin","<i>trans</i>-Diiodobis(triphenylphosphine)palladium(II) bis(tetrahydrofuran) solvate","Acta Crystallographica Section E","2001","57","6","m233","m234","10.1107/S1600536801007541","","","0.71073","MoKα","","0.0518","0.0361","","","","0.073","","","","","","1.14","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200277","9.465","0.001","19.821","0.001","14.208","0.001","90","","105.51","0.01","90","","2568.4","0.4","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[1,2-bis(diphenylphosphino)ethane-P,P]diiodopalladium(II)","","- C26 H24 I2 P2 Pd -","- C26 H24 I2 P2 Pd -","- C104 H96 I8 P8 Pd4 -","4","1","BT6044","Batsanov, Andrei S.; Howard, Judith A. K.; Robertson, Graham S.; Kilner, Melvin","Solvent-free [1,2-bis(diphenylphosphino)ethane-<i>P</i>,<i>P</i>']diiodopalladium(II)","Acta Crystallographica Section E","2001","57","6","m235","m236","10.1107/S1600536801007589","","","0.71073","MoKα","","0.0617","0.0405","","","","0.0803","","","","","","1.157","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200278","10.294","0.006","12.102","0.005","12.23","0.006","69.86","0.02","86.58","0.02","66.39","0.02","1305.3","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(μ-diphenylphosphido)bis{trans-tricarbonylbis[1-(4- ethoxybutoxy)pentylidene]rhenium}","","- C52 H64 O10 P2 Re2 -","- C52 H64 O10 P2 Re2 -","- C52 H64 O10 P2 Re2 -","1","0.5","BT6046","Flörke, Ulrich; Petters, Dina","Bis(μ-diphenylphosphido)bis{<i>trans</i>-tricarbonylbis[1-(4-ethoxybutoxy)pentylidene]rhenium}","Acta Crystallographica Section E","2001","57","6","m237","m238","10.1107/S1600536801007826","","","0.71073","MoKα","","0.0367","0.0281","","","","0.0656","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200279","14.1286","0.0012","5.8874","0.0007","8.8335","0.0009","90","","94.321","0.008","90","","732.69","0.13","291","2","291","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(3-Methylbut-2-enyl)ammonium chloride","","- C5 H12 Cl N -","- C5 H12 Cl N -","- C20 H48 Cl4 N4 -","4","1","BT6048","Kruszynski, Rafal; Czestkowski Wojciech; .","(3-Methylbut-2-enyl)ammonium chloride","Acta Crystallographica Section E","2001","57","6","o516","o518","10.1107/S1600536801008108","","","0.71073","MoKα","","0.0495","0.049","","","","0.1386","","","","","","1.183","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200280","9.9015","0.0012","9.9015","0.0012","13.4199","0.0016","90","","90","","90","","1315.7","0.3","298","","293","2","","","","","","","","6","P -4 21 c","P -4 2n","114","","propane-1,3-diammonium bis(zinc phosphate)","","- C1.875 H7.5 N1.25 O5 P1.25 Zn1.25 -","- O4 P Zn -","- O40 P10 Zn10 -","10","1.25","BT6049","Harrison, William T. A.","[H~3~N(CH~2~)~3~NH~3~]~0.5~[ZnPO~4~], an organically templated zincophosphate analogue of the aluminosilicate zeolite edingtonite","Acta Crystallographica Section E","2001","57","6","m248","m250","10.1107/S1600536801008327","","","0.71073","MoKα","","0.1","0.085","","","","0.222","","","","","","1.099","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200281","9.4224","0.0002","5.0947","0.0001","21.551","0.0007","90","","94.895","0.0009","90","","1030.77","0.04","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","S-benzyl-L-cysteine","","- C10 H13 N O2 S -","- C10 H13 N O2 S -","- C40 H52 N4 O8 S4 -","4","2","BT6050","Troup, Susan D.; Ward, Mark F.; Jaspars, Marcel; Harrison, William T. A.","<i>S</i>-Benzyl-<small>L</small>-cysteine","Acta Crystallographica Section E","2001","57","6","o535","o537","10.1107/S1600536801008340","","","0.71073","MoKα","","0.095","0.062","","","","0.16","","","","","","0.994","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200282","11.698","0.002","11.698","0.002","19.643","0.015","90","","90","","90","","2688","2","293","","","","","","","","","","","4","P 41","P 4w","76","Methyl 1-{N-[N-(benzyloxycarbonyl)-α-aminoisobutyryl]-α-aminoisobutyryl}- 4-hydroxypyrrolidine-2-carboxylate ethanol solvate","","","- C24 H37 N3 O8 -","- C24 H37 N3 O8 -","- C96 H148 N12 O32 -","4","1","CF6053","Geßmann, Renate; Brückner, Hans; Kokkinidis, Michael","Tripeptide Z‒Aib‒Aib‒Hyp‒OMe","Acta Crystallographica Section E","2001","57","6","o492","o494","10.1107/S1600536801007371","","","1.54178","CuKα","","0.0985","0.0777","","","","0.211","","","","","","1.082","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2200283","9.809","0.001","13.978","0.005","18.73","0.002","90","","90","","90","","2568.1","1","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H37 N O7 -","- C25 H37 N O7 -","- C100 H148 N4 O28 -","4","1","CF6056","Coutrot, Frédéric; Grison, Claude; Coutrot, Philippe; Toupet, Loic","Isopropyl 6,7-dideoxy-1,2:3,4-di-<i>O</i>-isopropylidene-7-{[(<i>S</i>)-1-phenylethyl]amino}-<small>L</small>-<i>glycero</i>-α-<small>D</small>-<i>galacto</i>-octopyranuronate","Acta Crystallographica Section E","2001","57","6","o519","o520","10.1107/S1600536801006481","","","0.71069","MoKα","","0.1313","0.047","","","","0.1252","","","","","","1.009","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200284","16.0658","0.0009","3.9597","0.0002","21.473","0.001","90","","90.619","0.006","90","","1365.94","0.12","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-[(4-Carboxyphenyl)amino]-4-chlorobenzoic acid monohydrate","","- C14 H12 Cl N O5 -","- C14 H12 Cl N O5 -","- C56 H48 Cl4 N4 O20 -","4","1","CF6058","Novoa de Armas, Héctor; Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J.; Xuárez Marill, Lisbet","2-[(4-Carboxyphenyl)amino]-4-chlorobenzoic acid monohydrate","Acta Crystallographica Section E","2001","57","6","o542","o543","10.1107/S160053680100650X","","","1.5418","CuKα","","0.0649","0.05","","0.1527","","0.1527","","","1.126","","","1.126","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200285","10.516","0.001","11.381","0.002","14.558","0.003","87.23","0.02","79.73","0.01","88.54","0.01","1712.2","0.5","293","2","","","","","","","","","","7","P -1","-P 1","2","","","","- C34 H32 Cu2 I2 N4 O4 Pb -","- C35 H34 Cu2 I2 N4 O4 Pb -","- C70 H68 Cu4 I4 N8 O8 Pb2 -","2","1","CF6059","Sarı, Musa; Durmus̨, Sefa; Atakol, Orhan; Svaboda, Ingrid; Fuess, Harmut","Bis[μ-<i>N</i>,<i>N</i>'-bis(salicylidene)-1,3-propanediaminecopper(II)]diiodolead(II)","Acta Crystallographica Section E","2001","57","5","m201","m203","10.1107/S1600536801006511","","","0.71073","MoKα","","","0.0403","","","","0.1004","","","","","","1.005","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200286","14.578","0.003","12.009","0.002","15.849","0.003","90","","103.67","0.03","90","","2696","0.9","150","2","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C29 H28 Cl2 Sb2 -","- C29 H28 Cl2 Sb2 -","- C116 H112 Cl8 Sb8 -","4","0.5","CF6060","Coles, Simon J.; Hursthouse, Michael B.; Joy, Jon S.; Paver, Michael A.","[2,2-Bis(chloromethyl)propylene]bis(diphenylstibine)","Acta Crystallographica Section E","2001","57","6","m261","m262","10.1107/S1600536801006523","","","0.71073","MoKα","","","0.0255","","","","0.0628","","","","","","1.065","","","","has coordinates,has Fobs","198632","2020-10-21","18:00:00",""
"2200287","7.783","0.003","7.8653","0.001","25.61","0.003","90","","90","","90","","1567.7","0.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","2-(3-cyano-coumarin-4-yl)-1-(4-methylthiophenyl)ethene","4-[2-(4-Methylthiophenyl)ethenyl]-2-oxo-2H-1-benzopyran-3-carbonitrile","","- C19 H13 N O2 S -","- C19 H13 N O2 S -","- C76 H52 N4 O8 S4 -","4","1","CI6015","Vijayalakshmi, L.; Parthasarathi, V.; Varu, Bharat; Shah, Anamik","3-Cyano-4-[2-(4-methylthiophenyl)ethenyl]-2<i>H</i>-1-benzopyran-2-one","Acta Crystallographica Section E","2001","57","5","o436","o438","10.1107/S1600536801005852","","","1.5418","CuKα","","0.032","0.03","","","","0.086","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200288","20.212","0.01","11.111","0.008","19.362","0.014","90","","96.53","0.13","90","","4320","5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C50 H38 N2 O4 Ru2 -","- C50 H38 N2 O4 Ru2 -","- C200 H152 N8 O16 Ru8 -","4","1","CI6017","García-Granda, Santiago; Pérez-Priede, Mónica; Vandermaelen, Juan Francisco; Cabeza, Javier A.","(<i>tert</i>-Butyl isocyanide)tetracarbonyl[<i>N</i>-(1,2,3,4-tetraphenylbutadienyl)benzophenone imine]diruthenium(I)","Acta Crystallographica Section E","2001","57","5","m174","m175","10.1107/S1600536801005207","","","0.71073","MoKα","","0.159","0.048","","","","0.142","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200289","6.8673","0.0002","12.8243","0.0003","20.613","0.0005","90","","94.52","0.001","90","","1809.71","0.08","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(Z)-3-Acetonylidene-2,3-dihydro-1H-isoindolin-1-one","","- C11 H9 N O2 -","- C11 H9 N O2 -","- C88 H72 N8 O16 -","8","2","CI6019","Chowdhury, Krishna; Mukhopadhyay, Rupa; Mukherjee, Monika; Broder, Charlotte K.; Kundu, Nitya G.","(<i>Z</i>)-3-Acetonylidene-2,3-dihydro-1<i>H</i>-isoindolin-1-one","Acta Crystallographica Section E","2001","57","5","o421","o423","10.1107/S1600536801005864","","","0.71073","MoKα","","0.052","0.043","","","","0.121","","","","","","1.05","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200290","9.077","0.001","11.065","0.001","17.106","0.001","90","","90","","90","","1718.1","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-{[2-carboxy-5-oxopyrrolidin-1-yl](p-tolyl)methyl}pyroglutamic acid","","- C18 H20 N2 O6 -","- C18 H20 N2 O6 -","- C72 H80 N8 O24 -","4","1","CI6021","Camus, Fabrice; Norberg, Bernadette; Bourry, Anne; Rigo, Benoît; Durant, François","1,1'-(4-Methylbenzylidene)bis(5-oxopyrrolidine-2-carboxylic acid)","Acta Crystallographica Section E","2001","57","5","o439","o440","10.1107/S1600536801006493","","","1.54178","CuKα","","0.029","0.028","","","","0.076","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200291","11.0853","0.0009","8.1425","0.0007","8.453","0.0008","90","","90","","90","","762.99","0.12","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C6 H9 N O3 S -","- C6 H9 N O3 S -","- C24 H36 N4 O12 S4 -","4","1","CI6022","Bolte, Michael; Griesinger, Christian; Sakhaii, Peyman","Pyridinium methylsulfonate: a pseudosymmetric structure","Acta Crystallographica Section E","2001","57","5","o458","o460","10.1107/S1600536801006894","","","0.71073","MoKα","","0.04","0.037","","","","0.098","","","","","","1.1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200292","11.6466","0.0002","17.1438","0.0003","10.5361","0.0002","90","","95.603","0.001","90","","2093.66","0.07","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Trans-dichlorobis(3,5-dimethylpyrazole-N)bis(triphenylphosphine-P)- ruthenium(II)","","- C46 H44 Cl2 N4 P2 Ru -","- C46 H44 Cl2 N4 P2 Ru -","- C92 H88 Cl4 N8 P4 Ru2 -","2","0.5","CI6023","Suchada Chantrapromma; Hoong-Kun Fun; Ibrahim Abdul Razak; Qian-Feng Zhang; Xinquan Xin","<i>trans</i>-Dichlorobis(3,5-dimethylpyrazole-<i>N</i>)bis(triphenylphosphine-<i>P</i>)ruthenium(II)","Acta Crystallographica Section E","2001","57","5","m207","m208","10.1107/S1600536801006997","","","0.71073","MoKα","","0.055","0.039","","","","0.109","","","","","","0.99","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200293","7.213","0.005","52.87","0.003","5.061","0.003","90","","90","","90","","1930","1.8","296.2","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C19 H40 O2 -","- C19 H40 O2 -","- C76 H160 O8 -","4","1","CI6025","Naotake Nakamura; Kenjiro Uno; Yoshihiro Ogawa","Nonadecane-1,19-diol","Acta Crystallographica Section E","2001","57","6","o485","o487","10.1107/S1600536801007176","","","1.5418","CuKα","","","0.04","","","","0.137","","","","","","1.42","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200294","4.2261","0.0006","5.4283","0.0006","23.819","0.003","87.43","0.01","86.56","0.01","83.37","0.01","541.39","0.12","296.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C20 H42 S2 -","- C20 H42 S2 -","- C20 H42 S2 -","1","0.5","CI6026","Naotake Nakamura; Kenjiro Uno; Yoshihiro Ogawa","Icosane-1,20-dithiol","Acta Crystallographica Section E","2001","57","6","o505","o507","10.1107/S1600536801007188","","","1.5418","CuKα","","","0.057","","","","0.159","","","","","","1.769","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200295","4.221","0.001","5.43","0.001","15.615","0.002","85.65","0.01","86.68","0.02","83.51","0.01","354.14","0.12","296.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C12 H26 S2 -","- C12 H26 S2 -","- C12 H26 S2 -","1","0.5","CI6027","Naotake Nakamura; Kenjiro Uno; Yoshihiro Ogawa","Dodecane-1,12-dithiol","Acta Crystallographica Section E","2001","57","6","o508","o510","10.1107/S160053680100719X","","","1.5418","CuKα","","","0.039","","","","0.138","","","","","","1.671","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200296","16.56","0.005","20.69","0.01","9.453","0.002","90","","90","","90","","3239","2","173","","173","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C17 H22 O3 S -","- C17 H22 O3 S -","- C136 H176 O24 S8 -","8","1","CI6031","Ward, A. David; Ward, Virginia R.; Tiekink, Edward R. T.","3,5,5-Trimethyl-2-[2-(phenylsulfonyl)ethyl]-2-cyclohexen-1-one","Acta Crystallographica Section E","2001","57","6","o526","o527","10.1107/S1600536801008248","","","0.71069","MoKα","","0.119","0.04","","","","0.129","","","","","","1.01","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200297","9.4231","0.0002","14.5514","0.0002","22.2014","0.0004","90","","94.56","0.001","90","","3034.6","0.09","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(μ-diphenylthiophosphinito-S:P)bis[(η^5^-cyclopentadienyl)nickel(II)]","","- C34 H30 Ni2 P2 S2 -","- C34 H30 Ni2 P2 S2 -","- C136 H120 Ni8 P8 S8 -","4","1","CV6016","Hoong-Kun Fun; Suchada Chantrapromma; Ibrahim Abdul Razak; Qian-Feng Zhang; Xinquan Xin","Bis(μ-diphenylthiophosphinito-<i>S</i>:<i>P</i>)bis[(η^5^-cyclopentadienyl)nickel(II)]","Acta Crystallographica Section E","2001","57","5","m190","m191","10.1107/S1600536801005475","","","0.71073","MoKα","","0.0457","0.0357","","","","0.0917","","","","","","0.982","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200298","13.332","0.003","13.791","0.003","7.44","0.002","90","","90","","90","","1367.9","0.6","200","2","200","2","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","Dimethyldihydrofluoranthene","(6bR,10aS)-6b,10a-Dimethyl-10,10a-dihydro-9H-fluoranthene","","- C18 H20 -","- C18 H20 -","- C72 H80 -","4","1","CV6017","Parvez, Masood; Simion, Dan V.; Sorensen, Ted S.","(6b<i>R</i>,10a<i>S</i>)-6b,10a-Dimethyl-10,10a-dihydro-9<i>H</i>-fluoranthene","Acta Crystallographica Section E","2001","57","5","o441","o443","10.1107/S1600536801006572","","","0.71069","MoKα","","0.118","0.054","","","","0.214","","","","","","1.11","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200299","13.495","0.002","10.2178","0.0018","15.154","0.003","90","","115.956","0.014","90","","1878.8","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4,5,6,9-tetramethoxy-11-phenyl-10-oxa-11-aza-tricyclo[7.2.2.0 2,7] trideca-2(7),3,5,12-tetraen-8-one","","- C21 H21 N O6 -","- C21 H21 N O6 -","- C84 H84 N4 O24 -","4","1","CV6018","Russi, Silvia; Mombrú, Alvaro W.; Gamenara, Daniela; Dias, Eduardo; Heinzen, Horacio; Moyna, Patrick; Faccio, Ricardo; Suescun, Leopoldo; Mariezcurrena, Raúl A.","4,5,6,9-Tetramethoxy-11-phenyl-10-oxa-11-azatricyclo[7.2.2.0^2,7^]trideca-2(7),3,5,12-tetraen-8-one","Acta Crystallographica Section E","2001","57","5","o444","o446","10.1107/S1600536801006286","","","0.71069","MoKα","","0.099","0.043","","","","0.1448","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200300","9.3876","0.001","10.2213","0.0011","19.64","0.002","90","","103.161","0.002","90","","1835","0.3","293","2","","","","","","","","","","6","P 1 c 1","P -2yc","7","","Poly[[silver(I)-di-μ-1,5-bis(phenylthio)pentane] hexafluorophosphate]","","- C34 H40 Ag F6 P S4 -","- C34 H40 Ag F6 P S4 -","- C68 H80 Ag2 F12 P2 S8 -","2","1","CV6019","Chen, Wei; Du, Miao; Zhang, Ruo-Hua; Bu, Xian-He","Poly[[silver(I)-di-μ-1,5-bis(phenylthio)pentane] hexafluorophosphate]: a two-dimensional molecular-rectangle coordination ploymer","Acta Crystallographica Section E","2001","57","6","m213","m215","10.1107/S1600536801006560","","","0.71073","MoKα","","0.0418","0.034","","","","0.0892","","","","","","1.017","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200301","14.1445","0.0014","6.2718","0.0004","22.34","0.002","90","","103.694","0.011","90","","1925.5","0.3","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H32 O2 Si -","- C19 H32 O2 Si -","- C76 H128 O8 Si4 -","4","1","CV6020","Marcel K. Eberle; Reinhart Keese; Helen Stoeckli-Evans","A bicyclo[3.3.0]octan-2-ylcyclopentanone","Acta Crystallographica Section E","2001","57","5","o461","o462","10.1107/S1600536801006808","","","0.71073","MoKα","","0.0544","0.0406","","","","0.1148","","","","","","1.052","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200302","7.4845","0.0011","13.937","0.002","22.012","0.003","90","","90","","90","","2296.1","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Ramipril","1-[2-(1-ethoxycarbonyl-3-phenylpropylamino)propionyl]octahydrocyclopenta[b]- pyrrole-2-carboxylic acid","","- C23 H32 N2 O5 -","- C23 H32 N2 O5 -","- C92 H128 N8 O20 -","4","1","CV6021","Nagel, Norbert; Schweitzer, Harald; Urbach, Hansjörg; Heyse, Winfried; Müller, Barbara; Berchtold, Harald","Ramipril","Acta Crystallographica Section E","2001","57","5","o463","o465","10.1107/S1600536801006948","","","0.71073","MoKα","","0.1558","0.0643","","","","0.0854","","","","","","0.918","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200303","10.0994","0.0006","5.041","0.0002","9.532","0.0006","90","","90.37","0.005","90","","485.27","0.05","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C F3 Li O3 S -","- C F3 Li O3 S -","- C4 F12 Li4 O12 S4 -","4","1","CV6022","Bolte, Michael; Lerner, Hans-Wolfram","Lithium trifluoromethanesulfonate","Acta Crystallographica Section E","2001","57","6","m231","m232","10.1107/S1600536801007462","","","0.71073","MoKα","","0.0398","0.0292","","","","0.0782","","","","","","1.118","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200304","9.407","0.002","23.121","0.004","11.604","0.002","90","","107.315","0.003","90","","2409.5","0.8","120","","120","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Carbonato-O,O')bis(1,2-ethanediamine-N,N')cobalt(III) nitrate monohydrate","","- C5 H18 Co N5 O7 -","- C5 H18 Co N5 O7 -","- C40 H144 Co8 N40 O56 -","8","2","CV6023","Alan Hazell; Josua Jepsen","(Carbonato-<i>O</i>,<i>O</i>')bis(1,2-ethanediamine-<i>N</i>,<i>N</i>')cobalt(III) nitrate monohydrate","Acta Crystallographica Section E","2001","57","6","m239","m241","10.1107/S1600536801007577","","","0.71073","MoKα","","","0.026","","","","0.032","","","","","","0.956","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200305","10.909","0.003","18.502","0.007","13.092","0.004","90","","97.143","0.012","90","","2622","1.5","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-(4-Methyl-benzylidene)-4,8-diphenyl-6-p-tolyl-2-oxa- 3,7-diazaspiro[4.4]nona-3,7-dien-1-one","","- C33 H26 N2 O2 -","- C33 H26 N2 O2 -","- C132 H104 N8 O8 -","4","1","NA6057","Bruno, Giuseppe; Nicoló, Francesco; Rotondo, Archimede; Foti, Francesco; Risitano, Francesco; Grassi, Giovanni; Bilardo, Cristina","9-(4-Methylbenzylidene)-4,8-diphenyl-6-<i>p</i>-tolyl-2-oxa-3,7-diazaspiro[4.4]nona-3,7-dien-1-one","Acta Crystallographica Section E","2001","57","5","o396","o398","10.1107/S1600536801005608","","","0.71073","MoKα","","0.1629","0.0493","","","","0.126","","","","","","1.144","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200306","9.127","0.002","10.45","0.003","14.632","0.003","99.172","0.019","101.131","0.017","101.239","0.018","1314.6","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","9-(2-Methoxy-benzylidene)-6-(2-methoxy-phenyl)-4,8-diphenyl-2-oxa- 3,7-diazaspiro[4.4]nona-3,7-dien-1-one","","- C33 H26 N2 O4 -","- C33 H26 N2 O4 -","- C66 H52 N4 O8 -","2","1","NA6058","Bruno, Giuseppe; Nicoló, Francesco; Rotondo, Archimede; Foti, Francesco; Risitano, Francesco; Grassi, Giovanni; Bilardo, Cristina","9-(2-Methoxybenzylidene)-6-(2-methoxyphenyl)-4,8-diphenyl-2-oxa-3,7-diazaspiro[4.4]nona-3,7-dien-1-one","Acta Crystallographica Section E","2001","57","5","o399","o401","10.1107/S160053680100561X","","","0.71073","MoKα","","0.1264","0.0414","","","","0.0972","","","","","","0.716","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200307","7.317","0.001","17.787","0.004","12.422","0.002","90","","98.7","0.03","90","","1598.1","0.5","294","2","294","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","7a,13b-ethylenedioxy-1-hydroxy-7a,13b-dihydrodibenzo[a,kl]xanthene","","- C22 H16 O4 -","- C22 H16 O4 -","- C88 H64 O16 -","4","1","NA6063","Cai, Yue-Peng; Tan, Duan-Min; Su, Cheng-Yong; Liao, Miao-Fen; Kang, Bei-Sheng; Xu, Zun-Le","7a,13b-Ethylenedioxy-1-hydroxy-7a,13b-dihydrodibenzo[<i>a</i>,<i>kl</i>]xanthene","Acta Crystallographica Section E","2001","57","6","o528","o530","10.1107/S1600536801007772","","","0.71073","MoKα","","0.0667","0.0452","","","","0.1358","","","","","","1.009","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200308","6.5392","0.0002","7.6077","0.0001","20.3127","0.0005","90","","90","","90","","1010.52","0.04","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-[(3-Pyridylamino)methyl]phenol","","- C12 H12 N2 O -","- C12 H12 N2 O -","- C48 H48 N8 O4 -","4","1","NA6064","Chen, Zhen-Feng; Xie, Yong-Rong; Fun, Hoong-Kun; Chantrapromma, Suchada; Razak, Ibrahim Abdul; Xiong, Ren-Gen; You, Xiao-Zeng","4-[(3-Pyridylamino)methyl]phenol","Acta Crystallographica Section E","2001","57","5","o411","o413","10.1107/S1600536801005037","","","0.71073","MoKα","","0.11","0.0577","","","","0.1333","","","","","","0.99","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200309","33.805","0.005","7.1247","0.0009","7.2074","0.001","90","","90","","90","","1735.9","0.4","290","2","290","2","","","","","","","","3","C m c 21","C 2c -2","36","","2,6-Bis[1-(phenylimino)ethyl]pyridine","","- C21 H19 N3 -","- C21 H19 N3 -","- C84 H76 N12 -","4","0.5","NA6065","Ayfer Mentes; John Fawcett; Raymond D. W. Kemmitt","2,6-Bis[1-(phenylimino)ethyl]pyridine","Acta Crystallographica Section E","2001","57","5","o424","o425","10.1107/S1600536801005943","","","0.71073","MoKα","","0.0645","0.0489","","","","0.1509","","","","","","1.072","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200310","8.411","0.002","9.617","0.003","10.538","0.003","102.62","0.02","91.23","0.02","102.94","0.02","808.5","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-(2,4-Dinitrophenyl)-3-(2-hydroxy-5-methylphenyl)pyrazole-4-carboxaldehyde","","- C17 H12 N4 O6 -","- C17 H12 N4 O6 -","- C34 H24 N8 O12 -","2","1","NA6066","Jeyakanthan, J.; Velmurugan, D.; Selvi, S.; Perumal, P. T.","1-(2,4-Dinitrophenyl)-3-(2-hydroxy-5-methylphenyl)pyrazole-4-carboxaldehyde","Acta Crystallographica Section E","2001","57","5","o474","o476","10.1107/S1600536801006900","","","1.5418","CuKα","","0.0825","0.0504","","","","0.1764","","","","","","1.169","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200311","6.6181","0.0012","7.4989","0.0011","9.9","0.004","90","","92.62","0.02","90","","490.8","0.2","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","Trichloro(sarcosinium) zinc(II) monohydrate","Trichloro(sarcosinium) zinc(II) monohydrate","","- C3 H10 Cl3 N O3 Zn -","- C3 H10 Cl3 N O3 Zn -","- C6 H20 Cl6 N2 O6 Zn2 -","2","1","NA6068","Krishnakumar, R. V.; Subha Nandhini, M.; Natarajan, S.","Trichloro(sarcosinio)zinc(II) monohydrate","Acta Crystallographica Section E","2001","57","5","m192","m194","10.1107/S160053680100592X","","","0.71073","MoKα","","0.0179","0.0173","","","","0.0527","","","","","","1.275","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200312","34.65","0.002","3.73","0.002","20.76","0.002","90","","110.47","0.06","90","","2513.7","1.7","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","diflunisal hydrate","2',4'-Difluoro-4-hydroxybiphenyl-3-carboxylic acid hydrate","","- C13 H10 F2 O4 -","- C13 H9 F2 O4 -","- C104 H72 F16 O32 -","8","1","NA6069","Hansen, Lars Kr.; Perlovich, German L.; Bauer-Brandl, Annette","The 1:1 hydrate of diflunisal","Acta Crystallographica Section E","2001","57","5","o477","o479","10.1107/S1600536801006973","","","0.71069","MoKα","","0.0995","0.0496","","","","0.1776","","","","","","0.826","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200313","7.1142","0.0002","11.0127","0.0003","16.463","0.0004","90","","90.078","0.001","90","","1289.82","0.06","133","","133","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H14 N4 O -","- C13 H14 N4 O -","- C52 H56 N16 O4 -","4","1","NA6071","Bolte, Michael; Kühl, Christine; Lüning, Ulrich","<i>N</i>,<i>N</i>'-Bis(6-methyl-2-pyridyl)urea","Acta Crystallographica Section E","2001","57","6","o502","o504","10.1107/S1600536801007334","","","0.71073","MoKα","","0.0441","0.0356","","","","0.0945","","","","1.119","1.119","1.085","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200314","12.996","0.003","5.8243","0.0012","42.693","0.009","90","","97.42","0.03","90","","3204.5","1.2","150","2","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H16 O7 -","- C20 H16 O7 -","- C160 H128 O56 -","8","2","NA6072","Coles, Simon J.; Hursthouse, Michael B.","4,8-Bis(3,4-methylenedioxy)phenyl-3,7-dioxabicyclo[3.3.0]octan-2-one","Acta Crystallographica Section E","2001","57","6","o544","o546","10.1107/S1600536801007437","","","0.71073","MoKα","","","0.0633","","","","0.1484","","","","","","0.866","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200315","15.244","0.002","15.244","0.002","15.244","0.002","90","","90","","90","","3542.4","0.8","173","2","173","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","","","","- C24 H48 Cl6 Fe3 O7 -","- C24 H48 Cl6 Fe3 O7 -","- C96 H192 Cl24 Fe12 O28 -","4","0.166667","NA6073","Bolte, Michael; Lerner, Hans-Wolfram; Scholz, Stefan","[Fe(thf)~6~][Cl~3~Fe‒O‒FeCl~3~]","Acta Crystallographica Section E","2001","57","6","m216","m217","10.1107/S1600536801007115","","","0.71073","MoKα","","0.1377","0.056","","","","0.1327","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200316","8.9591","0.0005","16.614","0.001","10.7359","0.0006","90","","91.83","0.01","90","","1597.19","0.16","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(dimethylglyoximato-N,N')(ethanol-O)nitrocobalt(III)","","- C10 H20 Co N5 O7 -","- C10 H20 Co N5 O7 -","- C40 H80 Co4 N20 O28 -","4","1","NA6074","Hu, Chunhua; Englert, Ulli","Bis(dimethylglyoximato-<i>N</i>,<i>N</i>')(ethanol-<i>O</i>)nitrocobalt(III), [Co(Hdmg)~2~(NO~2~)(EtOH)]","Acta Crystallographica Section E","2001","57","6","m222","m223","10.1107/S1600536801007383","","","0.71073","MoKα","","0.0559","0.0426","","","","0.108","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200317","11.206","0.0017","9.3052","0.001","14.4925","0.0018","90","","101.979","0.008","90","","1478.3","0.3","220","1","220","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","7-phenyl-5H-dibenz[c,e]azepine N-oxide","","- C20 H15 N O -","- C20 H15 N O -","- C80 H60 N4 O4 -","4","1","NA6075","Gould, Robert O.; Krieger, Matthias; Sharp, John T.","7-Phenyl-5<i>H</i>-dibenz[<i>c</i>,<i>e</i>]azepine <i>N</i>-oxide","Acta Crystallographica Section E","2001","57","6","o521","o523","10.1107/S1600536801008042","","","1.5418","CuKα","","0.0452","0.0399","","","","0.1083","","","","","","1.052","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200318","11.425","0.003","5.542","0.003","12.95","0.004","90","","106.39","0.02","90","","786.6","0.5","296.2","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C18 H16 Cu N2 O4 -","- C18 H16 Cu N2 O4 -","- C36 H32 Cu2 N4 O8 -","2","0.5","NA6078","Okabe, Nobuo; Saishu, Hiroko","Bisaquabis(8-hydroxyquinolinato-<i>N</i>,<i>O</i>)copper(II)","Acta Crystallographica Section E","2001","57","6","m251","m252","10.1107/S1600536801008297","","","0.7107","MoKα","","","0.0327","","","","0.1109","","","","","","0.914","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200319","11.914","0.002","12.399","0.005","26.133","0.005","90","","90","","90","","3860.4","1.8","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","7-Cyclopentyl-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidine-4-ylamine","","- C23 H22 N4 O -","- C23 H22 N4 O -","- C184 H176 N32 O8 -","8","1","NA6079","Zrinka Banić Tomišić; Andreja Čempuh; Ivica Malnar","7-Cyclopentyl-5-(4-phenoxyphenyl)-7<i>H</i>-pyrrolo[2,3-<i>d</i>]pyrimidine-4-ylamine, an lck tyrosine kinase inhibitor","Acta Crystallographica Section E","2001","57","6","o511","o513","10.1107/S1600536801007917","","","0.71069","MoKα","","0.4675","0.0614","","","","0.136","","","","","","0.841","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200320","17.761","0.004","6.6774","0.0013","19.173","0.004","90","","96.91","0.02","90","","2257.3","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Aqua(n-pentyl)[3,3'-(propane-1,3-diyldinitrilo)bis(butan-2-one)dioximato- ^4^N]cobalt(III)perchlorate","","- C16 H32 Cl Co N4 O7 -","- C16 H32 Cl Co N4 O7 -","- C64 H128 Cl4 Co4 N16 O28 -","4","1","OB6033","Shen, Xu-Jie; Chen, Hui-Lan; Duan, Chun-Ying; Liu, Yong-Jiang","Aqua(<i>n</i>-pentyl)[3,3'-(propane-1,3-diyldinitrilo)bis(butan-2-one) dioximato-κ^4^<i>N</i>]cobalt(III) perchlorate","Acta Crystallographica Section E","2001","57","5","m188","m189","10.1107/S1600536801005086","","","0.71073","MoKα","","0.1003","0.0656","","","","0.1887","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200321","6.2854","0.0019","8.626","0.003","15.318","0.005","97.391","0.006","97.498","0.006","100.559","0.007","799.5","0.5","293","2","","","","","","","","","","4","P -1","-P 1","2","","2-tert-Butyl-4-methyl-6-(4-piperidylmethyl)phenol","","- C17 H27 N O -","- C17 H27 N O -","- C34 H54 N2 O2 -","2","1","OB6034","Xu Deng; Ya-Mei Guo; Miao Du; Ya-Yin Fang","2-<i>tert</i>-Butyl-4-methyl-6-(4-piperidylmethyl)phenol","Acta Crystallographica Section E","2001","57","6","o488","o489","10.1107/S1600536801006328","","","0.71073","MoKα","","0.1533","0.0584","","","","0.1551","","","","","","0.993","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200322","9.61","0.002","11.313","0.002","13.455","0.003","80.96","0.03","81.45","0.03","77.78","0.03","1401.8","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Tetraaqua[3-(1H-imidazol-4-yl)-2-(6-{N-[(1H-imidazol-4-yl)-1-carboxylatoethyl]- carbamoyl}-2-pyridylcarbonylamino)propionato]nickel(II) pentahydrate","","- C19 H35 N7 Ni O15 -","- C19 H35 N7 Ni O15 -","- C38 H70 N14 Ni2 O30 -","2","1","OB6035","Joussef, Antônio C.; Ceccato, Augusto S.; Bortoluzzi, Adailton J.; de Brito, Marcos A.; Drechsel, Sueli M.","Tetraaqua[3-(1<i>H</i>-imidazol-4-yl)-2-(6-{<i>N</i>-[(1<i>H</i>-imidazol-4-yl)-1-carboxylatoethyl]carbamoyl}-2-pyridylcarbonylamino)propionato]nickel(II) pentahydrate","Acta Crystallographica Section E","2001","57","6","m224","m226","10.1107/S1600536801007164","","","0.71073","MoKα","","0.073","0.041","","","","0.114","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200323","11.235","0.003","5.8312","0.0014","13.0948","0.0019","90","","91.282","0.016","90","","857.7","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","L-Valine L-Valinium Perchlorate","L-Valine L-Valinium Perchlorate monohydrate","","- C10 H25 Cl N2 O9 -","- C10 H25 Cl N2 O9 -","- C20 H50 Cl2 N4 O18 -","2","1","OB6036","S. Pandiarajan; B. Sridhar; R. K. Rajaram","<small>L</small>-Valine <small>L</small>-valinium perchlorate monohydrate","Acta Crystallographica Section E","2001","57","5","o466","o468","10.1107/S160053680100681X","","","0.71073","MoKα","","0.0445","0.0371","","","","0.11","","","","","","1.172","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200324","7.2861","0.0015","20.179","0.004","10.453","0.002","90","","103.47","0.03","90","","1494.6","0.5","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Octaaquabis[dihydrogen 1,2,4,5-benzenetetracarboxylate(2-)]dissodium(I)zinc(II) dihydrate","","- C20 H28 Na2 O26 Zn -","- C20 H28 Na2 O26 Zn -","- C40 H56 Na4 O52 Zn2 -","2","0.25","OB6037","Chuan-De Wu; Ding-Ming Wu; Can-Zhong Lu; Jin-Shun Huang","Octaaquabis[dihydrogen 1,2,4,5-benzenetetracarboxylate(2‒)]disodium(I)zinc(II) dihydrate","Acta Crystallographica Section E","2001","57","6","m253","m255","10.1107/S1600536801008261","","","0.71073","MoKα","","0.0762","0.0564","","","","0.1634","","","","","","1.089","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200325","8.5577","0.0002","10.7752","0.0003","11.0632","0.0003","90","","97.386","0.0009","90","","1011.68","0.05","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3,5-Diiodo-4-oxo-1,4-dihydropyridine-1-acetic acid","","- C7 H5 I2 N O3 -","- C7 H5 I2 N O3 -","- C28 H20 I8 N4 O12 -","4","1","OB6039","Cox, Philip J.; Hickey, Geraldine","3,5-Diiodo-4-oxo-1,4-dihydropyridine-1-acetic acid","Acta Crystallographica Section E","2001","57","6","o495","o497","10.1107/S160053680100722X","","","0.71073","MoKα","","0.053","0.05","","","","0.1364","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200326","10.7043","0.0002","10.723","0.0002","13.9487","0.0003","103.352","0.001","111.835","0.001","92.519","0.001","1431.01","0.05","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-{4-[2-(2-hydroxyethyl)methylamino]benzylideneamino}-5-methyl- 1,2,4-triazole-3-thione","","- C13 H17 N5 O S -","- C13 H17 N5 O S -","- C52 H68 N20 O4 S4 -","4","2","OB6040","Ji Wu; Yu-Peng Tian; Fu-Xin Xie; Suchada Chantrapromma; Hoong-Kun Fun; Ibrahim Abdul Razak","4-Amino-5-methyl-1,2,4-triazole-3-thione derivative of 4-[2-(2-hydroxyethyl)methylamino]benzaldehyde","Acta Crystallographica Section E","2001","57","6","o547","o549","10.1107/S1600536801007851","","","0.71073","MoKα","","0.0815","0.0536","","","","0.1456","","","","","","0.964","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200327","11.81","0.002","13.985","0.003","14.434","0.003","90","","90","","90","","2384","0.8","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","dimethyl(Z)-[(8aS,2R, 4aR, 4bR)-8a-methoxycarbonyl-1,4a,7- -trimethyl-8-oxo-2,3,4,4a,4b,5,8,8a,9,10-decahydro- -phenanthren-2-yl]-2-butenedioate","","- C25 H32 O7 -","- C25 H32 O7 -","- C100 H128 O28 -","4","1","OB6041","Abad, Antonio; Agulló, Consuelo; Cuñat, Ana C.; Navarro, Ismael; Ramírez de Arellano, Carmen","The product of a regiospecific and stereoselective ene-reaction of a polycyclic terpenoid system","Acta Crystallographica Section E","2001","57","6","o553","o554","10.1107/S1600536801008510","","","0.71073","MoKα","","0.0778","0.0491","","","","0.123","","","","","","1.094","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200328","6.3521","0.0007","10.4406","0.0006","13.523","0.001","90","","97.199","0.004","90","","889.77","0.13","123.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H10 N2 O -","- C10 H10 N2 O -","- C40 H40 N8 O4 -","4","1","OB6043","Yoshinori Naruta; Yoshimitsu Tachi; Takefumi Chishiro; Yuichi Shimazaki; Fumito Tani","2-(Imidazol-1-yl)-4-methylphenol","Acta Crystallographica Section E","2001","57","6","o550","o552","10.1107/S1600536801008492","","","0.7107","MoKα","","","0.049","","","","0.1569","","","","","","1.604","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200329","6.8839","0.0011","12.463","0.0017","7.9173","0.0012","90","","111.127","0.018","90","","633.6","0.18","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C4 H14 Br2 N2 Ni O4 -","- C4 H14 Br2 N2 Ni O4 -","- C8 H28 Br4 N4 Ni2 O8 -","2","0.5","OM6004","Assoumatine, Tokouré; Stoeckli-Evans, Helen","<i>trans</i>-Bis(acetonitrile-<i>N</i>)tetraaquanickel(II) dibromide","Acta Crystallographica Section E","2001","57","5","m179","m180","10.1107/S1600536801005323","","","0.71073","MoKα","","0.0474","0.0397","","","","0.1122","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200330","15.14","0.004","13.655","0.003","12.286","0.003","90","","110.51","0.03","90","","2379","1.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(1-Adamantyl)-4-hydroxy-2-(2-methylpropyl)-2-oxo-1,2-dihydroquinoline-3- carboxamide","","- C25.5 H34 N2 O3.5 -","- C25.5 H34 N2 O3.5 -","- C102 H136 N8 O14 -","4","1","OM6005","Shishkina, Svetlana V.; Shishkin, Oleg V.; Ukrainets, Igor V.; Maher Amer; Sidorenko, Lyudmila V.","<i>N</i>-(1-Adamantyl)-4-hydroxy-2-(2-methylpropyl)-2-oxo-1,2-dihydroquinoline-3-carboxamide","Acta Crystallographica Section E","2001","57","5","o414","o415","10.1107/S1600536801005591","","","0.71073","MoKα","","0.2399","0.0688","","","","0.212","","","","","","0.907","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2200331","6.7112","0.0008","10.4414","0.0008","17.687","0.002","90","","90","","90","","1239.4","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","8-Oxa-1-aza-7-phenylbicyclo[5.2.1]decane-9,10-dione","","- C14 H15 N O3 -","- C14 H15 N O3 -","- C56 H60 N4 O12 -","4","1","OM6011","Kubicki, Maciej; Codding, Penelope W.","8-Oxa-1-aza-7-phenylbicyclo[5.2.1]decane-9,10-dione","Acta Crystallographica Section E","2001","57","5","o406","o407","10.1107/S160053680100558X","","","1.54178","CuKα","","0.0744","0.0628","","","","0.1369","","","","","","1.1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200332","10.365","0.002","15.529","0.004","11.767","0.003","90","","93.33","0.02","90","","1890.8","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","PK11195","1-(2-Chlorophenyl)-N-methyl-N-(1-methylpropyl)isoquinoline-3-carboxamide","","- C21 H21 Cl N2 O -","- C21 H21 Cl N2 O -","- C84 H84 Cl4 N8 O4 -","4","1","OM6013","Kubicki, Maciej; Codding, Penelope W.","1-(2-Chlorophenyl)-<i>N</i>-methyl-<i>N</i>-(1-methylpropyl)isoquinoline-3-carboxamide","Acta Crystallographica Section E","2001","57","5","o389","o391","10.1107/S160053680100530X","","","1.54178","CuKα","","0.0962","0.0688","","","","0.164","","","","","","1.291","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200333","14.016","0.0007","38.4862","0.0012","17.2175","0.0005","90","","90","","90","","9287.5","0.6","174","2","174","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Bis[(μ-1,3-diphenylpropane-1,3-dionato-O,O':O')dimethylthallium]","","- C34 H34 O4 Tl2 -","- C34 H34 O4 Tl2 -","- C408 H408 O48 Tl24 -","12","1.5","OM6014","Britton, Doyle","Bis[(μ-1,3-diphenylpropane-1,3-dionato-<i>O</i>,<i>O</i>':<i>O</i>')dimethylthallium], [(CH~3~)~2~Tl(bzbz)]~2~","Acta Crystallographica Section E","2001","57","5","m176","m178","10.1107/S1600536801005311","","","0.71073","MoKα","","0.057","0.046","","","","0.107","","","","","","1.136","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200334","10.7917","0.0014","11.0583","0.0014","11.7156","0.0015","63.282","0.002","77.173","0.002","71.153","0.002","1177","0.3","171","2","171","2","","","","","","","","6","P -1","-P 1","2","","trans-bis(Triphenylphosphine)bis(4,4,4-trifluoro-1-phenyl- 1,3-butanedionato-O,O')nickel(II)","","- C56 H42 F6 Ni O4 P2 -","- C56 H42 F6 Ni O4 P2 -","- C56 H42 F6 Ni O4 P2 -","1","0.5","OM6015","Dickman, Michael H.","<i>trans</i>-Bis(4,4,4-trifluoro-1-phenyl-1,3-butanedionato-<i>O</i>,<i>O</i>')bis(triphenylphosphine-<i>P</i>)nickel(II) at 173K","Acta Crystallographica Section E","2001","57","6","m220","m221","10.1107/S1600536801005220","","","0.71073","MoKα","","0.0532","0.0407","","","","0.1086","","","","","","1.012","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200335","8.3588","0.0004","10.6774","0.0004","12.5709","0.0005","99.033","0.003","108.701","0.004","99.057","0.003","1023.33","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","α-[(diphenylmethoxy)methyl]-2,5-dimethyl-1-pyrrolidineethanol","","- C22 H29 N O2 -","- C22 H29 N O2 -","- C44 H58 N2 O4 -","2","1","OM6016","Kubicki, Maciej; Codding, Penelope W.","α-[(Diphenylmethoxy)methyl]-2,5-dimethyl-1-pyrrolidineethanol","Acta Crystallographica Section E","2001","57","6","o490","o491","10.1107/S1600536801006638","","","1.54178","CuKα","","0.0488","0.043","","","","0.1156","","","","","","1.092","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200336","10.0838","0.0016","25.963","0.004","10.1696","0.0017","90","","95.641","0.014","90","","2649.6","0.7","296","2","296","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","Tricarbonylchromium dihydroacenaphthylene complex","exo-(±)-Tricarbonyl(η^6^-1-hydroxy-1,2-dihydroacenaphthylene)chromium(0)","","- C15 H10 Cr O4 -","- C15 H10 Cr O4 -","- C120 H80 Cr8 O32 -","8","2","OM6017","Parvez, Masood; Simion, Dan V.; Sorensen, Ted S.","<i>exo</i>-(±)-Tricarbonyl(η^6^-1-hydroxy-1,2-dihydroacenaphthylene)chromium(0)","Acta Crystallographica Section E","2001","57","5","m204","m206","10.1107/S1600536801006304","","","0.71069","MoKα","","0.253","0.047","","","","0.161","","","","","","0.95","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200337","17.48","0.002","11.443","0.002","21.889","0.003","90","","91.95","0.02","90","","4375.8","1.1","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H64 N4 Si2 W -","- C44 H64 N4 Si2 W -","- C176 H256 N16 Si8 W4 -","4","1","OM6018","Mills, Ryan C.; Boncella, James M.; Abboud, Khalil A.","A chelate-stabilized tungsten‒bis(imido) complex","Acta Crystallographica Section E","2001","57","6","m218","m219","10.1107/S160053680100664X","","","0.71073","MoKα","","0.0356","0.0221","","","","0.0471","","","","","","1.002","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200338","12.6157","0.0004","8.2419","0.0004","7.5397","0.0008","90","","90","","90","","783.96","0.09","120","","120","","","","","","","","","4","P n m a","-P 2ac 2n","62","","trimethylsulfonium methanesulfonate","","- C4 H12 O3 S2 -","- C4 H12 O3 S2 -","- C16 H48 O12 S8 -","4","0.5","OM6021","Fronczek, Frank R.; Johnson, Rolanda J.; Strongin, Robert M.","Trimethylsulfonium methanesulfonate","Acta Crystallographica Section E","2001","57","5","o447","o448","10.1107/S1600536801006651","","","0.71073","MoKα","","0.074","0.039","","","","0.089","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200339","9.2865","0.0016","9.6572","0.0018","8.2077","0.0018","98.813","0.018","92.841","0.017","65.794","0.012","663.4","0.2","296","","296","","","","","","","","","5","P -1","-P 1","2","","α-bromoisopropyl mesityl sulfone","","- C12 H17 Br O2 S -","- C12.002 H17.006 Br0.983 O2 S -","- C24.004 H34.012 Br1.966 O4 S2 -","2","1","OM6022","Chan-Yu-King, Roch; Hou, Yuqing; Sandrock, Paul; Meyers, Cal Y.; Robinson, Paul D.","2-Bromo-2-propyl mesityl sulfone","Acta Crystallographica Section E","2001","57","5","o449","o450","10.1107/S1600536801006687","","","0.71069","MoKα","","0.13","0.055","","","","0.169","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2200340","12.472","0.0009","16.07","0.0012","14.0635","0.0011","90","","104.66","0.02","90","","2726.9","0.4","90","2","90","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","NacNacAlH2","","","- C29 H43 Al N2 -","- C29 H43 Al N2 -","- C116 H172 Al4 N8 -","4","1","OM6027","Twamley, Brendan; Hardman, Ned J.; Power, Philip P.","A primary monomeric alane: [<i>N</i>,<i>N</i>'-bis(2,6-diisopropylphenyl)pentane-2,4-diiminato-<i>N</i>,<i>N</i>']dihydridoaluminium","Acta Crystallographica Section E","2001","57","6","m227","m228","10.1107/S1600536801007413","","","0.71073","MoKα","","0.093","0.049","","","","0.135","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200341","11.669","0.004","11.7771","0.0016","6.175","0.0012","101.711","0.014","95.71","0.03","75.948","0.017","805","0.3","296","","296","","","","","","","","","4","P -1","-P 1","2","","2-Bromo-2-propyl 2-(5-tert-butyl-1,3-xylyl) ketone","","- C16 H23 Br O -","- C16.0001 H23.0003 Br0.9999 O -","- C32.0002 H46.0006 Br1.9998 O2 -","2","1","OM6028","Robinson, Paul D.; Sandrock, Paul; Xie, Songwen; Meyers, Cal Y.","2-Bromo-2-propyl 2-(5-<i>tert</i>-butyl-1,3-xylyl) ketone","Acta Crystallographica Section E","2001","57","6","o555","o557","10.1107/S1600536801008522","","","0.71069","MoKα","","0.19","0.07","","","","0.261","","","","","","1.029","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2200342","10.165","0.002","10.365","0.002","9.053","0.002","112.93","0.01","100.12","0.02","102.37","0.01","821.7","0.3","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C19 H17 N S2 -","- C19 H17 N S2 -","- C38 H34 N2 S4 -","2","1","TK6007","Tolhurst, Vicki-Anne; Ball, Rachel J.; Genge, Anthony R. J.","2,6-Bis(phenylthiomethyl)pyridine","Acta Crystallographica Section E","2001","57","5","o392","o393","10.1107/S1600536801005293","","","0.7107","MoKα","","","0.0343","","","0.0407","","","","","3.021","3.021","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200343","21.585","0.004","11.675","0.003","8.092","0.002","90","","90","","90","","2039.2","0.8","293","2","293","2","","","","","","","","3","C m c 21","C 2c -2","36","","","","- C24 H24 O5 -","- C24 H24 O5 -","- C96 H96 O20 -","4","0.5","TK6010","Sim, Wonbo; Lee, Jai Young; Kim, Jong Seung; Kim, Moon-Jib; Kim, Jin-Gyu; Suh, Il-Hwan","2,11,18,21,24-Pentaoxatetracyclo[23.4.0.0^4,9^.0^12,17^]nonaicosa-1(25),4(9),5,7,12(17),13,15,26,28-nonaene","Acta Crystallographica Section E","2001","57","5","o416","o418","10.1107/S1600536801005505","","","0.71069","MoKα","","0.142","0.045","","","","0.107","","","","","","0.981","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2200344","12.2039","0.0008","12.2039","0.0008","8.343","0.001","90","","90","","90","","1242.57","0.19","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-N-benzyl-4-carboxybenzotriazole","","- C14 H11 N3 O2 -","- C14 H11 N3 O2 -","- C56 H44 N12 O8 -","4","1","TK6012","Graham Smith; Steven E. Bottle; Damien A. Reid; D. Paul Schweinsberg; Raymond C. Bott","A novel benzylated carboxytriazole: 1-benzyl-4-carboxybenzotriazole","Acta Crystallographica Section E","2001","57","6","o531","o532","10.1107/S1600536801008133","","","0.71069","MoKα","","0.133","0.042","","","","0.102","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200345","7.109","0.003","15.014","0.002","17.139","0.002","90","","90","","90","","1829.3","0.8","200","","","","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C18 H16 Ag F6 P S2 -","- C18 H16 Ag F6 P S2 -","- C72 H64 Ag4 F24 P4 S8 -","4","0.5","TK6013","Wen, Ming; Munakata, Megumu; Suenaga, Yusaku; Kuroda-Sowa, Takayoshi; Maekawa, Masahiko; Yan, Sheng Gang","A bent two-coordinate silver(I) complex with 2,2',3,3'-tetrahydro-4,4'-dithia-1,1'-binaphylidene","Acta Crystallographica Section E","2001","57","6","m246","m247","10.1107/S1600536801007759","","","0.7107","MoKα","","","0.034","","","","0.079","","","","","","1.13","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200346","8.444","0.004","15.58","0.007","11.579","0.006","90","","110.333","0.009","90","","1428.4","1.2","293","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(R,R)-1,3-Bis(phenylsulfinyl)propane","","- C15 H16 O2 S2 -","- C15 H16 O2 S2 -","- C60 H64 O8 S8 -","4","1","TK6014","Wei Chen; Miao Du; Wei Weng; Ruo-Hua Zhang; Xian-He Bu","(<i>R</i>,<i>R</i>)-1,3-Bis(phenylsulfinyl)propane","Acta Crystallographica Section E","2001","57","5","o430","o431","10.1107/S1600536801006134","","","0.71073","MoKα","","0.052","0.044","","","","0.127","","","","","","1.1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200347","6.743","0.005","19.418","0.005","22.095","0.005","90","","90","","90","","2893","2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Tri(L-Isoleucinium) sulfate bisulfate","Tri(L-Isoleucinium) sulfate bisulfate","","- C18 H43 N3 O14 S2 -","- C18 H43 N3 O14 S2 -","- C72 H172 N12 O56 S8 -","4","1","TK6015","B. Sridhar; N. Srinivasan; R. K. Rajaram","Tri(<small>L</small>-isoleucinium) sulfate bisulfate","Acta Crystallographica Section E","2001","57","6","o558","o560","10.1107/S1600536801008583","","","0.71069","MoKα","","0.145","0.047","","","","0.125","","","","","","0.99","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200348","8.8053","0.0018","13.885","0.003","15.647","0.003","90","","90","","90","","1913","0.7","163","2","163","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","Dichoro[(3-methyl-2-p-tolylsulfonamidobutyl)-κ^2^N,O:η^5^-cyclopentadienyl]- titanium","","- C17 H21 Cl2 N O2 S Ti -","- C17 H21 Cl2 N O2 S Ti -","- C68 H84 Cl8 N4 O8 S4 Ti4 -","4","1","TK6016","Lensink, Cornelis; Gainsford, Graeme J.; Brandsma, Menno","Dichloro[(3-methyl-2-<i>p</i>-tolylsulfonamidobutyl)-κ^2^<i>N</i>,<i>O</i>:η^5^-cyclopentadienyl]titanium","Acta Crystallographica Section E","2001","57","5","m211","m212","10.1107/S1600536801007061","","","0.71073","MoKα","","0.022","0.021","","","","0.056","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200349","9.4515","0.0002","10.7953","0.0003","12.7494","0.0004","90","","109.025","0.001","90","","1229.79","0.06","149","2","","","","","","","","","","4","P 1 21 1","P 2yb","4","","oxobis(2,2,6,6-tetramethyl-3,5-heptadionato)vanadium(IV)","","- C22 H38 O5 V -","- C22 H38 O5 V -","- C44 H76 O10 V2 -","2","1","TK6017","Urs, Usha K.; Anitha, K. C.; Lakshmi Raghunathan, K.; Shivashankar, S. A.; Robinson, W. T.; Guru Row, T. N.","Low-temperature oxobis(2,2,6,6-tetramethyl-3,5-heptanedionato)vanadium(IV)","Acta Crystallographica Section E","2001","57","6","m242","m243","10.1107/S1600536801007760","","","0.71073","MoKα","","","0.074","","","","0.187","","","","","","0.92","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200350","9.147","0.006","10.138","0.007","9.699","0.008","90","","92.02","0.04","90","","898.9","1.1","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2'-amino-3',5'-dibromoacetophenone","","- C8 H7 Br2 N O -","- C8 H7 Br2 N O -","- C32 H28 Br8 N4 O4 -","4","1","TK6020","Baker, L-J.; Copp, Brent R.; Rickard, Clifton E. F.","2'-Amino-3',5'-dibromoacetophenone","Acta Crystallographica Section E","2001","57","6","o538","o539","10.1107/S1600536801008388","","","0.71073","MoKα","","0.026","0.023","","","","0.061","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200351","21.9206","0.0006","7.3583","0.0002","5.0596","0.0002","90","","90","","90","","816.11","0.05","291","2","291","2","","","","","","","","5","P n a 21","P 2c -2n","33","","2'-amino-5'-bromoacetophenone","","- C8 H8 Br N O -","- C8 H8 Br N O -","- C32 H32 Br4 N4 O4 -","4","1","TK6021","Baker, L-J.; Copp, Brent R.; Rickard, Clifton E. F.","2'-Amino-5'-bromoacetophenone","Acta Crystallographica Section E","2001","57","6","o540","o541","10.1107/S160053680100839X","","","0.71073","MoKα","","0.025","0.024","","","","0.061","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200352","29.037","0.013","9.072","0.006","12.628","0.006","90","","109.14","0.07","90","","3143","3","173","2","173","2","","","","","","","","5","C 1 2 1","C 2y","5","Cholesteryl Trichloroacetimidate","","","- C31.5 H51 Cl3 N O1.5 -","- C31.5 H51 Cl3 N O1.5 -","- C126 H204 Cl12 N4 O6 -","4","1","TK6022","Simon Fielder; Daryl D. Rowan; Michael S. Sherburn; Anthony K. Burrell","1-(Cholest-4-en-3β-yl)-2,2,2-trichloroethanimidate <i>tert</i>-butyl methyl ether hemisolvate","Acta Crystallographica Section E","2001","57","6","o533","o534","10.1107/S160053680100825X","","","0.71073","MoKα","","0.086","0.078","","","","0.221","","","","","","1.03","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200353","13.573","0.001","13.8717","0.0009","12.688","0.001","90","","90","","90","","2388.9","0.3","293","2","293","2","","","","","","","","4","I b a m","-I 2 2c","72","Triisopropylphosphine sulfide","Triisopropylphosphine sulfide","","- C9 H21 P S -","- C9 H21 P S -","- C72 H168 P8 S8 -","8","0.5","WN6010","Staples, Richard J.; Segal, Brent M.","Triisopropylphosphine sulfide","Acta Crystallographica Section E","2001","57","5","o432","o433","10.1107/S1600536801004767","","","0.71073","MoKα","","0.1434","0.0694","","","","0.2179","","","","","","1.143","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200354","10.1504","0.0001","11.9299","0.0003","12.6337","0.0001","111.073","0.001","90.906","0.002","111.218","0.002","1311.91","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","[Cu(OH)~4~(C~12~H~8~N~2)~4~(H~2~O)~4~(NO~3~)~4~]","Diaquadi-μ~3~-hydroxo-di-μ~2~-hydroxo-tetraphenanthrolinetetracopper(II) tetranitrate dihydrate","","- C48 H36 Cu4 N12 O20 -","- C48 H36 Cu4 N12 O20 -","- C48 H36 Cu4 N12 O20 -","1","0.5","WN6011","Chuanpeng Cui; Jingcao Dai; Limin Wu; Wenxin Du; Xintao Wu","A tetranuclear copper complex, [Cu~4~(μ~3~-OH)~2~(μ~2~-OH)~2~(phen)~4~(H~2~O)~2~](NO~3~)~4~·2H~2~O","Acta Crystallographica Section E","2001","57","5","m198","m200","10.1107/S1600536801006018","","","0.71073","MoKα","","0.1261","0.0688","","","","0.1296","","","","","","1.392","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200355","7.467","0.001","16.002","0.002","8.256","0.001","90","","98.96","0.01","90","","974.4","0.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis(2-methoxyphenyl)-3,6-dioxaoctanediamide","","- C20 H24 N2 O6 -","- C20 H24 N2 O6 -","- C40 H48 N4 O12 -","2","0.5","WN6012","Wei-Hua Jiang; Wei-Sheng Liu; Kai-Bei Yu","<i>N</i>,<i>N</i>'-Bis(2-methoxyphenyl)-3,6-dioxaoctanediamide","Acta Crystallographica Section E","2001","57","5","o402","o403","10.1107/S1600536801005499","","","0.71073","MoKα","","0.0631","0.0371","","","","0.0976","","","","","","0.94","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200356","16.788","0.013","6.791","0.007","15.814","0.013","90","","119.89","0.06","90","","1563","3","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Dichlorobis(eta(5)-1,2,4-trimethylcyclopentadienyl)titanium(IV)","","- C16 H22 Cl2 Ti -","- C16 H22 Cl2 Ti -","- C64 H88 Cl8 Ti4 -","4","0.5","WN6013","Howie, R. Alan; McQuillan, Geoffrey P.; Thompson, David W.","Dichlorobis(η^5^-1,2,4-trimethylcyclopentadienyl)titanium(IV)","Acta Crystallographica Section E","2001","57","5","m181","m182","10.1107/S1600536801005372","","","0.71073","MoKα","","0.0392","0.0381","","","","0.0998","","","","","","1.172","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200357","9.91","0.001","11.653","0.002","9","0.002","100.93","0.01","95.31","0.01","89.24","0.01","1016.1","0.3","293","","293","","","","","","","","","4","P -1","-P 1","2","","","","- C10 H11 N3 O2 -","- C10 H11 N3 O2 -","- C40 H44 N12 O8 -","4","2","WN6014","Prager, Rolf H.; Smith, Jason A.; Tiekink, Edward R. T.","Ethyl 3-methylimidazo[1,2-<i>a</i>]pyrimidine-2-carboxylate","Acta Crystallographica Section E","2001","57","5","o451","o453","10.1107/S1600536801006316","","","0.71073","MoKα","","0.147","0.058","","","","0.171","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200358","8.957","0.0009","27.968","0.003","7.137","0.001","90","","104.82","0.009","90","","1728.4","0.4","291","1","291","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","5-morpholinemethyl-3-(4-fluoridebenzylideamin)-2-oxazolidinone chloride monohydrate","4-[3-(4-fluorobenzylidenamino)-2-oxooxazolidin-5-ylmethyl]morpholin-4-ium chloride monohydrate","","- C15 H21 Cl F N3 O4 -","- C15 H21 Cl F N3 O4 -","- C60 H84 Cl4 F4 N12 O16 -","4","1","WN6015","Kruszynski, Rafal; Bartczak, Tadeusz J.; Chilmonczyk, Zdzislaw; Cybulski, Jacek","4-[3-(4-Fluorobenzylideneamino)-2-oxo-1,3-oxazolidin-5-ylmethyl]morpholin-4-ium chloride monohydrate","Acta Crystallographica Section E","2001","57","5","o469","o471","10.1107/S1600536801006742","","","1.54056","CuKα","","0.0835","0.0629","","","","0.2012","","","","","","1.124","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200359","19.0388","0.0006","9.6511","0.0003","20.9817","0.0006","90","","155.492","0.001","90","","1599.25","0.1","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl (2-benzylidene-3-oxo-1,4-benzothiazin-4-yl)acetate","","- C18 H15 N O3 S -","- C18 H15 N O3 S -","- C72 H60 N4 O12 S4 -","4","1","WN6016","Zerzouf, A.; Salem, M.; Essassi, E. M.; Pierrot, M.","Methyl (2-benzylidene-3-oxo-1,4-benzothiazin-4-yl)acetate","Acta Crystallographica Section E","2001","57","6","o498","o499","10.1107/S1600536801007139","","","0.71073","MoKα","","0.048","0.039","","0.052","","0.05","","","1.398","","","1.289","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200360","10.0535","0.0002","10.9029","0.0003","15.4808","0.0005","90","0.01","90","0.01","90","0.01","1696.89","0.08","298","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","3-Methyl-4-(7-methylthiazolo[3,2-a]pyrimidin-5-yl)-2-phenyl-1H-pyrazol-5-one dihydrate","","- C17 H18 N4 O3 S -","- C17 H18 N4 O3 S -","- C68 H72 N16 O12 S4 -","4","1","WN6017","Djerrari, B.; Essassi, E. M.; Fifani, J.; Pierrot, M.","3-Methyl-4-(7-methylthiazolo[3,2-<i>a</i>]pyrimidin-5-yl)-2-phenyl-1<i>H</i>-pyrazol-5-one dihydrate","Acta Crystallographica Section E","2001","57","6","o500","o501","10.1107/S1600536801007140","","","0.71073","MoKα","","0.056","0.048","","0.074","","0.068","","","1.857","","","1.8","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200361","6.6528","0.0002","5.7251","0.0002","20.9637","0.0008","90","","90.205","0.002","90","","798.46","0.05","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(quinoxaline-2,3-dithiolato-S,S')nickel(II)","","- C16 H8 N4 Ni S4 -","- C16 H8 N4 Ni S4 -","- C32 H16 N8 Ni2 S8 -","2","0.5","WN6018","Zhao, Yingjun; Su, Weiping; Cao, Rong; Hong, Maochun","Bis(quinoxaline-2,3-dithiolato-<i>S</i>,<i>S</i>')nickel(II)","Acta Crystallographica Section E","2001","57","6","m229","m230","10.1107/S1600536801007152","","","0.71073","MoKα","","0.0855","0.0591","","","","0.1633","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200362","19.516","0.008","6.039","0.002","14.94","0.007","90","","112.17","0.03","90","","1630.6","1.2","223","","223","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H21 N O5 S2 -","- C14 H21 N O5 S2 -","- C56 H84 N4 O20 S8 -","4","1","YA6017","Creaser, Steffen P.; Pyke, Simon M.; Tiekink, Edward R. T.","<i>N</i>-(4,4-Dimethoxy-1-oxo-1λ^6^-thianylidene)-4-methyl-1-benzenesulfonamide","Acta Crystallographica Section E","2001","57","5","o394","o395","10.1107/S1600536801005347","","","0.71073","MoKα","","0.088","0.047","","","","0.136","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200363","8.555","0.004","8.814","0.004","14.849","0.002","90","","101.7","0.02","90","","1096.4","0.7","173","","173","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C12 H12 O4 -","- C12 H12 O4 -","- C48 H48 O16 -","4","1","YA6018","Avery, Thomas D.; Taylor, Dennis K.; Tiekink, Edward R. T.","<i>trans</i>-(±)-2-Carboxymethyl-3-phenylcyclopropane-1-carboxylic acid","Acta Crystallographica Section E","2001","57","5","o419","o420","10.1107/S1600536801005736","","","0.71073","MoKα","","0.061","0.037","","","","0.114","","","","","","0.9","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200364","9.273","0.002","4.877","0.002","31.976","0.005","90","","92.76","0.02","90","","1444.4","0.7","173","","173","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C17 H18 O3 -","- C17 H18 O3 -","- C68 H72 O12 -","4","1","YA6019","Jevric, Martyn; Taylor, Dennis K.; Tiekink, Edward R. T.","Ethyl (<i>E</i>)-4-(2-hydroxy-1-naphthyl)-2-methyl-2-butenoate","Acta Crystallographica Section E","2001","57","5","o426","o427","10.1107/S160053680100602X","","","0.71073","MoKα","","0.067","0.037","","","","0.135","","","","","","0.82","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200365","4.869","0.005","8.052","0.005","9.153","0.005","109.26","0.005","99.862","0.005","96.108","0.005","328.6","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","Tartaric acid monohydrate","2,3-Dihydroxysuccinic acid monohydrate","","- C4 H8 O7 -","- C4 H8 O7 -","- C8 H16 O14 -","2","1","YA6020","Nie, Jing-Jing; Xu, Duan-Jun; Wu, Jing-Yun; Chiang, Michael Y.","Redetermination of racemic tartaric acid monohydrate","Acta Crystallographica Section E","2001","57","5","o428","o429","10.1107/S1600536801006158","","","0.71069","MoKα","","0.043","0.04","","0.119","","0.114","","","1.07","","","1.09","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200366","7.5755","0.0004","21.657","0.0012","11.0354","0.0006","90","","103.3","0.001","90","","1761.94","0.17","298","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","cis-[rac-1,3-Bis(phenylsulfinyl)propane]dichloroplatinum(II)","","- C15 H16 Cl2 O2 Pt S2 -","- C15 H16 Cl2 O2 Pt S2 -","- C60 H64 Cl8 O8 Pt4 S8 -","4","1","YA6021","Wei Chen; Miao Du; Ruo-Hua Zhang; Xian-He Bu","<i>cis</i>-[<i>rac</i>-1,3-Bis(phenylsulfinyl)propane-<i>S</i>,<i>S</i>']dichloroplatinum(II)","Acta Crystallographica Section E","2001","57","5","m209","m210","10.1107/S1600536801006754","","","0.71073","MoKα","","0.049","0.047","","","","0.114","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200367","16.576","0.003","10.877","0.006","14.314","0.002","90","","90.25","0.01","90","","2580.7","1.5","173","","173","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H40 Cl2 N6 O12 -","- C16 H40 Cl2 N6 O12 -","- C64 H160 Cl8 N24 O48 -","4","0.5","YA6022","Choi, Ki-Young; Lee, Han-Hyoung; Smyth, Douglas R.; Suh, Il-Hwan; Tiekink, Edward R. T.","4,11-Bis(acetamido)-7,14-dimethyl-4,11-diaza-1,8-diazoniacyclotetradecane diperchlorate dihydrate","Acta Crystallographica Section E","2001","57","5","o480","o482","10.1107/S1600536801007073","","","0.71069","MoKα","","0.13","0.043","","","","0.13","","","","","","0.98","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2200368","11.839","0.002","8.0773","0.001","22.695","0.004","90","","91.84","0.03","90","","2169.1","0.6","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(1S*,4S*,5R*,8R*)-8-(3,4-Dimethoxyphenyl)-4-(3,4,5-trimethoxyphenyl)-3,7- dioxabicyclo[3.3.0]octan-2-one","","- C23 H26 O8 -","- C23 H26 O8 -","- C92 H104 O32 -","4","1","YA6023","Light, Mark E.; Hursthouse, Michael B.","(1<i>S</i>*,4<i>S</i>*,5<i>R</i>*,8<i>R</i>*)-8-(3,4-Dimethoxyphenyl)-4-(3,4,5-trimethoxyphenyl)-3,7-dioxabicyclo[3.3.0]octan-2-one","Acta Crystallographica Section E","2001","57","6","o514","o515","10.1107/S1600536801007425","","","0.71073","MoKα","","0.272","0.086","","","","0.334","","","","","","0.81","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200369","18.795","0.002","13.32","0.001","19.579","0.002","90","","114.42","0.01","90","","4463.1","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","tetraphenylphosphonium μ-bromo-bromoheptacarbonyl-μ-dicyclohexylphosphido-dirhenate","","- C43 H42 Br2 O7 P2 Re2 -","- C43 H42 Br2 O7 P2 Re2 -","- C172 H168 Br8 O28 P8 Re8 -","4","1","YA6024","Petters, Dina; Flörke, Ulrich","The first example of a bromo- and phosphido-bridged binuclear rhenium carbonyl complex","Acta Crystallographica Section E","2001","57","6","m244","m245","10.1107/S1600536801007620","","","0.71073","MoKα","","0.07","0.037","","0.085","","0.076","","","0.96","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200370","7.974","0.003","17.685","0.004","9.007","0.006","90","","98.74","0.04","90","","1255.4","1","173","","173","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H46 N6 -","- C24 H46 N6 -","- C48 H92 N12 -","2","0.5","YA6025","Roy, Tapashi G.; Hazari, Saroj K. S.; Dey, Benu K.; Miah, H. A.; Tiekink, Edward R. T.","<i>trans</i>-(3<i>S</i>,5<i>S</i>,10<i>R</i>,12<i>R</i>)-1,8-Bis(2-cyanoethyl)-<i>C</i>-<i>meso</i>-3,5,7,7,10,12,14,14-octamethyl-1,4,8,11-tetraazacyclotetradecane","Acta Crystallographica Section E","2001","57","6","o524","o525","10.1107/S160053680100784X","","","0.71069","MoKα","","0.078","0.045","","","","0.143","","","","","","1.04","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2200371","10.3759","0.0003","9.7074","0.0003","10.84","0.0003","90","","92.432","0.001","90","","1090.85","0.06","100","2","100","2","","","","","","","","5","I 1 2 1","I 2y","5","","Tetramethylammonium dichlorotriphenylplumbate","","- C22 H27 Cl2 N Pb -","- C22 H27 Cl2 N Pb -","- C44 H54 Cl4 N2 Pb2 -","2","0.5","YA6026","Howie, R. Alan; .; Wardell, James L.","Tetramethylammonium dichlorotriphenylplumbate","Acta Crystallographica Section E","2001","57","6","m256","m258","10.1107/S1600536801008273","","","0.71073","MoKα","","0.032","0.031","","","","0.079","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200372","15.4413","0.0003","10.9988","0.0003","9.5699","0.0002","90","","90","","90","","1625.31","0.06","291","1","291","1","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C19 H18 N2 O -","- C19 H18 N2 O -","- C76 H72 N8 O4 -","4","1","YA6027","Kolev, Tsonko; Glavcheva, Zornitza; Yancheva, Denitsa; Schürmann, Markus; Kleb, Dirk-Christian; Preut, Hans; Bleckmann, Paul","2-{3-[2-(4-Hydroxyphenyl)vinyl]-5,5-dimethylcyclohex-2-en-1-ylidene}malononitrile","Acta Crystallographica Section E","2001","57","6","o561","o562","10.1107/S1600536801008480","","","0.71073","MoKα","","0.077","0.039","","","","0.095","","","","","","0.99","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200373","8.0692","0.0005","9.5398","0.0006","7.7245","0.0004","90","","111.6","0.001","90","","552.86","0.06","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tin(II) oxalate potassium fluoride","","- C2 F K O4 Sn -","- C2 F K O4 Sn -","- C8 F4 K4 O16 Sn4 -","4","1","BR6015","Salami, Tolulope O.; Zavalij, Peter Y.; Oliver, Scott R. J.","BING-2: a layered tin‒oxalate potassium fluoride, KSn(C~2~O~4~)F","Acta Crystallographica Section E","2001","57","7","i49","i51","10.1107/S1600536801008959","","","0.71073","MoKα","","0.0331","0.0254","","","","0.0592","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200374","15.1416","0.0018","11.1843","0.0012","4.90256","","90","","108.117","0.005","90","","789.06","0.16","293","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Al10 O20 Si Sr3 -","- Al10 O20 Si Sr3 -","- Al20 O40 Si2 Sr6 -","2","0.25","","Kubota, Shunichi; Hisanori, Yamane; Masahiko, Shimada","A powder diffraction study of Sr~3~Al~10~SiO~20~","Acta Crystallographica, Section E","2001","57","","i60","i61","10.1107/S1600536801007346","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2200375","5.947","0.001","21.574","0.002","7.526","0.001","90","","103.82","0.01","90","","937.6","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Sodium thiosulfate pentahydrate","Sodium thiosulfate pentahydrate","","- H10 Na2 O8 S2 -","- H10 Na2 O8 S2 -","- H40 Na8 O32 S8 -","4","1","BR6018","Prasad, Satya Murti; Rani, Asha","Rerefinement of sodium thiosulfate pentahydrate","Acta Crystallographica Section E","2001","57","8","i67","i69","10.1107/S1600536801011175","","","0.71073","MoKα","","0.0223","0.0218","","0.0605","","0.0604","","","1.072","","","1.086","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200376","6.719","0.001","18.024","0.001","10.826","0.002","90","","90","","90","","1311.1","0.3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Potassium Silver Thiocyanate","","","- C2 Ag K N2 S2 -","- C2 Ag K N2 S2 -","- C16 Ag8 K8 N16 S16 -","8","1","BR6023","Valkonen, Jussi; Günes, Minna","Potassium silver thiocyanate","Acta Crystallographica Section E","2001","57","7","i52","i54","10.1107/S1600536801009679","","","0.71073","MoKα","","0.0924","0.0362","","","","0.0953","","","","","","1.002","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200377","6.524","0.001","6.591","0.001","8.205","0.002","90","","108.29","0.03","90","","334.99","0.12","100","2","100","2","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","Europiumtetrathiosilicate(IV)","","- Eu2 S4 Si -","- Eu2 S4 Si -","- Eu4 S8 Si2 -","2","0.5","BR6024","Johrendt, Dirk; Pocha, Regina","Europium thiosilicate at 100K","Acta Crystallographica Section E","2001","57","7","i57","i59","10.1107/S1600536801010376","","","0.71073","MoKα","","0.0529","0.0445","","","","0.0715","","","","","","1.131","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200378","3.7527","0.0005","5.7581","0.0009","11.313","0.002","90","","90","","90","","244.46","0.07","293","","","","","","","","","","","5","I m m m","-I 2 2","71","","","","- Ba Ca0.1 Ni O5 Y1.9 -","- Ba Ca0.098 Ni O5 Y1.902 -","- Ba2 Ca0.196 Ni2 O10 Y3.804 -","2","0.125","BR6025","Lannuzel, François-Xavier; Boucher, Florent; Boucher, Christophe","Charge-doped nickel oxide, Y~1.90~Ca~0.10~BaNiO~5~","Acta Crystallographica, Section E: Structure Reports Online","2001","57","8","i70","i71","10.1107/S1600536801011667","","","0.71069","MoKα","","0.0183","0.0156","","","","0.0419","","","","","","1","","","","has coordinates","210922","2020-10-21","18:00:00",""
"2200379","15.878","0.001","15.878","0.001","15.878","0.001","90","","90","","90","","4003","0.4","293","2","150","2","","","","","","","","3","F -4 3 m","F -4 2 3","216","","barium palladium oxide","","- Ba2.125 O0.422 Pd -","- Ba2.125 O0.42 Pd -","- Ba68 O13.44 Pd32 -","32","0.333333","BR6026","Mårtensson, Malin; Wikstad, Emma; Blomqvist, Helen; Kritikos, Mikael; Eriksson, Lars","Ba~68~Pd~32~O~<i>x~</i>, with <i>x</i> ≃13.5","Acta Crystallographica Section E","2001","57","8","i64","i66","10.1107/S1600536801010935","","","0.71073","MoKα","","0.0497","0.0288","","","","0.0415","","","","","","1.161","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200380","7.9362","0.0003","8.522","0.0003","9.1762","0.0004","90","","90","","90","","620.61","0.04","120","","120","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- B H4 Li O4 -","- B H4 Li O4 -","- B8 H32 Li8 O32 -","8","1","","Fronczek, Frank R.; Aubry, David A.; Stanley, George G.","Refinement of lithium tetrahydroxoborate with low-temperature CCD data","Acta Crystallographica, Section E","2001","57","","i62","i63","10.1107/S1600536801011163","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2200381","8.818","0.001","8.818","0.001","8.818","0.001","90","","90","","90","","685.66","0.13","293","2","293","2","","","","","","","","3","P m -3 m","-P 4 2 3","221","","","","- Ce2 Rh15 Si7 -","- Ce2 Rh15 Si7 -","- Ce4 Rh30 Si14 -","2","0.0416667","BT6041","Tursina, Anna I.; Gribanov, Alexandr V.; Seropegin, Yuri D.","The new ternary compound Ce~2~Rh~15~Si~7~","Acta Crystallographica Section E","2001","57","7","i55","i56","10.1107/S1600536801008431","","","0.71073","MoKα","","0.0763","0.0473","","","","0.1482","","","","","","0.856","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200382","7.4943","0.0009","14.566","0.0017","10.8812","0.0013","90","","105.655","0.002","90","","1143.8","0.2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","μ-oxalato-bis[(isocyanato-N)(tetramethylethylenediamine)copper(II)]","","- C16 H32 Cu2 N6 O6 -","- C16 H32 Cu2 N6 O6 -","- C32 H64 Cu4 N12 O12 -","2","0.5","BT6045","Jack Cheng; Fen-Ling Liao; Tian-Huey Lu; Partha S. Mukherjee; Tapas K.Maji; N. Ray Chaudhuri","An oxalato-bridged copper(II) complex","Acta Crystallographica Section E","2001","57","7","m263","m264","10.1107/S1600536801007814","","","0.71073","MoKα","","0.0487","0.0394","","","","0.0897","","","","","","1.16","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200383","9.669","0.005","17.063","0.009","17.875","0.01","90","","90","","90","","2949","3","298","2","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Ethyl 1-phenyl-3-sulfanyl-5-(4H-1,2,4-triazol-4-yl)pyrazole-4-carboxylate","","- C15 H15 N5 O2 S -","- C15 H15 N5 O2 S -","- C120 H120 N40 O16 S8 -","8","1","BT6051","Wei-Qiang Chen; Miao Du; Lin-Hong Weng; Gui-Yu Jin","Ethyl 1-phenyl-3-sulfanyl-5-(4<i>H</i>-1,2,4-triazol-4-yl)pyrazole-4-carboxylate","Acta Crystallographica Section E","2001","57","7","o619","o621","10.1107/S1600536801010091","","","0.71073","MoKα","","0.0611","0.038","","","","0.1106","","","","","","1.007","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200384","12.675","0.002","18.259","0.003","22.864","0.004","89.15","0.02","87.73","0.02","77.31","0.02","5158.1","1.5","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","cis-Dicarbonylbis[1,2-ethanediylbis(diphenylphosphine)-P,P']tungsten(0) benzene sesquisolvate","","- C63 H57 O2 P4 W -","- C63 H57 O2 P4 W -","- C252 H228 O8 P16 W4 -","4","2","BT6052","Filippou, Alexander, C.; Philippopoulos, Athanassios, I.; Ziemer, Burkhard","<i>cis</i>-Dicarbonylbis[1,2-ethanediylbis(diphenylphosphine)-<i>P,P</i>']tungsten(0) benzene sesquisolvate","Acta Crystallographica Section E","2001","57","8","m338","m340","10.1107/S1600536801010893","","","0.71073","MoKα","","0.0295","0.0221","","","","0.0534","","","","","","0.938","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200385","8.626","0.002","9.924","0.003","5.179","0.001","90","","103.719","0.009","90","","430.7","0.18","293","2","21","2","","","","","","","","4","P 1 21 1","P 2yb","4","cyclo(analine-4-hydroxyproline)","2-hydroxy-6-methyl-1,2,3,5,6,7,8,8a-octahydro-7-azaindolizine-5,8-dione","","- C8 H12 N2 O3 -","- C8 H12 N2 O3 -","- C16 H24 N4 O6 -","2","1","BT6054","Pavkovic, Stephen F.; Zerkowski, Jonathan A.; Zeng, Qi","Cyclo(alanine-4-hydroxyproline)","Acta Crystallographica Section E","2001","57","8","o798","o799","10.1107/S1600536801012636","","","0.7107","MoKα","","0.0562","0.04","","","","0.096","","","","","","0.989","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200386","7.9814","0.001","8.2719","0.001","12.168","0.003","91.779","0.018","106.668","0.014","111.018","0.01","710.3","0.2","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H18 N4 O2 -","- C14 H18 N4 O2 -","- C28 H36 N8 O4 -","2","1","BT6055","Hökelek, Tuncer; Batı, Hümeyra; Bekdemir, Yunus; Kütük, Halil","2,3-Dimethylquinoxaline‒dimethylglyoxime (1/1)","Acta Crystallographica Section E","2001","57","8","o663","o665","10.1107/S1600536801010765","","","0.71073","MoKα","","0.0627","0.0458","","","","0.1332","","","","","","1.084","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200387","13.2","0.002","13.2","0.002","18.874","0.005","90","","90","","120","","2848","1","210","2","210","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C18 H24.15 N4 O6.075 -","- C18 H24.15 N4 O6.075 -","- C108 H144.9 N24 O36.45 -","6","0.333333","BT6057","Blake, Alexander J.; Doble, Dan M. J.; Li, Wan-Sheung; Schröder, Martin","Tris(2-succinimidoethyl)amine hydrate (1/0.075)","Acta Crystallographica Section E","2001","57","8","o690","o691","10.1107/S1600536801011047","","","0.71073","MoKα","","0.125","0.071","","","","0.144","","","","","","1.28","","","","has coordinates,has Fobs","194389","2020-10-21","18:00:00",""
"2200388","19.846","0.004","10.653","0.002","10.469","0.002","90","","90","","90","","2213.4","0.7","100","2","","","","","","","","","","5","P m n 21","P 2ac -2","31","","","","- C45 H64 Cl2 F N5 -","- C45 H64 Cl2 F N5 -","- C90 H128 Cl4 F2 N10 -","2","0.5","BT6058","Camiolo, Salvatore; Coles, Simon J.; Gale, Philip A.; Hursthouse, Michael B.; Sessler, Jonathan L.","Tetrabutylammonium <i>meso</i>-octamethylcalix[4]pyrrole fluoride dichloromethane solvate","Acta Crystallographica Section E","2001","57","9","o816","o818","10.1107/S1600536801012880","","","0.71073","MoKα","","","0.0744","","","","0.2158","","","","","","1.091","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200389","21.7299","0.0004","21.3998","0.0004","17.088","0.0004","90","","91.318","0.003","90","","7944.1","0.3","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetrabutylammonium sulfate","","- C16 H37 N O4 S -","- C16 H37 N O4 S -","- C256 H592 N16 O64 S16 -","16","4","BT6059","Light, Mark E.; Gale, Philip A.; Hursthouse, Michael B.","Anion‒anion dimerization in tetrabutylammonium hydrogensulfate","Acta Crystallographica Section E","2001","57","8","o705","o706","10.1107/S1600536801011321","","","0.71073","MoKα","","0.1357","0.0735","","","","0.2372","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200390","16.1733","0.0003","17.8443","0.0003","26.7","0.0005","77.52","0.003","77.237","0.003","83.124","0.003","7316.7","0.3","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","Tetrabutylammonium dihydrogenphosphate dichloromethane solvate","","- C17.33 H40.67 Cl2.67 N O4 P -","- C17.3333 H40.6667 Cl2.66667 N O4 P -","- C208 H488 Cl32 N12 O48 P12 -","12","6","BT6060","Light, Mark E.; Camiolo, Salvatore; Gale, Philip A.; Hursthouse, Michael B.","Anion‒anion one-dimensional chain formation within cationic channels in tetrabutylammonium dihydrogenphosphate dichloromethane solvate","Acta Crystallographica Section E","2001","57","8","o727","o729","10.1107/S1600536801011746","","","0.71073","MoKα","","0.2697","0.156","","","","0.3933","","","","","","1.93","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200391","10.281","0.003","10.281","0.003","14.788","0.006","90","","90","","120","","1353.7","0.8","293","2","293","2","","","","","","","","5","P 3","P 3","143","Bis(DL-Methioninium)sulfate","Bis(DL-Methioninium)sulfate","","- C10 H24 N2 O8 S3 -","- C10 H24 N2 O8 S3 -","- C30 H72 N6 O24 S9 -","3","1","BT6061","N. Srinivasan; B. Sridhar; R. K. Rajaram","Bis(<small>DL</small>-methioninium) sulfate","Acta Crystallographica Section E","2001","57","8","o746","o748","10.1107/S1600536801012016","","","1.5418","CuKα","","0.054","0.0507","","","","0.1473","","","","","","1.09","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200392","7.4962","0.0007","9.5511","0.0009","11.4013","0.0011","79.039","0.002","76.866","0.002","76.886","0.002","765.9","0.13","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-[(2-Chlorophenyl)iminomethyl]-4,6-dimethylquinoline","","- C18 H15 Cl N2 -","- C18 H15 Cl N2 -","- C36 H30 Cl2 N4 -","2","1","BT6063","Sema Öztürk; Mehmet Akkurt; Feray Aydog̃an","2-[(2-Chlorophenyl)iminomethyl]-4,6-dimethylquinoline","Acta Crystallographica Section E","2001","57","8","o730","o732","10.1107/S1600536801011771","","","0.71073","MoKα","","0.1607","0.0705","","","","0.2171","","","","","","0.976","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200393","8.816","0.003","14.965","0.004","15.936","0.005","90","","104.122","0.006","90","","2038.9","1.1","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Di-2-naphthylpyridine-2,6-dicarboxamide","","- C27 H19 N3 O2 -","- C27 H19 N3 O2 -","- C108 H76 N12 O8 -","4","1","BT6064","Qi, Jianying; Zhou, Zhongyuan; Chan, Albert S. C.","<i>N,N</i>'-Di-2-naphthylpyridine-2,6-dicarboxamide","Acta Crystallographica Section E","2001","57","8","o749","o750","10.1107/S1600536801012028","","","0.71073","MoKα","","0.1714","0.0436","","","","0.1053","","","","","","0.753","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200394","9.078","0.002","5.928","0.002","10.7711","0.0018","90","","98.998","0.017","90","","572.5","0.3","298","","298","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C10 H8 Cl N3 O4 -","- C10 H8 Cl N3 O4 -","- C20 H16 Cl2 N6 O8 -","2","1","BT6065","Ishida, Hiroyuki; Rahman, Bilkish; Kashino, Setsuo","Imidazolium 2-chloro-4-nitrobenzoate","Acta Crystallographica Section E","2001","57","8","o744","o745","10.1107/S1600536801011977","","","0.71073","MoKα","","0.05","0.032","","","","0.076","","","","","","1.04","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200395","17.689","0.004","5.661","0.0011","17.328","0.004","90","","112.3","0.03","90","","1605.4","0.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Glycinium maleate","","- C6 H9 N O6 -","- C6 H9 N O6 -","- C48 H72 N8 O48 -","8","1","BT6066","Rajagopal, K.; Krishnakumar, R. V.; Mostad, A.; Natarajan, S.","Glycinium maleate","Acta Crystallographica Section E","2001","57","8","o751","o753","10.1107/S1600536801012168","","","0.71073","MoKα","","0.0309","0.0292","","","","0.0824","","","","","","1.11","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200396","17.191","0.003","7.308","0.001","17.843","0.005","90","","104.94","0.03","90","","2165.9","0.8","293","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[bis(2-pyridyl)amine-N,N'](nitrato-O,O')cobalt(II) nitrate","","- C20 H18 Co N8 O6 -","- C20 H18 Co N8 O6 -","- C80 H72 Co4 N32 O24 -","4","1","BT6068","Castillo, Oscar; Luque, Antonio; De la Pinta, Noelia; Román, Pascual","Bis[bis(2-pyridyl)amine-<i>N</i>,<i>N</i>'](nitrato-<i>O</i>,<i>O</i>')cobalt(II) nitrate","Acta Crystallographica Section E","2001","57","9","m384","m386","10.1107/S1600536801012909","","","0.71073","MoKα","","0.0651","0.034","","","","0.0785","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200397","15.1655","0.0006","15.1655","0.0006","11.0678","0.0007","90","","90","","120","","2204.48","0.19","100","2","100","2","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Tetraaquadihydroxohexarheniumoctaselenium dodecahydrate","","- H34 O18 Re6 Se8 -","- O18 Re6 Se8 -","- O54 Re18 Se24 -","3","0.0833333","BT6069","Zheng, Zhiping; Selby, Hugh D.; Roland, Bryan K.","The first `hexaaqua-' complex of the [Re~6~Se~8~]^2+^ cluster core, [Re~6~Se~8~(OH)~2~(H~2~O)~4~]·12H~2~O","Acta Crystallographica, Section E: Structure Reports Online","2001","57","9","i77","i79","10.1107/S1600536801013241","","","0.71073","MoKα","","0.049","0.0267","","","","0.0683","","","","","","1.141","","","","has coordinates,has Fobs","210921","2020-10-21","18:00:00",""
"2200398","7.6801","0.0019","13.235","0.003","8.078","0.0016","90","","107.69","0.016","90","","782.3","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","ammonium zinc phosphate","","","- H7 N O8 P2 Zn -","- H7 N O8 P2 Zn -","- H28 N4 O32 P8 Zn4 -","4","1","BT6071","Harrison, William T. A.","Ammonium zinc phosphate, (NH~4~)Zn(HPO~4~)(H~2~PO~4~)","Acta Crystallographica Section E","2001","57","9","i72","i74","10.1107/S1600536801013010","","","0.71073","MoKα","","0.042","0.0307","","","","0.0745","","","","","","1.069","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200399","9.2198","0.0019","10.3158","0.0014","10.7956","0.0011","112.511","0.009","96.598","0.01","93.007","0.01","937","0.3","146","2","146","2","","","","","","","","7","P -1","-P 1","2","","2,2'-bipyridyl-9-boroniumbicyclo[3.3.1]nonane trifluoromethanesulfonate","","- C19 H22 B F3 N2 O3 S -","- C19 H22 B F3 N2 O3 S -","- C38 H44 B2 F6 N4 O6 S2 -","2","1","BT6072","Ma, Kuangbiao; Bats, Jan W.; Wagner, Matthias","(2,2'-Bipyridyl-<i>N</i>,<i>N</i>')(bicyclo[3.3.1]nonane-<i>C</i>^1^,<i>C</i>^5^)boronium trifluoromethanesulfonate","Acta Crystallographica Section E","2001","57","9","o846","o848","10.1107/S1600536801013083","","","0.71073","MoKα","","0.0537","0.0379","","","","0.0975","","","","","","1.087","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200400","7.224","0.003","15.38","0.006","12.204","0.005","90","","103.48","0.04","90","","1318.6","1","160","2","160","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis[μ-1-(2,4,6-trimethylphenyl)ethanolato-O:O]bis(dimethylaluminium)","","- C26 H42 Al2 O2 -","- C26 H42 Al2 O2 -","- C52 H84 Al4 O4 -","2","0.5","BT6073","Clegg, William; Henderson, Kenneth W.; Rakov, Igor M.","Bis[μ-1-(2,4,6-trimethylphenyl)ethanolato-<i>O</i>:<i>O</i>]bis(dimethylaluminium)","Acta Crystallographica Section E","2001","57","9","m387","m389","10.1107/S1600536801013095","","","1.54184","CuKα","","0.0832","0.0765","","","","0.2165","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200401","4.2374","0.0003","4.2374","0.0003","8.8","0.002","90","","90","","90","","158","0.04","293","2","293","2","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","","","- F I Pb -","- F I Pb -","- F2 I2 Pb2 -","2","0.125","","Weil, Matthias; Kubel, Frank","Matlockite-type PbFI","Acta Crystallographica, Section E","2001","57","","i80","i81","10.1107/S1600536801013678","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2200402","4.933","0.0003","8.9074","0.0005","14.8407","0.0008","90","","94.751","0.001","90","","649.86","0.06","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Hexamethylenediammonium hydrogenphosphite","","- C6 H22 N2 O6 P2 -","- C6 H22 N2 O6 P2 -","- C12 H44 N4 O12 P4 -","2","0.5","BT6077","Mahmoudkhani, Amir H.; Langer, Vratislav","Pillared layered hydrogen-bonded network in hexamethylenediammonium hydrogenphosphite","Acta Crystallographica Section E","2001","57","9","o866","o868","10.1107/S1600536801013587","","","0.71073","MoKα","","0.0576","0.0426","","","","0.1173","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200403","6.9944","0.001","5.8925","0.0008","8.2495","0.0011","90","","90","","90","","340","0.08","299","2","299","2","","","","","","","","4","P n m a","-P 2ac 2n","62","lead gallium borate","","","- B Ga O4 Pb -","- B Ga O4 Pb -","- B4 Ga4 O16 Pb4 -","4","0.5","","Park, Hyunsoo; Jacques Barbier","PbGaBO~4~, an orthoborate with a new structure-type","Acta Crystallographica, Section E","2001","57","","i82","i84","10.1107/S1600536801013940","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2200404","8.52","0.001","15.97","0.002","9.67","0.001","90","","110.77","0.01","90","","1230.2","0.3","130","2","130","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4,4'-Bipyridine-2,2'-dicarboxylic acid dihydrate","","- C12 H12 N2 O6 -","- C12 H12 N2 O6 -","- C48 H48 N8 O24 -","4","1","BT6080","Bond, Andrew D.; Feeder, Neil; Redman, James E.; Sanders, Jeremy K. M.","4,4'-Bipyridine-3,3'-dicarboxylic acid dihydrate","Acta Crystallographica Section E","2001","57","9","o869","o871","10.1107/S1600536801013939","","","0.71073","MoKα","","0.1032","0.0548","","","","0.1082","","","","","","0.941","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200405","8.5512","0.0001","11.8172","0.0001","15.0854","0.0002","90","","90","","90","","1524.4","0.03","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","Nitrato(1,4,7-trimethyl-1,4,7-triazacyclononane)copper(II) perchlorate","Nitrato(1,4,7-trimethyl-1,4,7-triazacyclononane)copper(II) perchlorate","","- C9 H21 Cl Cu N4 O7 -","- C9 H21 Cl Cu N4 O7 -","- C36 H84 Cl4 Cu4 N16 O28 -","4","1","CF6061","Batten, Stuart R.; Spiccia, Leone; Templar, Claire E.","Nitrato(1,4,7-trimethyl-1,4,7-triazacyclononane)copper(II) perchlorate","Acta Crystallographica Section E","2001","57","7","m265","m266","10.1107/S1600536801008972","","","0.71073","MoKα","","0.0414","0.0371","","","","0.0917","","","","","","1.035","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200406","10.394","0.002","10.493","0.003","20.265","0.004","76.03","0.02","79.83","0.02","72.21","0.02","2029.6","0.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N(2)-Acetyl-1,3-diphenyl-1,2,3,4-tetrahydrobenzo[b]-1,6-naphthyridine","","- C26 H22 N2 O -","- C26 H22 N2 O -","- C104 H88 N8 O4 -","4","2","CF6062","Laavanya, Parthasarathi; Panchanatheswaran, Krishnaswamy; Sivakumar, Balasubramanian; Jeyaraman, Ramasubbu; Krause Bauer, Jeanette A.","<i>N</i>(6)-Acetyl-5,7-diphenyl-5,6,7,8-tetrahydrobenzo[<i>b</i>]-1,6-naphthyridine","Acta Crystallographica Section E","2001","57","7","o599","o601","10.1107/S1600536801009151","","","0.71069","MoKα","","0.1422","0.0554","","","","0.1667","","","","","","0.987","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200407","12.551","0.002","12.551","0.002","40.418","0.005","90","","90","","90","","6367","1.6","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","[Bis(terpy)Cu(II)] 2ClO~4~ * H~2~O","Bis(2,2:6,2-terpyridine)copper(II) diperchlorate monohydrated","","- C30 H24 Cl2 Cu N6 O9 -","- C30 H24 Cl2 Cu N6 O9 -","- C240 H192 Cl16 Cu8 N48 O72 -","8","0.5","CF6064","Valdés-Martínez, Jesús; Toscano, Rubén A.; Salazar-Mendoza, Domingo","Bis(2,2':6',2''-terpyridine)copper(II) diperchlorate hemihydrate","Acta Crystallographica Section E","2001","57","8","m331","m332","10.1107/S160053680100900X","","","0.71073","MoKα","","0.1217","0.0629","","","","0.1905","","","","","","0.883","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200408","14.9803","0.0007","15.0682","0.0008","22.6217","0.0012","90","","90","","90","","5106.3","0.5","293","2","293","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","tetradimethylammonium hexahydroxytriacontaoxo- (tetraoxophosphato)dodecamolybdate dichloride","","- C8 H44 Cl2 Mo12 N4 O44 P -","- C8 H24 Cl2 Mo12 N4 O44 P -","- C32 H96 Cl8 Mo48 N16 O176 P4 -","4","0.5","CF6065","Wu, Chuan-De; Lu, Can-Zhong; Lin, Xiang; Yang, Wen-Bin; Zhuang, Hong-Hui; Huang, Jin-Shun","[(CH~3~)~2~NH~2~]~4~[H~4~PMo~12~O~40~]Cl~2~·4H~2~O","Acta Crystallographica Section E","2001","57","9","m390","m392","10.1107/S1600536801010467","","","0.71073","MoKα","","0.0449","0.0338","","","","0.0898","","","","","","1.103","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200409","9.891","0.002","15.443","0.001","20.664","0.002","90","","90","","90","","3156.4","0.7","296.2","","","","","","","","","","","6","P b c m","-P 2c 2b","57","","","","- C26 H24 Cd2 Cl2 N4 O9 -","- C26 H18 Cd2 Cl2 N4 O9 -","- C104 H72 Cd8 Cl8 N16 O36 -","4","0.5","CF6068","Odoko, Mamiko; Isomoto, Noriko; Okabe, Nobuo","Di-μ-chloro-bis[(2-pyridinecarboxylato-<i>N,O</i>)(2-pyridinecarboxylic acid-<i>N,O</i>)cadmium(II)] ethanol solvate","Acta Crystallographica Section E","2001","57","8","m371","m372","10.1107/S1600536801011904","","","0.7107","MoKα","","","0.0352","","","","0.1059","","","","","","1.579","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200410","9.029","0.0007","10.0804","0.0008","12.1751","0.001","72.031","0.002","81.913","0.002","89.545","0.002","1042.86","0.14","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","trans-2-(2-hydroxyphenyl)-cyclohexanol","","- C12 H16 O2 -","- C12 H16 O2 -","- C48 H64 O8 -","4","2","CF6070","Kandasamy Chinnakali; Thangavel Ravishankar; Kamaraj Sriraghavan; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Vayalakkavoor T.Ramakrishnan","<i>trans</i>-2-(2-Hydroxyphenyl)cyclohexanol","Acta Crystallographica Section E","2001","57","7","o659","o660","10.1107/S160053680101056X","","","0.71073","MoKα","","0.1289","0.0778","","","","0.2227","","","","","","0.961","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200411","8.978","0.001","11.073","0.002","7.2349","0.0007","106.25","0.01","107.399","0.009","78.47","0.01","653.6","0.16","296.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H32 N2 Ni O10 -","- C24 H32 N2 Ni O10 -","- C24 H32 N2 Ni O10 -","1","0.5","CF6071","Odoko, Mamiko; Muranishi, Yasunori; Okabe, Nobuo","<i>trans</i>-Diaquabis(quinoline-2-carboxylato-<i>N</i>,<i>O</i>)nickel(II)‒water‒ethanol (1/2/2)","Acta Crystallographica Section E","2001","57","7","m267","m269","10.1107/S1600536801009138","","","0.7107","MoKα","","","0.0333","","","","0.1183","","","","","","1.026","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200412","6.345","0.004","11.353","0.008","11.838","0.008","90","","95.684","0.016","90","","848.6","1","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(4-aminopyridinium) 2,5-dioxidobenzoquinone dihydrate","","- C16 H20 N4 O6 -","- C16 H20 N4 O6 -","- C32 H40 N8 O12 -","2","0.5","CF6075","Cowan, John A.; Howard, Judith A. K.; Leech, Michael A.; Williams, Ian D.","Bis(4-aminopyridinium) 2,5-dioxidobenzoquinone dihydrate","Acta Crystallographica Section E","2001","57","7","o563","o565","10.1107/S1600536801009011","","","0.71073","MoKα","","0.0919","0.068","","","","0.1482","","","","","","1.659","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200413","9.7545","0.0006","12.0427","0.0009","13.5242","0.0018","90","","90","","90","","1588.7","0.3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","3-amino-4H-pyrido[2,3-e]-1,2,4-thiadiazine 1,1-dioxide","","- C6 H6 N4 O2 S -","- C6 H6 N4 O2 S -","- C48 H48 N32 O16 S8 -","8","1","CF6076","Dupont, Léon; De Tullio, Pascal; Boverie, Stéphane; Pirotte, Bernard","3-Amino-4<i>H</i>-pyrido[2,3-<i>e</i>]-1,2,4-thiadiazine 1,1-dioxide","Acta Crystallographica Section E","2001","57","7","o602","o603","10.1107/S1600536801009904","","","1.5418","CuKα","","0.0459","0.0316","","","","0.0895","","","","","","0.956","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200414","26.655","0.005","18.004","0.003","12.623","0.002","90","","91.972","0.003","90","","6054.1","1.8","150","2","150","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","2-(2,6-Diisopropylphenylamino)-4-(2,6-diisopropylphenylimino)-2-pentene","","- C32.5 H46 N2 -","- C29 H42 N2 -","- C232 H336 N16 -","8","1","CF6079","Bailey, Philip J.; Liddle, Stephen T.; Parsons, Simon","2-(2,6-Diisopropylphenylamino)-4-(2,6-diisopropylphenylimino)-2-pentene toluene hemisolvate at 150K","Acta Crystallographica Section E","2001","57","7","o661","o662","10.1107/S1600536801009163","","","0.71073","MoKα","","0.0676","0.0596","","","","0.1408","","","","","","1.139","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200415","7.323","0.003","26.98","0.004","6.897","0.004","90","","90","","90","","1362.7","1","296","","296","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","2,5-Diphenyl-3,6-dihydroxy-1,4-benzoquinone","","- C18 H12 O4 -","- C18 H12 O4 -","- C72 H48 O16 -","4","0.5","CF6080","Cohen, Peter A.; Robinson, Paul D.","2,5-Diphenyl-3,6-dihydroxy-1,4-benzoquinone (polyporic acid)","Acta Crystallographica Section E","2001","57","7","o596","o598","10.1107/S160053680100914X","","","0.71069","MoKα","","0.068","0.035","","","","0.11","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200416","14.15","0.01","3.622","0.009","15.028","0.01","90","","97.52","0.07","90","","764","2","296.2","","","","","","","","","","","3","P 1 2/n 1","-P 2yac","13","","","","- C7 H8 O6 -","- C7 H8 O6 -","- C28 H32 O24 -","4","1","CF6081","Okabe, Nobuo; Kyoyama, Hasuyo; Suzuki, Misato","Gallic acid monohydrate","Acta Crystallographica Section E","2001","57","8","o764","o766","10.1107/S1600536801012041","","","0.7107","MoKα","","","0.0492","","","","0.1875","","","","","","0.907","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200417","5.7159","0.0008","15.8498","0.0014","8.4139","0.0007","90","","101.041","0.007","90","","748.16","0.14","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2,6-diamino-3,5-dinitro-1,4-pyrazine 1-oxide","2,6-diamino-3,5-dinitro-1,4-pyrazine-1-oxide","","- C4 H4 N6 O5 -","- C4 H4 N6 O5 -","- C16 H16 N24 O20 -","4","1","CF6082","Gilardi, Richard D.; Butcher, Ray J.","2,6-Diamino-3,5-dinitro-1,4-pyrazine 1-oxide","Acta Crystallographica Section E","2001","57","7","o657","o658","10.1107/S1600536801010352","","","0.71073","MoKα","","0.0694","0.0399","","","","0.0974","","","","","","1.011","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200418","7.0265","0.0004","18.9749","0.001","7.1157","0.0004","90","","90","","90","","948.72","0.09","100","1","100","1","","","","","","","","5","P c a 21","P 2c -2ac","29","","Potassium (E)-2-Phenyl-1-ethenyltrifluoroborate","","- C8 H7 B F3 K -","- C8 H7 B F3 K -","- C32 H28 B4 F12 K4 -","4","1","CF6083","Thadani, Avinash N.; Batey, Robert A.; Smil, David V.; Lough, Alan J.","Potassium trifluoro[(<i>E</i>)-2-phenyl-1-ethenyl]borate","Acta Crystallographica Section E","2001","57","8","m333","m334","10.1107/S1600536801010169","","","0.71073","MoKα","","0.0291","0.0259","","","","0.0667","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200419","8.0692","0.0006","18.5615","0.0013","12.1622","0.0009","90","","102.061","0.001","90","","1781.4","0.2","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Pinoresinol","","","- C20 H22 O6 -","- C20 H20.218 O6 -","- C80 H80.872 O24 -","4","1","CF6084","Stomberg, Rolf; Langer, Vratislav; Li, Shiming; Lundquist, Knut","The racemate of pinoresinol","Acta Crystallographica Section E","2001","57","8","o692","o694","10.1107/S1600536801011084","","","0.71073","MoKα","","0.0759","0.0461","","","","0.1461","","","","","","0.997","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200420","12.6506","0.0006","10.1894","0.0005","19.8565","0.0012","90","","107.16","0.005","90","","2445.6","0.2","293","","","","","","","","","","","4","P 1 c 1","P -2yc","7","","","","- C14 H13 N O3 -","- C14 H13 N O3 -","- C112 H104 N8 O24 -","8","4","","Héctor Novoa de Armas; Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J.; Xuárez Marill, Lisbet","2-(4-Methoxyphenyl)aminobenzoic acid","Acta Crystallographica, Section E","2001","57","","o638","o640","10.1107/S1600536801010364","","","","","","","","","","","","","","","","","","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200421","20.137","0.004","10.572","0.005","21.81","0.006","90","","103.71","0.01","90","","4511","3","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H24 Cl2 Fe N2 Pt -","- C23 H24 Cl2 Fe N2 Pt -","- C184 H192 Cl16 Fe8 N16 Pt8 -","8","2","CF6086","Blake, Alexander J.; Osborne, Anthony G.; Hollands, Ronald E.","<i>fac</i>-(2,2'-Bipyridine)(1,1'-dichloroferrocen-2-yl)trimethylplatinum(IV)","Acta Crystallographica Section E","2001","57","7","m318","m319","10.1107/S1600536801010170","","","0.71073","MoKα","","0.072","0.061","","","","0.168","","","","","","1.08","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200422","15.4741","0.0005","15.0135","0.0005","14.0407","0.0005","90","","115.018","0.001","90","","2955.89","0.17","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","bis(pyridine-N)mercury(II) dichromate(VI)","","- C10 H10 Cr2 Hg N2 O7 -","- C10 H10 Cr2 Hg N2 O7 -","- C80 H80 Cr16 Hg8 N16 O56 -","8","1","CF6087","Matthias Weil","[Hg(pyridine)~2~][Cr~2~O~7~], a compound used for a quick assay method to quantify soluble Hg^II^ ions","Acta Crystallographica Section E","2001","57","7","m322","m324","10.1107/S1600536801010455","","","0.71073","MoKα","","0.0241","0.0178","","","","0.0458","","","","","","1.208","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200423","9.931","0.0002","15.545","0.0004","17.923","0.0005","87.499","0.0014","87.935","0.0017","75.334","0.0016","2673.31","0.12","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","Tetra-n-butylammonium Ferrocenyltrifluoroborate","","- C26 H45 B F3 Fe N -","- C26 H45 B F3 Fe N -","- C104 H180 B4 F12 Fe4 N4 -","4","2","CF6088","Quach, Tan D.; Batey, Robert A.; Lough, Alan J.","Tetra-<i>n</i>-butylammonium ferrocenyltrifluoroborate","Acta Crystallographica Section E","2001","57","7","m320","m321","10.1107/S1600536801010261","","","0.7107","MoKα","","0.0877","0.048","","","","0.1226","","","","","","1.023","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200424","5.768","0.002","17.702","0.003","17.823","0.004","90","","90","","90","","1819.8","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3-(Diphenylphosphino)-N-phenylmethylene-1-propanamine","","- C22 H22 N P -","- C22 H22 N P -","- C88 H88 N4 P4 -","4","1","CF6089","Xie Tong; Li Yi-Zhi; Li Bang-Jing; Shi Ling; Wang Liu-Fang; Gao Shi-Yang; Liang Yong-Min","<i>N</i>-Benzylidene-3-(diphenylphosphino)-1-propanamine","Acta Crystallographica Section E","2001","57","9","o858","o859","10.1107/S160053680101203X","","","0.71073","MoKα","","0.0359","0.0313","","","","0.0989","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200425","13.5626","0.0006","17.1534","0.0007","20.3567","0.0007","90","","90","","90","","4735.9","0.3","150","1","150","1","","","","","","","","5","P b c n","-P 2n 2ab","60","","Tetra-n-butylammonium Phenyltrifluoroborate","","- C22 H41 B F3 N -","- C22 H41 B F3 N -","- C176 H328 B8 F24 N8 -","8","1","CF6090","Quach, Tan D.; Batey, Robert A.; Lough, Alan J.","Tetra-<i>n</i>-butylammonium phenyltrifluoroborate","Acta Crystallographica Section E","2001","57","8","o688","o689","10.1107/S1600536801010443","","","0.71073","MoKα","","0.0928","0.0513","","","","0.1299","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200426","8.1997","0.0003","18.2477","0.0006","8.8871","0.0003","90","","95.798","0.001","90","","1322.94","0.08","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,5-Dihydroxy-3,5-bis(trifluoromethyl)-1,2-dioxolane 1,4-dioxane","","- C9 H12 F6 O6 -","- C9 H12 F6 O6 -","- C36 H48 F24 O24 -","4","1","CF6091","Dickman, Michael H.","3,5-Dihydroxy-3,5-bis(trifluoromethyl)-1,2-dioxolane‒1,4-dioxane (1/1) at 173K","Acta Crystallographica Section E","2001","57","7","o636","o637","10.1107/S1600536801010340","","","0.71073","MoKα","","0.1047","0.0532","","","","0.1052","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200427","5.662","0.002","7.342","0.002","19.157","0.006","90","","94.48","0.03","90","","793.9","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","DL-alaninium oxalate","DL-alaninium oxalate","","- C5 H9 N O6 -","- C5 H9 N O6 -","- C20 H36 N4 O24 -","4","1","CF6092","M. Subha Nandhini; R. V. Krishnakumar; S. Natarajan","<small>DL</small>-Alaninium oxalate","Acta Crystallographica Section E","2001","57","8","o666","o668","10.1107/S1600536801010558","","","0.71073","Mokα","","0.0574","0.0443","","","","0.126","","","","","","1.123","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200428","15.436","0.001","17.4317","0.0011","8.1756","0.0005","90","","91.195","0.001","90","","2199.4","0.2","298","2","298","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","di-μ-iodo-bis(1,4,7,10,13,16-hexaoxacyclooctadecanecaesium(I)) p-xylene solvate","","- C32 H58 Cs2 I2 O12 -","- C32 H58 Cs2 I2 O12 -","- C64 H116 Cs4 I4 O24 -","2","0.25","CF6095","Kim, Tae Ho; Park, Ki-Min; Lee, Shim Sung; Kim, Jae Sang; Kim, Jineun","The sandwich dimeric form of a Cs^I^ complex of 18-crown-6 with bridging iodide ions","Acta Crystallographica Section E","2001","57","8","m357","m358","10.1107/S1600536801011916","","","0.71073","MoKα","","0.0338","0.0283","","","","0.0753","","","","","","1.091","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200429","10.155","0.005","13.586","0.005","14.972","0.008","80.55","0.05","73.07","0.04","85.4","0.05","1948.1","1.7","220","2","220","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H8 N2 O8 Re2 -","- C18 H8 N2 O8 Re2 -","- C72 H32 N8 O32 Re8 -","4","2","CF6096","Blake, Alexander J.; George, Michael W.; Little, Emma L.; Turner, James J.","2,2'-Bipyridine(octacarbonyl)dirhenium(<i>Re</i>‒<i>Re</i>)","Acta Crystallographica Section E","2001","57","8","m378","m379","10.1107/S1600536801011278","","","0.71073","MoKα","","0.056","0.046","","","","0.136","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200430","9.258","0.0005","10.9165","0.0006","16.4073","0.0008","90","","91.543","0.001","90","","1657.6","0.15","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Di-μ-hydroxo-bis[(1,1,4,7,7-pentamethyldiethylenetriamine)copper(II)] dibromide acetonitrile solvate","","- C22 H54 Br2 Cu2 N8 O2 -","- C22 H54 Br2 Cu2 N8 O2 -","- C44 H108 Br4 Cu4 N16 O4 -","2","0.5","CF6097","Kickelbick, Guido","A centrosymmetric hydroxo-bridged pentamethyldiethylenetriamine copper(II) complex, {[(pmdeta)Cu(OH)]~2~}^2+^·2Br^{-^}·2MeCN","Acta Crystallographica Section E","2001","57","8","m365","m367","10.1107/S1600536801011928","","","0.71073","MoKα","","0.0416","0.031","","","","0.0802","","","","","","1.068","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200431","38.755","0.003","9.378","0.003","22.043","0.002","90","","108.19","0.03","90","","7611","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Dichloro(2,2-diphenyl-4,4,6,6-tetrakis(3,5-dimethylpyrazol-1-yl)- cyclotriphosphazeneCobalt(II)","","","- C32 H38 Cl2 Co N11 P3 -","- C32 H38 Cl2 Co N11 P3 -","- C256 H304 Cl16 Co8 N88 P24 -","8","1","CF6098","Prabakaran, P.; Justin Thomas, K. R.; Thomas Muthiah, P.; Bocelli, G.; Righi, L.","Dichloro[2,2-diphenyl-4,4,6,6-tetrakis(3,5-dimethylpyrazol-1-yl)cyclotriphosphazene]cobalt(II)","Acta Crystallographica Section E","2001","57","9","m399","m401","10.1107/S1600536801013253","","","0.71069","MoKα","","0.1824","0.0482","","","","0.0738","","","","","","0.735","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200432","8.374","0.005","12.762","0.01","14.381","0.009","98.08","0.06","90.12","0.05","107.44","0.05","1450.1","1.8","130","2","130","2","","","","","","","","6","P -1","-P 1","2","[Co(bpb)(Cl)(pyridine)]^.^2CHCl~3~","(chloroN,N'-bis(2'-pyridinecarboxamido)pyridinecobalt(III) 2-chloroform solvate","","- C25 H19 Cl7 Co N5 O2 -","- C25 H19 Cl7 Co N5 O2 -","- C50 H38 Cl14 Co2 N10 O4 -","2","1","CF6099","John M. Rowland; Marilyn M. Olmstead; Pradip K. Mascharak","Chloro[<i>N,N</i>'-<i>o</i>-phenylenebis(pyridine-2-carboxamido)]cobalt(III) chloroform disolvate","Acta Crystallographica Section E","2001","57","8","m368","m370","10.1107/S160053680101193X","","","1.54178","CuKα","","0.1529","0.0993","","","","0.2988","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200433","7.153","0.001","10.29","0.002","37.22","0.008","90","","90","","90","","2739.6","0.9","291","2","291","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(2α,3α,5α,20S,22S)-2,3,5,14,20,20,24-Heptahydroxycholest-7-en-6-one monohydrate","","- C27 H46 O9 -","- C27 H46 O9 -","- C108 H184 O36 -","4","1","CF6101","Pan, Yuan-Jiang; Zhou, Hui; Shi, Hao; Lv, Shu-Ming; Jin, Zhi-Min","(2α,3α,5α,20<i>S</i>,22<i>S</i>)-2,3,5,14,20,20,24-Heptahydroxycholest-7-en-6-one monohydrate","Acta Crystallographica Section E","2001","57","9","o849","o851","10.1107/S1600536801013162","","","0.71073","MoKα","","0.0993","0.0407","","","","0.0643","","","","","","0.801","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200434","9.2136","0.0002","10.2904","0.0003","10.9603","0.0003","68.119","0.001","80.83","0.001","75.083","0.001","929.47","0.04","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-Acetyl-7a'-phenyl-spiro[3H-indole-3,2'(2a'H)oxeto [2,3-b]benzofuran-2(1H)-one","","- C24 H17 N O4 -","- C24 H17 N O4 -","- C48 H34 N2 O8 -","2","1","CF6102","Usman, Anwar; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Chantrapromma, Suchada; Xue, Jie; Xu, Jian-Hua","1-Acetyl-7a'-phenylspiro[3<i>H</i>-indole-3,2'(2a'<i>H</i>)-oxeto[2,3-<i>b</i>]benzofuran]-2(1<i>H</i>)-one","Acta Crystallographica Section E","2001","57","9","o852","o854","10.1107/S1600536801013125","","","0.71073","MoKα","","0.0883","0.0644","","","","0.1686","","","","","","0.938","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200435","11.206","0.004","12.811","0.002","16.208","0.004","96.032","0.017","103.54","0.02","113.191","0.016","2028.1","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(Pyridine-2,6-dicarboxylic acid)triaquastrontium(II) tris(pyridine-2,6- dicarboxylato)Ce(IV) hexahydrate","(Pyridine-2,6-dicarboxylic acid)triaquastrontium(II) tris(pyridine-2,6- dicarboxylato)Ce(IV) hexahydrate","","- C28 H32 Ce N4 O25 Sr -","- C28 H14 Ce N4 O25 Sr -","- C56 H28 Ce2 N8 O50 Sr2 -","2","1","CI6024","Sunkari Sailaja; M. V. Rajasekharan","A one-dimensional coordination polymer with alternating CeN~3~O~6~ and SrNO~7~ polyhedra","Acta Crystallographica Section E","2001","57","8","m341","m343","10.1107/S1600536801010741","","","0.71073","MoKα","","0.094","0.067","","","","0.197","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200436","12.3201","0.0012","5.9377","0.0015","14.2908","0.0016","90","0.014","111.369","0.01","90","0.013","973.5","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","Bis(D-phenylglycinium)sulfate monohydrate","Bis(D-phenylglycinium) sulfate monohydrate","","- C16 H22 N2 O9 S -","- C16 H22 N2 O9 S -","- C32 H44 N4 O18 S2 -","2","1","CI6028","Srinivasan, N.; Sridhar, B.; Rajaram, R. K.","Bis(<small>D</small>-phenylglycinium) sulfate monohydrate","Acta Crystallographica Section E","2001","57","8","o754","o756","10.1107/S1600536801011941","","","0.7107","MoKα","","0.045","0.043","","","","0.133","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200437","10.455","0.003","13.83","0.004","28.548","0.01","90","","90","","90","","4128","2","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","cis-Bis(2,2-bipyridine)dichloronickel(II) methanol solvate","","- C21 H20 Cl2 N4 Ni O -","- C21 H20 Cl2 N4 Ni O -","- C168 H160 Cl16 N32 Ni8 O8 -","8","1","CI6029","Fontaine, Frédéric-Georges","<i>cis</i>-Bis(2,2-bipyridine)dichloronickel(II) methanol solvate","Acta Crystallographica Section E","2001","57","7","m270","m271","10.1107/S1600536801007838","","","1.54056","CuKα","","0.088","0.047","","0.112","","0.101","","","0.79","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200438","5.0264","0.0006","20.822","0.002","20.897","0.002","90","","90","","90","","2187.1","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Hydrogen bis[L-lysinium(2+)] dichloride perchlorate","Hydrogen bis[L-lysinium(2+)] dichloride perchlorate","","- C12 H31 Cl3 N4 O8 -","- C12 H31 Cl3 N4 O8 -","- C48 H124 Cl12 N16 O32 -","4","1","CI6030","Srinivasan, N.; Sridhar, B.; Rajaram, R. K.","Hydrogen bis[<small>L</small>-lysinium(2+)] dichloride perchlorate","Acta Crystallographica Section E","2001","57","9","o875","o877","10.1107/S1600536801013484","","","0.7107","MoKα","","0.081","0.069","","","","0.196","","","","","","1.06","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200439","9.806","0.003","5.928","0.003","19.933","0.002","90","","90.696","0.016","90","","1158.6","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H9 N5 O7 -","- C8 H9 N5 O7 -","- C32 H36 N20 O28 -","4","1","CI6032","Graham Smith; Raymond C. Bott; Urs D. Wermuth","Guanidinium 3,5-dinitrosalicylate","Acta Crystallographica Section E","2001","57","7","o640","o642","10.1107/S1600536801010303","","","0.71069","MoKα","","0.0798","0.04","","","","0.1335","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200440","6.818","0.003","13.288","0.004","30.67","0.014","90","","94.47","0.03","90","","2770.2","1.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,8,9,10-Tetrakis(4-chlorophenyl)-1,3-diazaadamantan-6-one","","- C32 H24 Cl4 N2 O -","- C32 H24 Cl4 N2 O -","- C128 H96 Cl16 N8 O4 -","4","1","CI6033","Krishnakumar, R. V.; Subha Nandhini, M.; Vijayakumar, V.; Natarajan, S.; Sundaravadivelu, M.; Perumal, S.; Mostad, A.","4,8,9,10-Tetrakis(4-chlorophenyl)-1,3-diazaadamantan-6-one","Acta Crystallographica Section E","2001","57","9","o860","o862","10.1107/S1600536801013277","","","1.5418","CuKα","","0.102","0.061","","","","0.149","","","","","","1.16","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200441","10.065","0.002","23.178","0.004","9.077","0.003","90","","90","","90","","2117.5","0.9","293","","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C11 H9 Cl N4 -","- C11 H9 Cl N4 -","- C88 H72 Cl8 N32 -","8","1","CI6034","Pifferi, Augusto; Camalli, Mercedes; Silvestri, Romano; De Martino, Gabriella; Massa, Silvio; Artico, Marino","1-Amino-6-chloro-2-(1<i>H</i>-pyrrol-2-yl)benzimidazole (RS 1350)","Acta Crystallographica Section E","2001","57","9","o819","o821","10.1107/S1600536801010856","","","0.71069","MoKα","","0.042","0.042","","0.07","","0.07","","","0.97","","","0.97","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200442","11.662","0.003","7.579","0.002","12.038","0.006","90","","106.89","0.03","90","","1018.1","0.7","173","","173","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H11 F O3 -","- C12 H11 F O3 -","- C48 H44 F4 O12 -","4","1","CI6035","Razzino, Pasquale; Ward, A. David; Tiekink, Edward R. T.","2-(6-Fluoro-5-hydroxy-2-methyl-1<i>H</i>-3-indenyl)acetic acid","Acta Crystallographica Section E","2001","57","7","o643","o644","10.1107/S1600536801010297","","","0.71069","MoKα","","0.079","0.047","","","","0.141","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200443","7.648","0.003","6.872","0.006","24.314","0.002","90","","93.1","0.02","90","","1276","1.2","173","","173","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H14 O2 S -","- C15 H14 O2 S -","- C60 H56 O8 S4 -","4","1","CI6036","Razzino, Pasquale; Ward, A. David; Tiekink, E. R. T.","4-[(4-Methoxybenzyl)sulfanyl]benzaldehyde","Acta Crystallographica Section E","2001","57","7","o622","o623","10.1107/S160053680101008X","","","0.71069","MoKα","","0.104","0.038","","","","0.099","","","","","","0.97","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200444","14.56","0.002","6.6","0.0012","22.115","0.004","90","","90.7","0.02","90","","2125","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Bis(DL-phenylalaninium)sulfate monohydrate","","","- C18 H26 N2 O9 S -","- C18 H26 N2 O9 S -","- C72 H104 N8 O36 S4 -","4","1","CI6038","Srinivasan, N.; Sridhar, B.; Rajaram, R. K.","Bis(<small>DL</small>-phenylalaninium) sulfate monohydrate","Acta Crystallographica Section E","2001","57","8","o772","o774","10.1107/S160053680101234X","","","0.71069","MoKα","","0.066","0.046","","","","0.119","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200445","10.3369","0.0004","4.7557","0.0002","14.2208","0.0007","90","","102.495","0.0018","90","","682.52","0.05","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1-Methylethyl 2-[(1-bromo-2-naphthalenyl)oxy]ethanoate","","- C15 H15 Br O3 -","- C15 H15 Br O3 -","- C30 H30 Br2 O6 -","2","1","CI6040","Janet M. S. Skakle; Solange M. S. V. Wardell","1-Methylethyl 2-[(1-bromo-2-naphthyl)oxy]ethanoate","Acta Crystallographica Section E","2001","57","8","o767","o768","10.1107/S160053680101176X","","","0.71073","MoKα","","0.05","0.042","","","","0.112","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200446","8.6089","0.0005","12.2249","0.0007","17.3057","0.0011","90","","100.86","0.002","90","","1788.68","0.19","298","2","298","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","Catena-(μ^2^-(1-Hydroxybenzene-3,5-dicarboxylato-O,O',O'',O''')(1,10-phenanthr oline)manganese(II) hydrate)","","- C20 H14 Mn N2 O6 -","- C20 H14 Mn N2 O6 -","- C80 H56 Mn4 N8 O24 -","4","1","CI6041","J. M. S. Skakle; M. R. St J. Foreman; M. J. Plater","<i>catena</i>-Poly[[[(1,10-phenanthroline)manganese(II)]-μ-(1-hydroxybenzene-3,5-dicarboxylato)] hydrate]","Acta Crystallographica Section E","2001","57","8","m373","m375","10.1107/S1600536801011758","","","0.71073","MoKα","","0.09","0.04","","","","0.079","","","","","","0.85","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200447","10.744","0.005","22.193","0.004","7.079","0.005","90","","90","","90","","1687.9","1.5","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1,1'-(phalolyl)bis(benzotriazole)","","- C20 H12 N6 O2 -","- C20 H12 N6 O2 -","- C80 H48 N24 O8 -","4","1","CI6043","Graham Smith; Steven E. Bottle; Damien A. Reid; D. Paul Schweinsberg; Raymond C. Bott","A phthaloyl-linked benzotriazole corrosion inhibitor: 1,1'-(phthaloyl)bis(benzotriazole)","Acta Crystallographica Section E","2001","57","8","o695","o696","10.1107/S1600536801011011","","","0.71069","MoKα","","0.153","0.037","","","","0.138","","","","","","0.89","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200448","8.949","0.002","22.451","0.005","12.712","0.004","90","","90","","90","","2554","1.1","298","","298","","","","","","","","","4","P c c n","-P 2ab 2ac","56","Piperidinium p-nitrobenzoate","Piperidinium p-nitrobenzoate","","- C12 H16 N2 O4 -","- C12 H16 N2 O4 -","- C96 H128 N16 O32 -","8","1","CI6044","Moritani, Yoshimitsu; Takeda, Akihiko; Kashino, Setsuo","Piperidinium <i>p</i>-nitrobenzoate","Acta Crystallographica Section E","2001","57","8","o707","o708","10.1107/S1600536801010844","","","0.71073","MoKα","","0.15","0.057","","","","0.205","","","","","","0.914","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200449","8.325","0.005","10.957","0.004","10.363","0.004","90","","112.39","0.05","90","","874","0.8","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","DL-threoninium oxalate","","- C6 H11 N O7 -","- C6 H11 N O7 -","- C24 H44 N4 O28 -","4","1","CI6046","M.Subha Nandhini; R.V. Krishnakumar; R. Malathi; S.S. Rajan; S.Natarajan","<small>DL</small>-Threoninium oxalate","Acta Crystallographica Section E","2001","57","8","o769","o771","10.1107/S1600536801012193","","","1.54178","CuKα","","0.067","0.053","","","","0.175","","","","","","1.1","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200450","7.7414","0.0001","10.3084","0.0001","10.9583","0.0002","74.415","0.001","78.835","0.001","81.192","0.001","821.65","0.02","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-Bromo-5,5-dimethoxybenzo[a]anthracene-6,7,12(5H)trione","","- C20 H13 Br O5 -","- C20 H13 Br O5 -","- C40 H26 Br2 O10 -","2","1","CI6048","Usman, Anwar; Razak, Ibrahim Abdul; Chantrapromma, Suchada; Fun, Hoong-Kun; Dey, Satyajit; Mal, Dipakranjan; Nigam, Gur Dayal","2-Bromobenz[<i>a</i>]anthracene-5,6,7,12-tetraone-5-dimethylketal","Acta Crystallographica Section E","2001","57","9","o825","o826","10.1107/S1600536801012892","","","0.71073","MoKα","","0.092","0.066","","","","0.165","","","","","","0.94","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200451","11.1302","0.0002","7.3731","0.0001","24.3816","0.0004","90","","96.95","0.001","90","","1986.15","0.06","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(1R/1S,5S/5R)-Dichloro-3,6,6-triphenyl-3-azabicyclo[3.2.0]hepta-2,4-dione","","- C24 H17 Cl2 N O2 -","- C24 H17 Cl2 N O2 -","- C96 H68 Cl8 N4 O8 -","4","1","CI6049","Usman, Anwar; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Chantrapromma, Suchada; Xue, Jie; Xu, Jian-Hua","1,5-Dichloro-3,6,6-triphenyl-3-azabicyclo[3.2.0]heptane-2,4-dione","Acta Crystallographica Section E","2001","57","8","o792","o793","10.1107/S1600536801012673","","","0.71073","MoKα","","0.064","0.045","","","","0.102","","","","","","0.83","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200452","7.7046","0.0005","10.6062","0.0007","9.3384","0.0006","90","","95.033","0.002","90","","760.16","0.09","297","2","297","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","3-Aza-bicyclo[3.3.1]nonane-2,4-dione","","- C8 H11 N O2 -","- C8 H11 N O2 -","- C32 H44 N4 O8 -","4","1","CI6050","Howie, R. Alan; Skakle, Janet M. S.","3-Azabicyclo[3.3.1]nonane-2,4-dione: CSP2001 structure prediction test case No. 1","Acta Crystallographica Section E","2001","57","9","o822","o824","10.1107/S1600536801012818","","","0.71073","MoKα","","0.083","0.044","","","","0.123","","","","","","0.9","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200453","7.744","0.005","7.284","0.005","11.653","0.005","90","","92.6","0.005","90","","656.6","0.7","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","L-Argininium dinitrate","L-Argininium dinitrate","","- C6 H16 N6 O8 -","- C6 H16 N6 O8 -","- C12 H32 N12 O16 -","2","1","CI6051","Ramaswamy, S.; Sridhar, B.; Ramakrishnan, V.; Rajaram, R. K.","<small>L</small>-Argininium dinitrate","Acta Crystallographica Section E","2001","57","9","o872","o874","10.1107/S1600536801013460","","","1.5418","CuKα","","0.074","0.07","","","","0.218","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200454","10.54","0.002","12.153","0.003","9.786","0.002","106.2","0.03","116.89","0.03","87.18","0.04","1069.2","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4-tert-Butyl-2,6-bis(piperidinomethyl)phenol","","- C22 H36 N2 O -","- C22 H36 N2 O -","- C44 H72 N4 O2 -","2","1","CI6052","Abdul Ajees, A.; Sekar, K.; Marrappan, M.; Kandasamy, M.","4-<i>tert</i>-Butyl-2,6-bis(piperidinomethyl)phenol","Acta Crystallographica Section E","2001","57","9","o878","o880","10.1107/S1600536801013836","","","1.5418","CuKα","","0.059","0.057","","","","0.176","","","","","","1.09","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200455","12.3624","0.0001","13.064","0.0002","17.1439","0.0003","110.066","0.001","93.2","0.001","110.534","0.001","2386.13","0.07","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4-Benzylidene-1'-methyl-4'-phenylcyclohexanespiro-3'-pyrrolidine-2'-spiro- 3''-indoline-2,2''-dione","","- C30 H28 N2 O2 -","- C30 H28 N2 O2 -","- C120 H112 N8 O8 -","4","2","CI6054","Jeyabharathi, A.; Ponnuswamy, M. N.; Amal Raj, A.; Raghunathan, R.; Razak, Ibrahim Abdul; Usman, Anwar; Chantrapromma, Suchada; Fun, Hoong-Kun","3-Benzylidene-1'-methyl-4'-phenylcyclohexanespiro-3'-pyrrolidine-2'-spiro-3''-indoline-2,2''-dione","Acta Crystallographica Section E","2001","57","9","o901","o903","10.1107/S1600536801013964","","","0.71073","MoKα","","0.104","0.057","","","","0.141","","","","","","0.88","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200456","34.826","0.017","3.7296","0.0016","20.703","0.01","90","","110.63","0.05","90","","2517","2","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Diflunisal","","","- C14.5 H7 F2 O3 -","- C14.5 H7 F2 O3 -","- C116 H56 F16 O24 -","8","1","CV6024","Hansen, Lars Kr.; Perlovich, German L.; Bauer-Brandl, Annette","Diflunisal‒hexane (4/1)","Acta Crystallographica Section E","2001","57","7","o604","o606","10.1107/S1600536801008558","","","0.71069","MoKα","","0.1885","0.0662","","","","0.2003","","","","","","1.043","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200457","21.416","0.001","7.52","0.001","19.487","0.001","90","","117.86","0.01","90","","2774.6","0.5","150","2","150","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","(1S*,4S*,5R*,8R*)-4,8-Diphenyl-3,7-dioxabicyclo[3.3.0]octan-2-one","","- C18 H16 O3 -","- C18 H16 O3 -","- C144 H128 O24 -","8","1","CV6025","Gelbrich, Thomas; Hursthouse, Michael B.","(1<i>S</i>*,4<i>S</i>*,5<i>R</i>*,8<i>R</i>*)-4,8-Diphenyl-3,7-dioxabicyclo[3.3.0]octan-2-one","Acta Crystallographica Section E","2001","57","7","o566","o567","10.1107/S1600536801008170","","","0.71073","MoKα","","0.0731","0.0509","","","","0.1092","","","","","","0.97","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200458","5.6733","0.0003","9.9375","0.0006","9.9407","0.0006","90","","90","","90","","560.44","0.06","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","R-thioproline","(R)-1,3-Thiazolidin-3-ium-4-carboxylate","","- C4 H7 N O2 S -","- C4 H7 N O2 S -","- C16 H28 N4 O8 S4 -","4","1","CV6026","Grant, Neil; Ward, Mark F.; Jaspars, Marcel; Harrison, William T. A.","(<i>R</i>)-1,3-Thiazolidin-3-ium-4-carboxylate","Acta Crystallographica Section E","2001","57","8","o697","o699","10.1107/S1600536801010947","","","0.71073","MoKα","","0.032","0.029","","","","0.079","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200459","7.9665","0.001","8.911","0.01","10.7318","0.001","69.59","0.06","75.783","0.01","80.87","0.08","689.9","0.8","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C16 H22 N2 -","- C16 H22 N2 -","- C32 H44 N4 -","2","1","CV6027","Hökelek, Tuncer; Patır, Süleyman; Ergün, Yavuz; Okay, Gürol","2-(1,2,3,4-Tetrahydrocarbazol-2-yl)butylamine","Acta Crystallographica Section E","2001","57","7","o568","o570","10.1107/S1600536801008984","","","1.5418","CuKα","","0.0883","0.0554","","","","0.1573","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200460","21.698","0.004","7.339","0.0015","8.638","0.0017","90","","90","","90","","1375.5","0.5","123","2","293","2","","","","","","","","3","P n n 2","P 2 -2n","34","2-trans-cinnamonyl-acetoacetic acid","2-acetyl-3-oxo-5-pentyl-pent-4-enoic acid ethyl ester","","- C15 H16 O4 -","- C15 H16 O4 -","- C60 H64 O16 -","4","1","CV6028","Arrieta, Antonio F.; Arvid Mostad","Ethyl 2-<i>trans</i>-cinnamoylacetoacetate","Acta Crystallographica Section E","2001","57","8","o669","o671","10.1107/S1600536801010583","","","0.71073","MoKα","","0.0331","0.0313","","","","0.0789","","","","","","1.062","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200461","12.11","0.009","6.084","0.003","15.024","0.011","90","","109.54","0.11","90","","1043.2","1.4","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","16α-Hydroxy-20-oxopregn-5-en-3β-yl-acetate","","- C23 H34 O4 -","- C23 H34 O4 -","- C46 H68 O8 -","2","1","CV6029","Andrade, L. C. R.; Paixão, J. A.; de Almeida, M. J. M.; Martins, R. M. L. M.; Soares, H. I. M.; Moreno, M. J. S. M.; Sá e Melo, M. L.; Campos Neves, A. S.","16α-Hydroxy-20-oxopregn-5-en-3β-yl acetate","Acta Crystallographica Section E","2001","57","7","o571","o573","10.1107/S1600536801008996","","","0.71073","MoKα","","0.0925","0.0405","","","","0.1185","","","","","","1.004","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200462","15.3382","0.0014","8.6418","0.0009","15.9748","0.0011","90","","105.034","0.01","90","","2045","0.3","291","2","291","1","","","","","","","","5","P 1 n 1","P -2yac","7","","benzene-1,3,5-triyltrismethylenetris(diphenylphosphine oxide) acetonitrile solvate monohydrate","","- C47 H44 N O4 P3 -","- C47 H44 N O4 P3 -","- C94 H88 N2 O8 P6 -","2","1","CV6030","Kruszynski, Rafal; Wieczorek, Wanda","Polymorphic form of 1,3,5-tris[(diphenylphosphine oxide)methyl]benzene acetonitrile solvate monohydrate","Acta Crystallographica Section E","2001","57","7","o624","o626","10.1107/S1600536801010157","","","0.71073","MoKα","","0.0794","0.0785","","","","0.164","","","","","","1.083","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200463","9.1308","0.0011","14.0077","0.0019","19.012","0.003","90","","90","","90","","2431.7","0.6","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18 H24 Cl2 N6 P2 Pd -","- C18 H24 Cl2 N6 P2 Pd -","- C72 H96 Cl8 N24 P8 Pd4 -","4","0.5","CV6031","Lawrence, Simon E.; Kelly, Maureen; Ní Dhubhghaill, Orla M.","Dichloro-<i>trans</i>-bis[tris(2-cyanoethyl)phosphine]palladium(II)","Acta Crystallographica Section E","2001","57","7","m272","m273","10.1107/S1600536801009278","","","0.71069","MoKα","","0.0385","0.0266","","","","0.0762","","","","","","1.188","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200464","8.7253","0.0001","8.9271","0.0001","11.5975","0.0002","72.68","0.01","71.25","0.01","61.01","0.01","737.16","0.08","183","2","183","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H18 Br N O6 -","- C12 H18 Br N O6 -","- C24 H36 Br2 N2 O12 -","2","1","CV6032","Kožíšek, Jozef; Šafář, Peter; Langer, Vratislav","1-[2-(Dicarboxymethyl)-3-oxocyclopent-4-en-1-yl]pyrrolidin-1-ium bromide hydrate","Acta Crystallographica Section E","2001","57","8","o775","o777","10.1107/S1600536801011266","","","0.71073","MoKα","","0.0365","0.0291","","","","0.0756","","","","","","0.974","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200465","18.581","0.003","5.163","0.002","13.344","0.003","90","","93.71","0.02","90","","1277.5","0.6","293","","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N^6^-benzyladenine hydrobromide","","","- C12 H12 Br N5 -","- C12 H12 Br N5 -","- C48 H48 Br4 N20 -","4","1","CV6033","Umadevi, Balakrishnan; Stanley, Nithianantham; Thomas Muthiah, Packianathan; Bocelli, Gabriele; Cantoni, Andrea","<i>N</i>^6^-Benzyladenine hydrobromide and the solid-state conformation of cytokinins","Acta Crystallographica Section E","2001","57","9","o881","o883","10.1107/S1600536801013629","","","1.54178","CuKα","","0.0674","0.0674","","","","0.1732","","","","","","1.044","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200466","6.765","0.002","13.822","0.002","12.114","0.003","90","","94.92","0.02","90","","1128.6","0.5","294","2","294","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C7 H7 Br5 -","- C7 H7 Br5 -","- C28 H28 Br20 -","4","1","CV6034","Hökelek, Tuncer; Çelik, Ïsmail; Tutar, Ahmet; Çakmak, Osman","2,2-<i>exo</i>-3,5,6-Pentabromobicycloheptane","Acta Crystallographica Section E","2001","57","8","o709","o711","10.1107/S1600536801010728","","","0.71073","MoKα","","0.1616","0.064","","","","0.1327","","","","","","0.982","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200467","10.9909","0.0002","10.5488","0.0002","11.3876","0.0002","90","","100.526","0.001","90","","1298.07","0.04","297","2","297","2","","","","","","","","3","P 1 21 1","P 2yb","4","","1,2:4,5-di-O-isopropylidene-β-D-erythro-hexo-2,3-diulo-2,6 -pyranose","","- C12 H18 O6 -","- C12 H18 O6 -","- C48 H72 O24 -","4","2","CV6035","Marián Ďurík; Vratislav Langer; Dalma Gyepesová; Júlia Mičová; Bohumil Steiner; Miroslav Koóš","1,2:4,5-Di-<i>O</i>-isopropylidene-β-<small>D</small>-<i>erythro</i>-hexo-2,3-diulo-2,6-pyranose","Acta Crystallographica Section E","2001","57","8","o672","o674","10.1107/S160053680101073X","","","0.71073","MoKα","","0.052","0.0356","","","","0.0914","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200468","6.555","0.0002","10.918","0.0003","20.559","0.0006","90","","93.203","0.0015","90","","1469.06","0.07","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[5,10,15,20-meso-Tetrakis(2-thienyl)porphyrinato-κ^4^N]copper(II)","","- C36 H20 Cu N4 S4 -","- C36 H20 Cu N4 S4 -","- C72 H40 Cu2 N8 S8 -","2","0.5","CV6036","Yael Diskin-Posner; Srinivasan Balasubramanian; Goutam Kumar Patra; Israel Goldberg","[5,10,15,20-<i>meso</i>-Tetrakis(2-thienyl)porphyrinato-κ^4^<i>N</i>]copper(II)","Acta Crystallographica Section E","2001","57","8","m346","m348","10.1107/S1600536801011308","","","0.7107","MoKα","","0.0524","0.0459","","","","0.1299","","","","","","0.979","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200469","9.078","0.001","5.761","0.002","21.372","0.002","90","","100.341","0.008","90","","1099.6","0.4","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,2-bis(diphenylarsino)ethane","","- C26 H24 As2 -","- C26 H24 As2 -","- C52 H48 As4 -","2","0.5","CV6037","Hill, Nicholas J.; Levason, William; Reid, Gillian; Webster, Michael","1,2-Bis(diphenylarsino)ethane","Acta Crystallographica Section E","2001","57","8","o700","o701","10.1107/S1600536801010959","","","0.71073","MoKα","","0.0311","0.0241","","","","0.0665","","","","","","1.096","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200470","8.683","0.003","15.159","0.006","11.151","0.003","90","","91.06","0.03","90","","1467.5","0.9","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","N-(1-Benzenesulfonyl-4-acetylpyrrol-3-yl)acetamide","N-(1-Benzenesulfonyl-4-acetylpyrrol-3-yl)acetamide","","- C14 H14 N2 O4 S -","- C14 H14 N2 O4 S -","- C56 H56 N8 O16 S4 -","4","1","CV6038","Grossie, David A; Ketcha, Daniel; Johyne P. Brooke; Scott A. Jones; Jonathan G. Grieb","<i>N</i>-(1-Benzenesulfonyl-4-acetylpyrrol-3-yl)acetamide","Acta Crystallographica Section E","2001","57","8","o778","o780","10.1107/S160053680101131X","","","0.71069","MoKα","","0.0714","0.0592","","","","0.1817","","","","","","1.079","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200471","12.978","0.002","16.518","0.002","23.95","0.004","90","","90","","90","","5134.2","1.3","213.2","","213.2","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C20 H34 Cl2 Cu N6 O8 -","- C20 H34 Cl2 Cu N6 O8 -","- C160 H272 Cl16 Cu8 N48 O64 -","8","1","CV6040","Daly, Robert I.; Hockless, David C. R.; Taylor, Max R.; Martin, Lisandra L.","{2-(4,7-Dimethyl-1,4,7-triazacyclonon-1-yl)-<i>N</i>-methyl-<i>N</i>-[(1-methylbenzimidazol-2-yl)methyl]ethylamine}copper(II) bis(perchlorate)","Acta Crystallographica Section E","2001","57","8","m355","m356","10.1107/S1600536801011540","","","1.5418","CuKα","","","0.054","","","","0.165","","","","","","1.377","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200472","10.367","0.001","6.343","0.001","23.361","0.002","90","","100.98","0.01","90","","1508","0.3","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","9-p-Toluidinoanthracene","","- C21 H17 N -","- C21 H17 N -","- C84 H68 N4 -","4","1","CV6042","Lahlou, Souad; Kerbal, Abdelali; Janati, Tajdine; Lyazidi, Saîda Aît; Bitit, Najib; El-Bali, Brahim; Bolte, Michael","9-<i>p</i>-Toluidinoanthracene","Acta Crystallographica Section E","2001","57","8","o733","o734","10.1107/S1600536801011539","","","0.71073","MoKα","","0.087","0.0491","","","","0.1397","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200473","5.5973","0.0002","18.5701","0.0005","11.8195","0.0003","90","","91.304","0.001","90","","1228.23","0.06","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-p-Toluoylquinoxaline","","- C16 H12 N2 O -","- C16 H12 N2 O -","- C64 H48 N8 O4 -","4","1","CV6043","Chowdhury, Krishna; Mukhopadhyay, Rupa; Mukherjee, Monika; Broder, Charlotte K.; Kundu, Nitya G.","2-<i>p</i>-Toluoylquinoxaline","Acta Crystallographica Section E","2001","57","8","o794","o795","10.1107/S1600536801012491","","","0.71073","MoKα","","0.0507","0.0433","","","","0.1273","","","","","","1.044","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200474","7.5206","0.0015","3.9367","0.0008","25.881","0.005","90","","96.84","0.03","90","","760.8","0.3","203","2","203","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-bromo-2-hydroxybenzene-1,3-dicarbaldehyde","","- C8 H5 Br O3 -","- C8 H5 Br O3 -","- C32 H20 Br4 O12 -","4","1","CV6044","Duclos, Séverine; Therrien, Bruno; Ward, Thomas R.","5-Bromo-2-hydroxybenzene-1,3-dicarbaldehyde","Acta Crystallographica Section E","2001","57","9","o884","o885","10.1107/S1600536801013630","","","0.71073","MoKα","","0.0532","0.0449","","","","0.1223","","","","","","1.149","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200475","9.1991","0.0011","7.384","0.0005","25.694","0.003","90","","100.03","0.009","90","","1718.6","0.3","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","cyclohexyl furan carboxylate derivative","2-(1-Naphthyl)cyclohexyl 3-furancarboxylate","","- C21 H20 O3 -","- C21 H20 O3 -","- C84 H80 O12 -","4","1","CV6045","Parvez, Masood; Hunt, Ian R.; Keay, Brian A.","2-(1-Naphthyl)cyclohexyl 3-furancarboxylate","Acta Crystallographica Section E","2001","57","8","o800","o801","10.1107/S1600536801012508","","","0.71069","MoKα","","0.26","0.053","","","","0.242","","","","","","0.955","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200476","5.5332","0.0011","12.841","0.002","20.088","0.003","90","","96.52","0.02","90","","1418.1","0.4","200","2","200","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","cyclohexyl furan carboxylate derivative","2-Phenyl-cyclohexyl-3-furan carboxylate","","- C17 H18 O3 -","- C17 H18 O3 -","- C68 H72 O12 -","4","1","CV6046","Parvez, Masood; Hunt, Ian R.; Keay, Brian A.","2-Phenylcyclohexyl 3-furancarboxylate","Acta Crystallographica Section E","2001","57","8","o802","o803","10.1107/S160053680101251X","","","0.71069","MoKα","","0.165","0.05","","","","0.221","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200477","21.774","0.003","10.694","0.002","18.43","0.003","90","","122.38","0.01","90","","3624.2","1.1","200","2","200","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","cyclohexyl furan carboxylate derivative","2-(1-Naphthyl)cyclohexyl 2-methylfuran-3-carboxylate","","- C22 H22 O3 -","- C22 H22 O3 -","- C176 H176 O24 -","8","1","CV6047","Parvez, Masood; Hunt, Ian R.; Keay, Brian A.","2-(1-Naphthyl)cyclohexyl 2-methylfuran-3-carboxylate","Acta Crystallographica Section E","2001","57","8","o804","o805","10.1107/S1600536801012521","","","0.71069","MoKα","","0.123","0.042","","","","0.146","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200478","5.9896","0.0011","15.5307","0.0015","8.8471","0.0011","90","","106.934","0.012","90","","787.3","0.2","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","racemic 7-oxabicyclo[2.2.1]heptane-5-exo-iodo-6-endo-hydroxy-2-endo- carboxylic acid-γ-lactone","","- C7 H7 I O3 -","- C7 H7 I O3 -","- C28 H28 I4 O12 -","4","1","CV6048","Smith, Graham; Bott, Raymond C.; Jenkins, Ian D.; Wermuth, Urs D.","Racemic 7-oxabicyclo[2.2.1]heptane-5-<i>exo</i>-iodo-6-<i>endo</i>-hydroxy-2-<i>endo</i>-carboxylic acid-γ-lactone","Acta Crystallographica Section E","2001","57","8","o806","o808","10.1107/S1600536801012661","","","0.71069","MoKα","","0.0396","0.0286","","","","0.0772","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200479","7.83","0.002","13.683","0.003","7.296","0.002","90","","90","","90","","781.7","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,6-Dinitrotoluene","","- C7 H6 N2 O4 -","- C7 H6 N2 O4 -","- C28 H24 N8 O16 -","4","1","CV6049","Jing-Jing Nie; Duan-Jun Xu; Zhen-Yu Li; Michael Y. Chiang","2,6-Dinitrotoluene","Acta Crystallographica Section E","2001","57","9","o827","o828","10.1107/S1600536801013022","","","0.71073","MoKα","","0.0541","0.0461","","0.1439","","0.1326","","","1.046","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200480","11.8692","0.0003","6.0255","0.0002","29.7783","0.0006","90","","94.221","0.001","90","","2123.9","0.1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4,4'-Bis(5-Carbomethoxy-2-thienyl)phenyl sulfide","","- C24 H18 O4 S3 -","- C24 H18 O4 S3 -","- C96 H72 O16 S12 -","4","0.5","CV6050","Anwar Usman; Ibrahim Abdul Razak; Suchada Chantrapromma; Hoong-Kun Fun; Dipanjan Pan; Jayanta Kumar Ray","Bis[4-(5-methoxycarbonyl-2-thienyl)phenyl] sulfide","Acta Crystallographica Section E","2001","57","9","o842","o843","10.1107/S1600536801013034","","","0.71073","MoKα","","0.0743","0.0528","","","","0.1505","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200481","8.4871","0.0002","10.0561","0.0002","16.0181","0.0001","90","","96.536","0.001","90","","1358.21","0.04","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","10-fluoro-6,7-dihydro-5H-benzo[6,7]cyclohepta[1,2-b]quinoline","","- C18 H14 F N -","- C18 H14 F N -","- C72 H56 F4 N4 -","4","1","CV6051","Anwar Usman; Ibrahim Abdul Razak; Suchada Chantrapromma; Hoong-Kun Fun; Dipanjan Pan; Jayanta Kumar Ray","10-Fluoro-6,7-dihydro-5<i>H</i>-benzo[6,7]cyclohepta[1,2-<i>b</i>]quinoline","Acta Crystallographica Section E","2001","57","9","o844","o845","10.1107/S1600536801013046","","","0.71073","MoKα","","0.0956","0.0538","","","","0.1482","","","","","","0.899","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200482","12.6246","0.0003","13.0962","0.0003","21.2134","0.0005","90","","90","","90","","3507.3","0.14","120","2","120","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","no","17S,20S-Dihydrofusidic acid diethylene glycol hydrate","","- C35 H62 O10 -","- C35 H62 O10 -","- C140 H248 O40 -","4","1","DN6000","Søtofte, Inger; Duvold, Tore","A new potent fusidic acid analogue","Acta Crystallographica Section E","2001","57","9","o829","o831","10.1107/S1600536801012776","","","0.71073","MoKα","","0.0829","0.0689","","0.1946","","0.175","","","1.151","","","1.125","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200483","9.5437","0.0005","11.8437","0.0006","10.1523","0.0003","90","","113.638","0.003","90","","1051.26","0.09","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H11 N3 O -","- C12 H11 N3 O -","- C48 H44 N12 O4 -","4","1","DN6001","Attar, K. H.; El Azaoui, B.; Benchidmi, M.; Essassi, E. M.; Pierrot, M.","2-[(5-Méthylisoxazol-3-yl)méthyl]benzimidazole","Acta Crystallographica Section E","2001","57","8","o809","o810","10.1107/S1600536801012740","","","0.71073","MoKα","","0.046","0.04","","0.054","","0.054","","","1.154","","","1.195","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200484","12.56","0.002","7.243","0.002","13.387","0.002","90","","117.96","0.02","90","","1075.7","0.4","293","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","μ-oxalato-bis[aqua(diethylenetriamine)nickel(II)] dinitrate","","- C10 H30 N8 Ni2 O12 -","- C10 H30 N8 Ni2 O12 -","- C20 H60 N16 Ni4 O24 -","2","0.5","DN6002","Guzmán-Miralles, Carmen; Castillo, Oscar; Luque, Antonio; Beitia, Javier I.; Román, Pascual","μ-Oxalato-bis[aqua(diethylenetriamine)nickel(II)] dinitrate","Acta Crystallographica Section E","2001","57","9","m407","m409","10.1107/S1600536801013344","","","0.71073","MoKα","","0.0594","0.0325","","","","0.0889","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200485","14.4988","0.0002","17.1659","0.0001","18.1536","0.0005","90","","90","","90","","4518.16","0.14","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Tris(μ-1,4-benzenedicarboxylate)tetrakis(dimethyl sulfoxide)di-μ~3~-hydroxo-tetrazinc dihydrate","","- C32 H42 O20 S4 Zn4 -","- C32 H42 O20 S4 Zn4 -","- C128 H168 O80 S16 Zn16 -","4","0.5","NA6080","Wang, Ruihu; Hong, Maochun; Liang, Yucang; Cao, Rong","Tris(μ-1,4-benzenedicarboxylate)tetrakis(dimethyl sulfoxide)di-μ~3~-hydroxo-tetrazinc dihydrate","Acta Crystallographica Section E","2001","57","7","m277","m279","10.1107/S1600536801009175","","","0.71073","MoKα","","0.0997","0.052","","","","0.1275","","","","","","1.051","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2200486","23.6702","0.0005","13.5602","0.0003","16.6057","0.0004","90","","126.717","0.0011","90","","4272.49","0.18","150","1","150","1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","cis-Bis[2-(2-pyridyl)-4-methoxycarbonylquinoline](2,2'-bipyridine)ruthenium(II) hexafluorophosphate","","- C42 H32 F12 N6 O4 P2 Ru -","- C42 H32 F12 N6 O4 P2 Ru -","- C168 H128 F48 N24 O16 P8 Ru4 -","4","0.5","NA6081","Farah, Abdiaziz A.; Zobi, Fabio; Stynes, Dennis V.; Lough, Alan J.; Pietro, William J.","<i>cis</i>-(2,2'-Bipyridine)bis[2-(2-pyridyl)-4-methoxycarbonylquinoline]ruthenium(II) hexafluorophosphate","Acta Crystallographica Section E","2001","57","7","m274","m276","10.1107/S1600536801008765","","","0.71073","MoKα","","0.0493","0.0426","","","","0.1104","","","","","","1.119","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200487","10.094","0.0002","13.5844","0.0003","16.1679","0.0003","90","","90","","90","","2216.96","0.08","293","1","293","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C25 H34 O3 -","- C25 H34 O3 -","- C100 H136 O12 -","4","1","NA6082","Linker, Manuela; Schürmann, Markus; Preut, Hans; Kreiser, Wolfgang","(20<i>S</i>)-Methyl-3-oxochola-1,4,22-trien-24-oate","Acta Crystallographica Section E","2001","57","7","o574","o575","10.1107/S1600536801008789","","","0.71073","MoKα","","0.1294","0.0525","","","","0.1226","","","","","","1.001","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200488","10.4164","0.0002","7.5425","0.0002","14.4209","0.0003","90","","107.762","0.0011","90","","1078.98","0.04","293","1","293","1","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C25 H34 O3 -","- C25 H34 O3 -","- C50 H68 O6 -","2","1","NA6083","Linker, Manuela; Schürmann, Markus; Preut, Hans; Kreiser, Wolfgang","(20<i>R</i>)-Methyl-3-oxochola-1,4,22-trien-24-oate","Acta Crystallographica Section E","2001","57","7","o576","o577","10.1107/S1600536801008777","","","0.71073","MoKα","","0.1014","0.047","","","","0.1139","","","","","","1.011","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200489","5.929","0.001","8.195","0.007","11.503","0.002","90","","100.06","0.01","90","","550.3","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","D-serinium D-serine nitrate","D-serinium D-serine nitrate","","- C6 H15 N3 O9 -","- C6 H15 N3 O9 -","- C12 H30 N6 O18 -","2","1","NA6085","Ravikumar, B.; Sridhar, B.; Rajaram, R. K.","<small>D</small>-Serinium <small>D</small>-serine nitrate","Acta Crystallographica Section E","2001","57","8","o682","o684","10.1107/S1600536801009035","","","0.71073","MoKα","","0.0359","0.0263","","","","0.0743","","","","","","0.947","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200490","8.34","0.0013","8.9291","0.0011","10.724","0.002","102.576","0.013","107.704","0.015","119.667","0.011","592","0.2","293","2","293","2","","","","","","","","5","P 1","P 1","1","Bis(L-histidinium sulfate) trihydrate","Bis(L-histidinium sulfate) trihydrate","","- C6 H14 N3 O7.5 S -","- C6 H14 N3 O7.515 S -","- C12 H28 N6 O15.03 S2 -","2","2","NA6086","Srinivasan, N.; Sridhar, B.; Rajaram, R. K.","Bis(<small>L</small>-histidinium sulfate) trihydrate","Acta Crystallographica Section E","2001","57","7","o607","o609","10.1107/S1600536801009758","","","1.5418","CuKα","","0.0524","0.0519","","","","0.1475","","","","","","1.054","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200491","10.0991","0.0011","14.1486","0.0015","16.205","0.003","90","","100.85","0.01","90","","2274.1","0.6","298","2","298","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C23 H21 Cl3 Fe N2 O Pt -","- C23 H21 Cl3 Fe N2 O Pt -","- C92 H84 Cl12 Fe4 N8 O4 Pt4 -","4","1","NA6087","Blake, Alexander J.; Osborne, Anthony G.; Hollands, R. E.","Acetyl(2,2'-bipyridine)chloro(1,1'-dichloroferrocen-2-yl)methylplatinum(IV)","Acta Crystallographica Section E","2001","57","7","m313","m314","10.1107/S1600536801009862","","","0.71073","MoKα","","0.0936","0.0544","","","","0.135","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200492","9.482","0.001","9.859","0.001","10.324","0.002","74.995","0.002","74.022","0.002","85.559","0.003","896.2","0.2","120","","120","","","","","","","","","5","P -1","-P 1","2","[V^V^O(salen)(H~2~O)](NO~3~),0.76H~2~O","N,N'-ethylene-bis(salicylideneaminato-N,O oxovanadium(V) nitrate hydrate(0.76)","","- C16 H17.52 N3 O7.76 V -","- C16 H17.18 N3 O7.76 V -","- C32 H34.36 N6 O15.52 V2 -","2","1","NA6088","Peter Hald; Alan Hazell; Torben R. Jensen; Helle F. Jensen; Jens-Erik Jørgensen","Aqua[<i>N</i>,<i>N</i>'-ethylenebis(salicylideneaminato-<i>N</i>,<i>O</i>)]oxovanadium(V) nitrate 0.76-hydrate","Acta Crystallographica Section E","2001","57","7","m310","m312","10.1107/S1600536801009850","","","0.71073","MoKα","","","0.036","","","","0.04","","","","","","0.97","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2200493","7.654","0.003","8.972","0.004","9.132","0.005","93.34","0.04","102.63","0.04","107.79","0.04","577.4","0.5","150","2","150","2","","","","","","","","6","P -1","-P 1","2","Bis([9]aneS~3~)nickel(II) dibromide tetrahydrate","Bis(1,4,7-trithiacyclononane-S,S',S"")nickel(II) dibromide tetrahydrate","","- C12 H32 Br2 Ni O4 S6 -","- C12 H32 Br2 Ni O4 S6 -","- C12 H32 Br2 Ni O4 S6 -","1","0.5","NA6089","Blake, Alexander J.; Brooks, Neil R.; Champness, Neil R.; Hubberstey, Peter; Keppie, Ian J.; Schröder, Martin; Marr, Andrew C.","Bis(1,4,7-trithiacyclononane-<i>S</i>,<i>S</i>',<i>S</i>'')nickel(II) dibromide tetrahydrate","Acta Crystallographica Section E","2001","57","8","m376","m377","10.1107/S1600536801011187","","","0.71073","MoKα","","0.0446","0.0376","","","","0.0915","","","","","","1.089","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200494","13.259","0.005","14.383","0.004","15.635","0.004","90","","90","","90","","2981.7","1.6","150","2","150","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H14 Cl4 O2 -","- C14 H14 Cl4 O2 -","- C112 H112 Cl32 O16 -","8","1","NA6090","Blake, Alexander J.; Dietel, Anja; Li, Wan-Sheung; Thomas, Neil R.; Marr, Andrew C.","1,2,3,4-Tetrachloro-11,11-dimethoxy-1,4,5,6,9,10-hexahydro-<i>endo</i>-1,4-<i>exo</i>-6,9-dimethanonaphthalene","Acta Crystallographica Section E","2001","57","8","o790","o791","10.1107/S1600536801011564","","","0.71073","MoKα","","0.044","0.035","","","","0.082","","","","","","1.19","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200495","9.5802","0.0012","10.692","0.0013","12.2069","0.0011","112.203","0.003","101.145","0.005","90.376","0.003","1131.5","0.2","301","2","","","","","","","","","","6","P -1","-P 1","2","","","","- C44 H52 Cu N6 Ni2 O10 -","- C44 H52 Cu N6 Ni2 O10 -","- C44 H52 Cu N6 Ni2 O10 -","1","0.5","OB6038","Arıcı, Cengiz; Ülkü, Dinçer; Tahir, M. Nawaz; Atakol, Orhan","Bis{(μ-acetato)(<i>N</i>,<i>N</i>'-dimethylformamide)[μ-bis(salicylidene)-1,3-propanediaminato]nickel(II)}copper(II)","Acta Crystallographica Section E","2001","57","7","m283","m285","10.1107/S160053680100753X","","","0.71073","MoKα","","","0.032","","","","0.085","","","","","","0.93","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200496","6.7899","0.0017","8.071","0.002","16.152","0.004","90","","94.76","0.005","90","","882.1","0.4","293","2","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(1,4-diazacycloheptane-N,N')nickel(II) diperchlorate","","- C10 H24 Cl2 N4 Ni O8 -","- C10 H24 Cl2 N4 Ni O8 -","- C20 H48 Cl4 N8 Ni2 O16 -","2","0.5","OB6042","Ya-Mei Guo; Miao Du; Xian-He Bu","Bis(1,4-diazacycloheptane-<i>N</i>,<i>N</i>')nickel(II) diperchlorate","Acta Crystallographica Section E","2001","57","7","m280","m282","10.1107/S1600536801008030","","","0.71073","MoKα","","0.091","0.0511","","","","0.1411","","","","","","0.982","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200497","7.2978","0.0003","14.9895","0.0005","19.6091","0.0006","90","","91.042","0.001","90","","2144.69","0.13","296","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H13 Cl2 N6 -","- C25 H13 Cl2 N6 -","- C100 H52 Cl8 N24 -","4","1","OB6044","Kazumasa Ueda; Toyonari Sugimoto; Tomoyuki Mochida","<i>N</i>-Methylphenazinium 2,5-dichloro-7,7',8,8'-tetracyanoquinodimethanide","Acta Crystallographica Section E","2001","57","7","o578","o580","10.1107/S1600536801008753","","","0.7107","MoKα","","","0.0419","","","","0.1219","","","","","","1.316","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200498","10.2233","0.0003","6.3323","0.0003","13.5389","0.0006","90","","107.587","0.002","90","","835.5","0.06","297","2","297","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Piperazine dihydrochloride monohydrate","","- C4 H14 Cl2 N2 O -","- C4 H14 Cl2 N2 O -","- C16 H56 Cl8 N8 O4 -","4","0.5","OB6045","Dehghanpour, Saeed; Mahmoudkhani, Amir H.; Langer, Vratislav","Redetermination of piperazine dihydrochloride monohydrate","Acta Crystallographica Section E","2001","57","7","o610","o611","10.1107/S1600536801009771","","","0.71073","MoKα","","0.0845","0.0518","","","","0.1489","","","","","","1.017","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200499","10.799","0.003","12.113","0.004","13.775","0.004","104.47","0.04","99.4","0.03","101.26","0.05","1667.9","1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","trans-5,6a-Dihydro-5-phenylisoindolo[1,2-b]benz[1,3]oxazepin-11-one","","- C22 H17 N O2 -","- C22 H17 N O2 -","- C88 H68 N4 O8 -","4","2","OB6046","Viktor Kettmann; Jan Lokaj; Christoph Kratky; Stefan Marchalin; Jana Sikoraiova","<i>trans</i>-5,6a-Dihydro-5-phenylisoindolo[1,2-<i>b</i>]benz[1,3]oxazepin-11-one","Acta Crystallographica Section E","2001","57","7","o612","o614","10.1107/S1600536801009898","","","0.71073","MoKα","","0.0999","0.0736","","","","0.1939","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200500","23.096","0.004","6.281","0.009","11.648","0.001","90","","116.122","0.009","90","","1517","2","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","Bis(L-threoninium)sulfate monohydrate","Bis(L-threoninium) sulfate monohydrate","","- C8 H22 N2 O11 S -","- C8 H22 N2 O11 S -","- C32 H88 N8 O44 S4 -","4","1","OB6047","Sridhar, B.; Srinivasan, N.; Rajaram, R. K.","Bis(<small>L</small>-threoninium) sulfate monohydrate","Acta Crystallographica Section E","2001","57","7","o581","o583","10.1107/S1600536801008960","","","0.71073","MoKα","","0.0336","0.0322","","","","0.0936","","","","","","0.983","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200501","16.774","0.004","5.9697","0.0009","14.5276","0.0018","90","","98.66","0.02","90","","1438.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Bis(DL-aspartic acid) sulfate","Bis(DL-aspartic acid) sulfate","","- C8 H16 N2 O12 S -","- C8 H16 N2 O12 S -","- C32 H64 N8 O48 S4 -","4","1","OB6050","Srinivasan, N.; Sridhar, B.; Rajaram, R. K.","Bis(<small>DL</small>-aspartic acid) sulfate","Acta Crystallographica Section E","2001","57","8","o679","o681","10.1107/S1600536801010054","","","0.71069","MoKα","","0.0447","0.0355","","","","0.1073","","","","","","0.814","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200502","27.0286","0.0004","27.0286","0.0004","13.6117","0.0005","90","","90","","90","","9944","0.4","293","2","293","2","","","","","","","","3","I 41/a :2","-I 4ad","88","6-(p-methly-benzly)6H-perchlorobenzo[cd]pyrene","","","- C26 H8 Cl10 -","- C26 H8 Cl10 -","- C416 H128 Cl160 -","16","1","OB6051","Yin Peng; Su-yuan Xie; Rong-bin Huang; Lan-sun Zheng","6-(<i>p</i>-Tolyl)-6<i>H</i>-perchlorobenzo[<i>cd</i>]pyrene","Acta Crystallographica Section E","2001","57","7","o617","o618","10.1107/S1600536801010066","","","0.71073","MoKα","","0.1717","0.0659","","","","0.1245","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200503","10.7493","0.0002","15.2255","0.0001","10.7828","0.0002","90","","93.84","0.001","90","","1760.79","0.05","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Di-4,4'-bipridine Hexacosaoxooctamolybdate","","- C20 H20 Mo8 N4 O26 -","- C20 H20 Mo8 N4 O26 -","- C40 H40 Mo16 N8 O52 -","2","0.5","OB6052","Chuan-De Wu; Can-Zhong Lu; Hong-Hui Zhuang; Jin-Shun Huang","Bis[4,4'-bipyridinium(2+)] hexacosaoxooctamolybdate","Acta Crystallographica Section E","2001","57","8","m349","m351","10.1107/S1600536801010546","","","0.71073","MoKα","","","0.0215","","","","0.054","","","","","","1.091","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200504","10.474","0.001","30.475","0.002","10.572","0.001","90","","111.54","0.01","90","","3138.9","0.5","293","2","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H40 Cl2 N8 Ni O8 -","- C24 H40 Cl2 N8 Ni O8 -","- C96 H160 Cl8 N32 Ni4 O32 -","4","1","OB6053","Daly, Robert I.; Taylor, Max R.; Martin, Lisandra L.","Acetonitrile{<i>N</i>-[2-(4,7-dimethyl-1,4,7-triazacyclonon-1-yl)ethyl]-<i>N</i>-[(1-methylbenzimidazol-2-yl)methyl]methylamine}nickel(II) bis(perchlorate) acetonitrile solvate","Acta Crystallographica Section E","2001","57","7","m315","m317","10.1107/S1600536801009837","","","0.71073","MoKα","","0.078","0.053","","0.132","","0.118","","","1.649","","","1.63","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2200505","6.0475","0.001","25.808","0.004","8.6101","0.001","90","","101.853","0.011","90","","1315.2","0.3","299","","299","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H13 Cl N2 O5 -","- C11 H13 Cl N2 O5 -","- C44 H52 Cl4 N8 O20 -","4","1","OB6054","Hiroyuki Ishida; Bilkish Rahman; Setsuo Kashino","Morpholinium 4-chloro-2-nitrobenzoate","Acta Crystallographica Section E","2001","57","7","o627","o629","10.1107/S1600536801009941","","","0.71073","MoKα","","0.064","0.05","","0.115","","0.098","","","1.19","","","1.19","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2200506","10.6482","0.0015","5.9079","0.0012","21.084","0.003","90","","102.722","0.01","90","","1293.8","0.4","298","","298","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H13 Cl N2 O5 -","- C11 H13 Cl N2 O5 -","- C44 H52 Cl4 N8 O20 -","4","1","OB6055","Hiroyuki Ishida; Bilkish Rahman; Setsuo Kashino","Morpholinium 5-chloro-2-nitrobenzoate","Acta Crystallographica Section E","2001","57","7","o630","o632","10.1107/S1600536801009953","","","0.71073","MoKα","","0.077","0.057","","0.109","","0.09","","","1.14","","","1.14","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200507","5.6304","0.0015","7.2353","0.0015","19.597","0.003","90","","90","","90","","798.3","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","L-alaninium oxalate","","- C5 H9 N O6 -","- C5 H9 N O6 -","- C20 H36 N4 O24 -","4","1","OB6056","Subha Nandhini, M.; Krishnakumar, R. V.; S. Natarajan","<small>L</small>-Alaninium oxalate","Acta Crystallographica Section E","2001","57","7","o633","o635","10.1107/S1600536801010042","","","1.5418","CuKα","","0.0312","0.0304","","","","0.0826","","","","","","1.092","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200508","14.446","0.003","3.963","0.001","17.807","0.007","90","","98.59","0.02","90","","1008","0.5","298","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C12 H7 Br N2 O -","- C12 H7 Br N2 O -","- C48 H28 Br4 N8 O4 -","4","1","OB6057","Hökelek, Tuncer; Kılıç, Emine; Dinçer, Sebla","2-Bromobenzo[<i>c</i>]cinnoline 6-oxide","Acta Crystallographica Section E","2001","57","7","o645","o647","10.1107/S1600536801010236","","","0.71073","MoKα","","","0.058","","","","0.051","","","","","","1.12","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200509","9.3189","0.0002","11.6565","0.0003","12.059","0.0001","80.845","0.001","86.638","0.001","89.051","0.001","1290.97","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","C26 H32 Cd0.50 N5 O5","trans-Diaquatetrakis(4,4'-methylenediphenylamine-N)cadmium(II) dinitrate dihydrate","","- C52 H64 Cd N10 O10 -","- C52 H64 Cd N10 O10 -","- C52 H64 Cd N10 O10 -","1","0.5","OB6060","Wang, Ruihu; Hong, Maochun; Weng, Jiabao; Cao, Rong; Liang, Yucang; Zhao, Yingjun","<i>trans</i>-Diaquatetrakis(4,4'-methylenediphenylamine-<i>N</i>)cadmium(II) dinitrate dihydrate","Acta Crystallographica Section E","2001","57","8","m344","m345","10.1107/S1600536801011072","","","0.71073","MoKα","","0.0588","0.0442","","","","0.1259","","","","","","1.098","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200510","10.0948","0.001","11.2408","0.001","14.055","0.003","85.524","0.011","71.679","0.011","89.852","0.014","1509","0.4","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","2-[[2-[2-[2-[2-[2-(2-Hydroxyethoxy)phenoxy]ethoxy]phenoxy]ethoxy] phenoxy]methyl]benzoato-aquarubidium monohydrate","","- C32 H35 O11 Rb -","- C32 H35 O11 Rb -","- C64 H70 O22 Rb2 -","2","1","OB6061","Kasuga, N. C.; Kanda, Ryu-suke; Yamaguchi, Kazuo; Shiro, Motoo","The rubidium salt of an ω-hydroxycarboxylic acid with six ethereal O atoms","Acta Crystallographica Section E","2001","57","9","m410","m412","10.1107/S1600536801014076","","","0.71069","MoKα","","0.074","0.0397","","","","0.1148","","","","","","0.936","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200511","7.2643","0.0004","10.6393","0.0006","15.6331","0.0013","90","","90","","90","","1208.24","0.14","296","","296","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","7-β-bromo-(-)-camphorsulfonimide","[3aS-(3aα,6α,7β)]-7-bromo-4,5,6,7-tetrahydro-8,8-dimethyl- 3H-3a,6-methano-2,1-benzisothiazole-2,2-dioxide","","- C10 H14 Br N O2 S -","- C10 H14 Br N O2 S -","- C40 H56 Br4 N4 O8 S4 -","4","1","OB6062","Fronczek, Frank R.; Garcia, J. Gabriel","(7-<i>endo</i>-Bromocamphorylsulfonyl)imine","Acta Crystallographica Section E","2001","57","9","o886","o887","10.1107/S1600536801013824","","","1.5418","CuKα","","0.061","0.057","","","","0.162","","","","","","1.152","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200512","4.9846","0.0002","20.604","0.002","20.663","0.002","90","","90","","90","","2122.1","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Bis( L-Lysinium(+)) hydrogen dichloride nitrate","Bis( L-Lysinium(+)) hydrogen dichloride nitrate","","- C12 H31 Cl2 N5 O7 -","- C12 H31 Cl2 N5 O7 -","- C48 H124 Cl8 N20 O28 -","4","1","OB6065","Srinivasan, N.; Sridhar, B.; Rajaram, R. K.","<small>L</small>-Lysine <small>L</small>-lysinium dichloride nitrate","Acta Crystallographica Section E","2001","57","9","o888","o890","10.1107/S1600536801014040","","","0.7107","MoKα","","0.1185","0.0616","","","","0.1897","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200513","9.773","0.001","17.404","0.002","7.44","0.001","90","","90","","90","","1265.5","0.3","295","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C12 H8 Cu N4 O4 -","- C12 H8 Cu N4 O4 -","- C48 H32 Cu4 N16 O16 -","4","0.5","OM6023","Breneman, Gary L.; Howald, Carl W.; Parker, O. Jerry","Second crystal form of dinitrito(1,10-phenanthroline)copper(II)","Acta Crystallographica Section E","2001","57","7","m286","m287","10.1107/S1600536801007863","","","0.71073","MoKα","","","0.0369","","","","0.109","","","","","","1.154","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200514","21.134","0.002","6.2537","0.0011","7.979","0.002","90","","90","","90","","1054.6","0.3","296","","296","","","","","","","","","5","P n a 21","P 2c -2n","33","","α-bromoisopropyl phenyl sulfone","","- C9 H11 Br O2 S -","- C9 H11 Br O2 S -","- C36 H44 Br4 O8 S4 -","4","1","OM6024","Robinson, Paul D.; Parady, Thomas E.; Hou, Yuqing; Meyers, Cal Y.","2-Bromo-2-propyl phenyl sulfone","Acta Crystallographica Section E","2001","57","7","o584","o586","10.1107/S1600536801007516","","","0.71069","MoKα","","0.073","0.034","","","","0.094","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200515","9.237","0.002","9.4592","0.0013","8.2079","0.0006","99.333","0.009","93.671","0.011","66.342","0.014","648.19","0.19","296","","296","","","","","","","","","5","P -1","-P 1","2","","α-chloroisopropyl mesityl sulfone","","- C12 H17 Cl O2 S -","- C12 H17 Cl0.998 O2 S -","- C24 H34 Cl1.996 O4 S2 -","2","1","OM6025","Meyers, Cal Y.; Hua, Duy H.; Hou, Yuqing; Robinson, Paul D.","2-Chloro-2-propyl mesityl sulfone","Acta Crystallographica Section E","2001","57","7","o587","o589","10.1107/S1600536801007528","","","0.71069","MoKα","","0.055","0.04","","","","0.121","","","","","","1.059","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2200516","8.027","0.0008","8.0435","0.0008","13.8493","0.0013","82.232","0.002","82.359","0.002","62.242","0.002","781.52","0.13","174","2","174","2","","","","","","","","5","P -1","-P 1","2","","2-fluoro-6-iodobenzonitrile","","- C7 H3 F I N -","- C7 H3 F I N -","- C28 H12 F4 I4 N4 -","4","2","OM6026","Britton, Doyle","2-Fluoro-6-iodobenzonitrile","Acta Crystallographica Section E","2001","57","8","o702","o704","10.1107/S1600536801010923","","","0.71073","MoKα","","0.0485","0.0433","","","","0.1093","","","","","","0.984","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200517","9.317","0.004","10.713","0.005","12.797","0.006","104.99","0.02","93.03","0.03","103.46","0.02","1191.2","1","295","","","","","","","","","","","6","P -1","-P 1","2","","","","- C17 H16 Cu N4 O4 S4 -","- C17 H16 Cu N4 O4 S4 -","- C34 H32 Cu2 N8 O8 S8 -","2","1","OM6029","Breneman, Gary L.; Aubol, Sheryl L.; Parker, O. Jerry","Diisothiocyanato[di(2-pyridyl)methanediol]copper(II) bis(dimethyl sulfoxide), [Cu(NCS)~2~(dpydiol)]·2DMSO","Acta Crystallographica Section E","2001","57","7","m288","m290","10.1107/S1600536801008534","","","0.71073","MoKα","","","0.0566","","","","0.152","","","","","","1.069","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200518","18.358","0.001","6.621","0.002","8.356","0.003","90","","90","","90","","1015.7","0.5","144","1","144","1","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C12 H9 Cl O2 -","- C12 H9 Cl O2 -","- C48 H36 Cl4 O8 -","4","1","OM6031","Lehmler, Hans-Joachim; Robertson, Larry W.; Parkin, Sean","4-Chloro-3',4'-dihydroxybiphenyl","Acta Crystallographica Section E","2001","57","7","o590","o591","10.1107/S1600536801008844","","","0.71073","MoKα","","0.0464","0.0356","","","","0.0746","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200519","6.7683","0.0005","7.4976","0.0007","14.4864","0.0002","87.92","0.01","90.77","0.01","114.18","0.01","670.19","0.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H11 N3 O7 -","- C12 H11 N3 O7 -","- C24 H22 N6 O14 -","2","1","OM6032","Moreno-Fuquen, Rodolfo; Cano, Felix; Martinez-Ripoll, Martin; Montaño, Angela; Zukerman-Schpector, Julio","1:1 Complex of 2,4-dinitrophenol and 4-methoxypyridine <i>N</i>-oxide hydrate","Acta Crystallographica Section E","2001","57","8","o712","o714","10.1107/S1600536801010790","","","1.5418","CuKα","","0.0483","0.0445","","","","0.132","","","","","","1.138","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200520","21.148","0.0017","8.5399","0.0011","9.4229","0.001","90","","100.524","0.007","90","","1673.2","0.3","100","1","100","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4,5,7,8-Tetrahydro-2-(2-Propenyl)-6H-[1,3,6,2]-dioxazaborocine","","- C7 H14 B N O2 -","- C7 H14 B N O2 -","- C56 H112 B8 N8 O16 -","8","1","OM6035","Thadani, Avinash N.; Batey, Robert A.; Lough, Alan J.","4,5,7,8-Tetrahydro-2-(2-propenyl)-6<i>H</i>-[1,3,6,2]dioxazaborocine","Acta Crystallographica Section E","2001","57","8","o762","o763","10.1107/S1600536801011679","","","0.71073","MoKα","","0.1201","0.063","","","","0.176","","","","","","0.987","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200521","23.63","0.005","5.582","0.002","18.004","0.006","90","","95.04","0.02","90","","2365.6","1.3","298","","298","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C15 H12 O3 -","- C15 H12 O3 -","- C120 H96 O24 -","8","1","OM6036","Kashino, Setsuo; Tanaka, Mitsuru; Todorov, Todor Dimitrov","2,2'-Dihydroxychalcone","Acta Crystallographica Section E","2001","57","8","o735","o737","10.1107/S1600536801011898","","","0.71073","MoKα","","0.052","0.048","","","","0.129","","","","","","1.17","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200522","8.6623","0.0008","18.1338","0.0013","9.8554","0.0009","90","","105.68","0.08","90","","1490.5","0.6","100","","100","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","5,17-di-tert-butyl-25,27-dihydroxy-calix[4]arene","","","- C38 H44 O2 -","- C38 H44 O2 -","- C76 H88 O4 -","2","0.5","OM6037","Jeffrey C. Bryan; Richard A. Sachleben; Agathe Urvoas","5,17-Di-<i>tert</i>-butyl-25,27-dihydroxycalix[4]arene","Acta Crystallographica Section E","2001","57","8","o781","o782","10.1107/S160053680101220X","","","0.71073","MoKα","","0.056","0.039","","","","0.108","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200523","27.726","0.003","12.412","0.002","16.087","0.003","90","","110.46","0.02","90","","5186.9","1.6","213","2","213","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Me~2~Ph~2~C~2~(ν^5^-C~5~H~4~)~2~Ca(DME)","","","- C30 H34 Ca O2 -","- C30 H34 Ca O2 -","- C240 H272 Ca8 O16 -","8","1","OM6038","Twamley, Brendan; Matare, Gilbert J.; Shapiro, Pamela J.; Vij, Ashwani","ansa-Calcocenes: <i>trans</i>-Ph~2~(CH~3~)~2~C~2~(η^5^-C~5~H~4~)~2~Ca(DME)","Acta Crystallographica Section E","2001","57","9","m402","m403","10.1107/S1600536801013265","","","0.71073","MoKα","","0.067","0.062","","","","0.117","","","","","","1.29","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200524","16.5784","0.0011","7.1077","0.0005","12.1751","0.0008","90","","95.475","0.002","90","","1428.1","0.17","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","3-Pyridylmethyl urea dihydrate","","","- C13 H18 N4 O3 -","- C13 H18 N4 O3 -","- C52 H72 N16 O12 -","4","0.5","OM6039","Harrison, William T. A.","3-Pyridylmethyl urea dihydrate","Acta Crystallographica Section E","2001","57","8","o783","o785","10.1107/S1600536801012211","","","0.71073","MoKα","","0.037","0.03","","","","0.09","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200525","5.5873","0.0011","7.3864","0.0017","23.688","0.003","90","","90","","90","","977.6","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","L-alaninium maleate","","- C7 H11 N O6 -","- C7 H11 N O6 -","- C28 H44 N4 O24 -","4","1","OM6040","Alagar, M.; Krishnakumar, R. V.; Subha Nandhini, M.; Natarajan, S.","<small>L</small>-Alaninium maleate","Acta Crystallographica Section E","2001","57","9","o855","o857","10.1107/S1600536801013149","","","1.5418","CuKα","","0.0371","0.0354","","","","0.106","","","","","","1.1","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200526","17.501","0.004","18.875","0.005","14.999","0.004","113.137","0.019","101.89","0.02","74.3","0.02","4358","2","296","","296","","","","","","","","","6","P -1","-P 1","2","","2,4,6-Tris(1'-phenylthio-1-ferrocenyl)boroxin","","- C48 H39 B3 Fe3 O3 S3 -","- C48 H39 B3 Fe3 O3 S3 -","- C192 H156 B12 Fe12 O12 S12 -","4","2","OM6042","Hua, Duy H.; McGill, James W.; Robinson, Paul D.; Meyers, Cal Y.","2,4,6-Tris(1'-phenylthio-1-ferrocenyl)boroxin","Acta Crystallographica Section E","2001","57","9","m413","m415","10.1107/S1600536801013988","","","0.71069","MoKα","","0.265","0.047","","","","0.158","","","","","","0.934","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200527","6.7249","0.0005","9.979","0.002","11.1574","0.001","90","","90","","90","","748.75","0.17","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C4 H4 N4 O7 -","- C4 H4 N4 O7 -","- C16 H16 N16 O28 -","4","1","OM6043","Gilardi, Richard D.; Butcher, Ray J.","6,8-Dinitro-2,4-dioxa-6,8-diazabicyclo[3.3.0]octan-3-one","Acta Crystallographica Section E","2001","57","9","o891","o892","10.1107/S1600536801013915","","","0.71073","MoKα","","0.0413","0.0333","","","","0.0923","","","","","","1.065","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200528","6.1295","0.0006","7.8227","0.0006","8.3961","0.0008","113.592","0.007","93.831","0.004","95.557","0.004","364.74","0.06","150","2","150","2","","","","","","","","4","P -1","-P 1","2","Ethyl 2-aminooxazole-5-carboxylate","","","- C6 H8 N2 O3 -","- C6 H8 N2 O3 -","- C12 H16 N4 O6 -","2","1","OM6045","Kennedy, Alan R.; Khalaf, Abedawn I.; Suckling, Colin J.; Waigh, Roger D.","Ethyl 2-aminooxazole-5-carboxylate","Acta Crystallographica Section E","2001","57","9","o832","o833","10.1107/S1600536801013058","","","0.71073","MoKα","","0.0847","0.05","","","","0.1264","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200529","3.9758","0.0007","22.489","0.004","9.7419","0.0016","90","","99.255","0.003","90","","859.7","0.3","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4'-fluoro-2'-nitroacetanilide","","- C8 H7 F N2 O3 -","- C8 H7 F N2 O3 -","- C32 H28 F4 N8 O12 -","4","1","TK6018","Qi, Jianying; Zhou, Zhongyuan; Liu, Dongsheng; Chan, Albert S. C.","4'-Fluoro-2'-nitroacetanilide","Acta Crystallographica Section E","2001","57","8","o675","o676","10.1107/S1600536801010704","","","0.71073","MoKα","","0.075","0.05","","","","0.168","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200530","4.7103","0.0008","11.684","0.002","21.352","0.004","90","","90.043","0.003","90","","1175.1","0.4","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","6-methylflavone","","","- C16 H12 O2 -","- C16 H12 O2 -","- C64 H48 O8 -","4","1","TK6019","Hall, Belinda J.; Hanrahan, Jane R.; Johnston, Graham A. R.; Hambley, Trevor W.; Hibbs, David E.","6-Methylflavone","Acta Crystallographica Section E","2001","57","7","o592","o593","10.1107/S1600536801008571","","","0.71073","MoKα","","0.085","0.045","","","","0.127","","","","","","0.934","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200531","10.0236","0.0009","9.098","0.003","10.357","0.001","90","","90","","90","","944.5","0.3","273","","","","","","","","","","","5","C m c m","-C 2c 2","63","","","","- Cl2 Cr H15 N6 O -","- Cl Cr0.25 H12.5 N2.5 O0.25 -","- Cl4 Cr H50 N10 O -","4","0.25","TK6023","Akashi, Haruo; Mori, Masayasu; Shibahara, Takashi","Pentaamminenitrosylchromium(III) dichloride","Acta Crystallographica Section E","2001","57","9","i75","i76","10.1107/S1600536801012983","","","0.7107","MoKα","","","0.044","","","","0.117","","","","","","0.83","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200532","9.3364","0.0009","20.948","0.002","9.6251","0.0009","90","","117.425","0.002","90","","1670.9","0.3","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","trans-Tetrachloro-bis(triphenylphosphine)osmium(IV)","","- C36 H30 Cl4 Os P2 -","- C36 H30 Cl4 Os P2 -","- C72 H60 Cl8 Os2 P4 -","2","0.5","TK6024","Li, Zhengkai; Zhou, Zhongyuan","<i>trans</i>-Tetrachlorobis(triphenylphosphine)osmium(IV)","Acta Crystallographica Section E","2001","57","7","m291","m292","10.1107/S1600536801008698","","","0.71073","MoKα","","0.046","0.032","","","","0.078","","","","","","0.98","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200533","10.874","0.004","13.517","0.005","12.057","0.004","90","","101.717","0.005","90","","1735.3","1.1","168","2","168","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C15 H17 Cl2 N O2 S Ti -","- C15 H17 Cl2 N O2 S Ti -","- C60 H68 Cl8 N4 O8 S4 Ti4 -","4","1","TK6025","Lensink, Cornelis; Gainsford, Graeme J.; Hosie, Camila F.","Dichloro{η^5^:η^1^-[2-(<i>p</i>-tolylsulfonamido)prop-1-yl]cyclopentadienyl}titanium","Acta Crystallographica Section E","2001","57","7","m293","m294","10.1107/S1600536801008856","","","0.71073","MoKα","","0.111","0.056","","","","0.132","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200534","13.7198","0.0001","15.3812","0.0002","13.8702","0.0002","90","","110.387","0.0005","90","","2743.64","0.06","150","2","150","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Dichloro[N,N'-bis(2,6-diisopropylphenyl)-1,2-ethanediimine-N,N']palladium","","- C26 H36 Cl2 N2 Pd -","- C26 H36 Cl2 N2 Pd -","- C104 H144 Cl8 N8 Pd4 -","4","1","TK6026","Comerlato, Nadia M.; Crossetti, Geraldo L.; Howie, R. Alan; Tibultino, Pollyanna C.D.; Wardell, James L.","Dichloro[<i>N</i>,<i>N</i>'-bis(2,6-diisopropylphenyl)-1,2-ethanediimine-<i>N</i>,<i>N</i>']palladium","Acta Crystallographica Section E","2001","57","7","m295","m297","10.1107/S1600536801008704","","","0.71073","MoKα","","0.037","0.029","","","","0.075","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200535","5.2472","0.0001","5.2528","0.0001","58.726","0.001","90","","92.543","0.001","90","","1617.04","0.05","153","2","153","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C19 H18 O4 -","- C19 H18 O4 -","- C76 H72 O16 -","4","2","TK6027","Deschamps, Jeffrey R.; George, Clifford; Flippen-Anderson, Judith L.; Spencer, Gayland","A new <i>Cryptocarya</i> lactone","Acta Crystallographica Section E","2001","57","7","o648","o649","10.1107/S1600536801010273","","","1.54178","CuKα","","0.057","0.057","","","","0.164","","","","","","0.99","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200536","14.6546","0.0005","14.7082","0.0005","20.3235","0.0007","90","","103.789","0.001","90","","4254.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H48 Co4 O16 -","- C36 H48 Co4 O16 -","- C144 H192 Co16 O64 -","4","1","","Wang, Ruihu; Hong, Maochun; Su, Weiping; Cao, Rong","Tetra-μ~3~-methanolato-tetrakis[(2-formylphenolato-O)(methanol-O)cobalt(II)]","Acta Crystallographica, Section E","2001","57","","m325","m665","10.1107/S1600536801010479","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2200537","11.821","0.002","10.7618","0.0018","6.3146","0.0011","90","","101.86","0.014","90","","786.2","0.2","295","2","295","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","Racemic 6-exo-hydroxybicyclo[2.2.1]heptane-2-exo-carboxylic acid","Racemic 6-exo-hydroxybicyclo[2.2.1]heptane-2-exo-carboxylic acid","","- C8 H12 O3 -","- C8 H12 O3 -","- C32 H48 O12 -","4","1","TK6030","Smith, Graham; Bott, Raymond C.; Jenkins, Ian D.; Wermuth, Urs D.","Racemic 6-<i>exo</i>-hydroxybicyclo[2.2.1]heptane-2-<i>exo</i>-carboxylic acid","Acta Crystallographica Section E","2001","57","8","o788","o789","10.1107/S1600536801012223","","","0.71069","MoKα","","0.076","0.043","","","","0.132","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200538","14.325","0.004","8.536","0.008","11.513","0.004","90","","91.56","0.02","90","","1407.3","1.5","295","","295","2","","","","","","","","4","C 1 c 1","C -2yc","9","","5-acetamido-1,1,3,3-tetramethylisoindolin-2-yloxyl","","- C14 H19 N2 O2 -","- C14 H19 N2 O2 -","- C56 H76 N8 O8 -","4","1","TK6031","Graham Smith; Steven E. Bottle; Damien A. Reid; Raymond C. Bott","An isoindoline EPR label: 5-acetamido-1,1,3,3-tetramethylisoindolin-2-yloxyl","Acta Crystallographica Section E","2001","57","8","o786","o787","10.1107/S1600536801010716","","","0.71069","MoKα","","0.113","0.039","","","","0.125","","","","","","1.03","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2200539","11.3122","0.0007","16.2035","0.0009","14.2663","0.0008","90","","104.046","0.01","90","","2536.8","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","carbonyl(tropolonato)(ferrocenyldiphenylphosphine)rhodium(I)","","- C30 H24 Fe O3 P Rh -","- C30 H24 Fe O3 P Rh -","- C120 H96 Fe4 O12 P4 Rh4 -","4","1","TK6032","Steyl, Gideon; Otto, Stefanus; Roodt, Andreas","Carbonyl(ferrocenyldiphenylphosphine)(tropolonato)rhodium(I)","Acta Crystallographica Section E","2001","57","8","m352","m354","10.1107/S1600536801011448","","","0.71073","MoKα","","0.036","0.026","","","","0.062","","","","","","1.08","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2200540","6.94","0.001","10.351","0.002","10.857","0.002","69.72","0.03","81.28","0.03","75.75","0.03","707.2","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","μ-Succinato-bis[aquanitrato(1,10-phenanthroline)copper(II)]","","- C28 H24 Cu2 N6 O12 -","- C28 H24 Cu2 N6 O12 -","- C28 H24 Cu2 N6 O12 -","1","0.5","TK6033","Long, La-Sheng; Wang, Peng-Ju; Chen, Xiao-Yun; Fang, Xue-Ming; Ng, Seik Weng","μ-Succinato-bis[aquanitrato(1,10-phenanthroline)copper(II)]","Acta Crystallographica Section E","2001","57","8","m328","m330","10.1107/S1600536801010571","","","0.71073","MoKα","","0.071","0.053","","","","0.124","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200541","7.212","0.003","10.139","0.003","11.337","0.005","73.67","0.03","82.67","0.03","85.04","0.03","787.9","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H12 Cu N2 O10 -","- C14 H12 Cu N2 O10 -","- C28 H24 Cu2 N4 O20 -","2","1","WN6019","Liang, Yucang; Hong, Maochun; Cao, Rong; Shi, Qian","Bis(pyridine-2,4-dicarboxylato)copper(II) dihydrate","Acta Crystallographica Section E","2001","57","8","m380","m381","10.1107/S1600536801011333","","","0.71073","MoKα","","","0.0355","","","","0.0978","","","","","","1.04","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2200542","14.8323","0.0007","14.8323","0.0007","30.0976","0.001","90","","90","","90","","6621.4","0.5","230","2","230","2","","","","","","","","4","I 41/a c d :2","-I 4bd 2c","142","Methylzinc tert-butoxide, thf solvate","tetra-μ~3~-tert-butoxo-tetrakis(methylzinc) tetrahydrofuran solvate","","- C24 H56 O5 Zn4 -","- C24 H56 O5 Zn4 -","- C192 H448 O40 Zn32 -","8","0.25","WN6021","Bond, Andrew D.; Linton, David J.; Wheatley, Andrew E. H.","Methylzinc <i>tert</i>-butoxide tetrahydrofuran solvate","Acta Crystallographica Section E","2001","57","7","m298","m300","10.1107/S1600536801009667","","","0.71073","MoKα","","0.0587","0.0389","","","","0.1097","","","","","","1.077","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200543","5.929","0.002","14.133","0.002","10.3892","0.0012","90","","95.065","0.016","90","","867.2","0.3","273","1","273","1","","","","","","","","3","P 1 21 1","P 2yb","4","","[3E]-3-deoxy-3-C-ethoxycarbonylmethylene-1,2:5,6-di-O-isopropylidene- α-D-ribohexofuranose","","- C16 H24 O7 -","- C16 H24 O7 -","- C32 H48 O14 -","2","1","WN6022","Linden, Anthony; Lee, C. Kuan; Siew, Kum Fong","[3E]-3-Deoxy-3-<i>C</i>-ethoxycarbonylmethylene-1,2:5,6-di-<i>O</i>-isopropylidene-α-<small>D</small>-ribohexofuranose","Acta Crystallographica Section E","2001","57","7","o594","o595","10.1107/S1600536801009710","","","0.71069","MoKα","","0.1424","0.0638","","","","0.2001","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200544","5.7499","0.0002","18.097","0.0011","16.0028","0.0008","90","","91.421","0.003","90","","1664.67","0.14","180","2","180","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","3-(phenylpropyl)diphenylphosphine","Diphenyl(3-phenylpropyl)phosphine","","- C21 H21 P -","- C21 H21 P -","- C84 H84 P4 -","4","1","WN6023","Bond, Andrew D.; Brown, David B.; Harper, Joanne R.; Johnson, Brian F. G.","Diphenyl(3-phenylpropyl)phosphine","Acta Crystallographica Section E","2001","57","7","o615","o616","10.1107/S1600536801009783","","","0.71073","MoKα","","0.0999","0.0515","","","","0.1531","","","","","","0.991","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200545","8.623","0.005","12.091","0.004","15.436","0.007","90","","100.59","0.04","90","","1582","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaquabis(pyridine-2,5-dicarboxylato)cobalt(II)","","- C14 H12 Co N2 O10 -","- C14 H12 Co N2 O10 -","- C56 H48 Co4 N8 O40 -","4","0.5","WN6024","Liang, Yucang; Cao, Rong; Hong, Maochun; Shi, Qian; Sun, Daofeng; Weng, Jiabao","Diaquabis(pyridine-2,5-dicarboxylato)cobalt(II)","Acta Crystallographica Section E","2001","57","8","m382","m383","10.1107/S1600536801011436","","","0.71073","MoKα","","0.0358","0.0293","","","","0.0775","","","","","","1.094","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2200546","29.332","0.003","3.8551","0.0002","11.0753","0.0011","90","","99.341","0.003","90","","1235.76","0.19","100","2","100","2","","","","","","","","4","C 1 2 1","C 2y","5","","2-(2-pyridyl)-4-methylcarboxyquinoline","","- C16 H12 N2 O2 -","- C16 H12 N2 O2 -","- C64 H48 N8 O8 -","4","1","WN6025","Farah, Abdiaziz A.; Pietro, William J.","Methyl 2-(2-pyridyl)quinoline-4-carboxylate","Acta Crystallographica Section E","2001","57","8","o677","o678","10.1107/S1600536801010595","","","0.71073","MoKα","","0.0494","0.0407","","","","0.1067","","","","","","0.887","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200547","6.879","0.002","29.563","0.009","8.511","0.003","90","","99.11","0.02","90","","1709","0.9","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","N-[(R)-3-methyl-2-butyl]-(S)-2-(6-methoxy-2-naphthyl)propionamide","","- C19 H25 N O2 -","- C19 H25 N O2 -","- C76 H100 N4 O8 -","4","2","WN6026","Dupont, Léon; Khelili, Smail; Pirotte, Bernard; Tinant, Bernard; de Tullio, Pascal","Absolute configuration of <i>N</i>-[(<i>R</i>)-3-methyl-2-butyl]-(<i>S</i>)-2-(6-methoxy-2-naphthyl)propionamide","Acta Crystallographica Section E","2001","57","7","o650","o651","10.1107/S1600536801010285","","","0.71069","MoKα","","0.0571","0.0531","","","","0.1495","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200548","16.181","0.002","11.625","0.002","7.938","0.003","90","","90","","90","","1493.2","0.6","296.2","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C8 H8 O4 -","- C8 H8 O4 -","- C64 H64 O32 -","8","1","WN6027","Okabe, Nobuo; Kyoyama, Hasuyo","3,4-Dihydroxyphenylacetic acid","Acta Crystallographica Section E","2001","57","8","o715","o716","10.1107/S1600536801011151","","","0.7107","MoKα","","","0.0511","","","","0.2202","","","","","","0.842","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200549","9.6233","0.0002","10.7356","0.0002","17.2999","0.0003","90","","91.624","0.001","90","","1786.57","0.06","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(N-methyl-N-phenylthiocarbamoyl) disulfide","","- C16 H16 N2 S4 -","- C16 H16 N2 S4 -","- C64 H64 N8 S16 -","4","1","WN6028","Hoong-Kun Fun; Suchada Chantrapromma; Ibrahim Abdul Razak; Fengli Bei; Fangfang Jian; Xujie Yang; Lude Lu; Xin Wang","Bis(<i>N</i>-methyl-<i>N</i>-phenylthiocarbamoyl) disulfide","Acta Crystallographica Section E","2001","57","8","o717","o718","10.1107/S1600536801011412","","","0.71073","MoKα","","0.1166","0.0708","","","","0.2157","","","","","","0.985","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200550","9.0136","0.0018","12.96","0.006","6.3936","0.0013","90","","100.77","0.03","90","","733.7","0.4","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2,6-diamino-3,5-dinitro-1,4-pyrazine","2,6-diamino-3,5-dinitro-1,4-pyrazine","","- C4 H4 N6 O4 -","- C4 H4 N6 O4 -","- C16 H16 N24 O16 -","4","1","WN6029","Gilardi, Richard D.; Butcher, Ray J.","2,6-Diamino-3,5-dinitropyrazine","Acta Crystallographica Section E","2001","57","8","o738","o740","10.1107/S1600536801011734","","","0.71073","MoKα","","0.0957","0.0642","","","","0.1868","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200551","5.7817","0.0005","8.1353","0.0008","12.027","0.0011","99.253","0.002","94.113","0.002","92.482","0.002","556.04","0.09","93","2","93","2","","","","","","","","5","P -1","-P 1","2","2,6-diamino-3,5-dinitro-1,4-pyrazine dimethyl sulfoxide solvate","2,6-diamino-3,5-dinitro-1,4-pyrazine dimethyl sulfoxide solvate","","- C6 H10 N6 O5 S -","- C6 H10 N6 O5 S -","- C12 H20 N12 O10 S2 -","2","1","WN6030","Gilardi, Richard D.; Butcher, Ray J.","2,6-Diamino-3,5-dinitro-1,4-pyrazine dimethyl sulfoxide solvate","Acta Crystallographica Section E","2001","57","8","o757","o759","10.1107/S1600536801011722","","","0.71073","MoKα","","0.0376","0.035","","","","0.0909","","","","","","1.144","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200552","8.0762","0.0011","9.9366","0.0013","14.1558","0.0019","90","","90","","90","","1136","0.3","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Poly[(2,2'-bipyridine)copper(II)-μ~4~-oxalato]","","- C12 H8 Cu N2 O4 -","- C12 H8 Cu N2 O4 -","- C48 H32 Cu4 N8 O16 -","4","1","WN6031","Luo, Junhua; Hong, Maochun; Liang, Yucang; Cao, Rong","Poly[(2,2'-bipyridine)copper(II)-μ~4~-oxalato]","Acta Crystallographica Section E","2001","57","8","m361","m362","10.1107/S1600536801011874","","","0.71073","MoKα","","0.0932","0.0511","","","","0.1085","","","","","","1.05","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2200553","9.2024","0.0011","7.5897","0.0009","9.7251","0.0011","90","","101.79","0.002","90","","664.9","0.13","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","trans-Bis(dicyanamido-N)-trans-bis(imidazole-N')copper(II) [Cu({N(CN)~2~}~2~(C~3~H~4~N~2~)~2~]","","- C10 H8 Cu N10 -","- C10 H8 Cu N10 -","- C20 H16 Cu2 N20 -","2","0.5","WN6032","Luo, Junhua; Hong, Maochun; Liang, Yucang; Cao, Rong","<i>trans</i>-Bis(dicyanamido-<i>N</i>)-<i>trans</i>-bis(imidazole-<i>N</i>')copper(II)","Acta Crystallographica Section E","2001","57","8","m359","m360","10.1107/S1600536801011710","","","0.71073","MoKα","","0.0882","0.0528","","","","0.1332","","","","","","1.023","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2200554","4.8558","0.001","8.1621","0.0016","15.919","0.003","90","","92.16","0.03","90","","630.5","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","N-(3-Pyridyl)urea","N-(3-Pyridyl)urea","","- C6 H7 N3 O -","- C6 H7 N3 O -","- C24 H28 N12 O4 -","4","1","WN6033","Sumod George; Ashwini Nangia","<i>N</i>-(3-Pyridyl)urea","Acta Crystallographica Section E","2001","57","8","o719","o720","10.1107/S1600536801011424","","","0.71073","MoKα","","0.0638","0.0449","","","","0.1336","","","","","","1.079","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200555","8.577","0.002","10.997","0.003","12.327","0.003","92.56","0.02","93.38","0.02","106.67","0.02","1109.6","0.5","293","","293","","","","","","","","","2","P -1","-P 1","2","","","","- C30 H28 -","- C30 H28 -","- C60 H56 -","2","1","WN6034","Spagna, Riccardo; Cascarano, Giovanni Luca; Ciminale, Francesco; Farinola, Gianluca M.; Lopez, Luigi","1,3-Diphenyl-1-<i>o</i>-tolyl-3,4-dimethylindan","Acta Crystallographica Section E","2001","57","8","o741","o743","10.1107/S1600536801011825","","","1.54178","CuKα","","0.045","0.045","","0.057","","0.057","","","0.944","","","0.944","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200556","11.5563","0.0001","9.9957","0.0002","42.9208","0.001","90","","91.3492","0.0015","90","","4956.55","0.16","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","asco6d","desoxazoline-ascidiacyclamide dimer (DMF & H2O solvated) cyclo(-Ile-Thr-D-Val-Thz-Ile-D-alloIle-D-Val-Thz-)2 [Thz = thiazole, Thr = (2S,3R), D-alloThr = (2R,3R)]","","- C81 H135 N19 O20 S4 -","- C81 H135 N19 O20 S4 -","- C162 H270 N38 O40 S8 -","2","1","WN6037","Asano, Akiko; Taniguchi, Taizo; Sasaki, Masahiro; Hasegawa, Hiroshi; Katsuya, Yoshio; Doi, Mitsunobu","A β-sheet structure formed by C‒H···O hydrogen bonds between the thiazole rings and amide bonds of a dimeric desoxazoline ascidiacyclamide analogue","Acta Crystallographica Section E","2001","57","9","o834","o838","10.1107/S160053680101279X","","","0.836","synchrotron","","0.0973","0.0967","","","","0.2592","","","","","","1.248","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200557","22.7045","0.0006","11.1044","0.0003","14.2366","0.0002","90","","90","","90","","3589.33","0.14","180","2","180","2","","","","","","","","4","P b c n","-P 2n 2ab","60","NTA‒1,10-phenanthroline‒water (1/1/1)","Nitrilotriacetic acid‒1,10-phenanthroline‒water (1/1/1)","","- C18 H19 N3 O7 -","- C18 H19 N3 O7 -","- C144 H152 N24 O56 -","8","1","WN6038","Shan, Ning; Bond, Andrew D.; Jones, William","NTA‒1,10-phenanthroline‒water (1/1/1)","Acta Crystallographica Section E","2001","57","8","o811","o813","10.1107/S1600536801012612","","","0.71073","MoKα","","0.0517","0.0398","","","","0.1019","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200558","8.0299","0.0016","12.765","0.003","10.587","0.002","90","","92.11","0.03","90","","1084.4","0.4","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H16 N2 O4 -","- C8 H16 N2 O4 -","- C32 H64 N8 O16 -","4","1","WN6039","Gelbrich, Thomas; Kilburn, Jeremy D.; Hursthouse, Michael B.","Diisopropyl hydrazocarboxylate","Acta Crystallographica Section E","2001","57","8","o796","o797","10.1107/S1600536801012648","","","0.71073","MoKα","","0.1033","0.0691","","","","0.1433","","","","","","1.055","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200559","7.3718","0.0003","18.5164","0.0007","8.9123","0.0001","90","","111.913","0.001","90","","1128.63","0.06","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","p-Phenylazoaniline Hydrochloride","","- C12 H12 Cl N3 -","- C12 H12 Cl N3 -","- C48 H48 Cl4 N12 -","4","1","WN6041","Mahmoudkhani, Amir H.; Langer, Vratislav","Zigzag hydrogen-bonded sheets in the structure of <i>p</i>-phenylazoaniline hydrochloride","Acta Crystallographica Section E","2001","57","9","o839","o841","10.1107/S1600536801012971","","","0.71073","MoKα","","0.0681","0.0515","","","","0.1503","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200560","7.1245","0.0003","17.183","0.0007","17.3367","0.0007","90","","94.64","0.001","90","","2115.41","0.15","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,1,4,4-tetra(isopropyl)piperazinium tetrachlorocobaltate(II)","","- C16 H36 Cl4 Co N2 -","- C16 H36 Cl4 Co N2 -","- C64 H144 Cl16 Co4 N8 -","4","1","WN6042","Mahmoudkhani, Amir H.; Langer, Vratislav; Casari, Barbara M.","Two-dimensional network of C‒H···Cl‒Co hydrogen bonds in the structure of 1,1,4,4-tetraisopropylpiperazinium tetrachlorocobaltate(II)","Acta Crystallographica Section E","2001","57","9","m393","m395","10.1107/S1600536801012843","","","0.71073","MoKα","","0.0835","0.0482","","","","0.1294","","","","","","0.987","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200561","9.577","0.003","16.039","0.003","16.127","0.002","90","","90","","90","","2477.2","1","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","N-methyl-2-methyl-3-furanthiocarboxanilyd","","- C13 H13 N O S -","- C13 H13 N O S -","- C104 H104 N8 O8 S8 -","8","1","WN6043","Popović, Jasminka; Mrvoš-Sermek, Draginja; Tralić-Kulenović, Vesna","<i>N</i>,2-Dimethyl-3-furanthiocarboxanilide","Acta Crystallographica Section E","2001","57","9","o893","o894","10.1107/S1600536801013472","","","0.71073","MoKα","","0.1336","0.0531","","","","0.1667","","","","","","0.965","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200562","7.075","0.003","8.783","0.005","12.469","0.005","105.85","0.04","93.44","0.03","106.89","0.03","705","0.6","293","2","","","","","","","","","","4","P -1","-P 1","2","","4-(4-ethoxyphenylamino)-2-oxo-1,2-dihydroquinoline","","- C17 H16 N2 O2 -","- C17 H16 N2 O2 -","- C34 H32 N4 O4 -","2","1","YA6028","Rybakov, Victor B.; Chernyshev, Vladimir V.; Ukrainets, Igor V.; Bezugly, Peter A.; Sidorenko, Lyudmila V.; Skaif, Nicola","4-(4-Ethoxyphenylamino)-2-oxo-1,2-dihydroquinoline","Acta Crystallographica Section E","2001","57","8","o721","o722","10.1107/S160053680101100X","","","0.71073","MoKα","","","0.046","","","","0.104","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200563","4.026","0.005","14.682","0.009","20.728","0.012","90","","90.27","0.02","90","","1225.2","1.8","293","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N^s^,N^o^‒diphenyl(thiooxamide)","","- C14 H12 N2 O S -","- C14 H12 N2 O S -","- C56 H48 N8 O4 S4 -","4","1","YA6029","Rybakov, Victor B.; Babaev, Eugene V.; Dlinnykh, Ylya V.","<i>N</i>^<i>S^</i>,<i>N</i>^<i>O^</i>-Diphenyl(thiooxamide)","Acta Crystallographica Section E","2001","57","8","o814","o815","10.1107/S1600536801012752","","","0.71073","MoKα","","","0.047","","","","0.117","","","","","","0.95","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200564","16.292","0.001","18.404","0.001","25.317","0.002","90","","90","","90","","7591","0.9","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","dichloro{1,2-bis(diphenylphosphino)ethane-P,P'} palladium(II) tris(deuterochloroform) solvate","","- C29 H24 Cl11 D3 P2 Pd -","- C29 H24 Cl11 D3 P2 Pd -","- C232 H192 Cl88 D24 P16 Pd8 -","8","2","YA6030","Batsanov, Andrei S.; Howard, Judith A. K.; Robertson, Graham S.; Kilner, Melvyn","[1,2-Bis(diphenylphosphino)ethane-<i>P</i>,<i>P</i>']dichloropalladium(II) tris(deuterochloroform) solvate","Acta Crystallographica Section E","2001","57","7","m301","m304","10.1107/S1600536801008728","","","0.71073","MoKα","","0.105","0.063","","","","0.099","","","","","","1.78","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200565","10.415","0.002","9.466","0.002","14.357","0.006","90","","105.88","0.02","90","","1361.4","0.7","173","","173","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H11 Cl Cu N2 O4 -","- C13 H11 Cl Cu N2 O4 -","- C52 H44 Cl4 Cu4 N8 O16 -","4","1","YA6031","Bhar, Mallika; Chaudhury, Muktimoy; Tiekink, Edward R. T.","Copper(II)-induced methanolysis of a stable enediol: isolation and crystallographic characterization of chloro(methylpicolinato-<i>N</i>,<i>O</i>)(picolinato-<i>N</i>,<i>O</i>)copper(II)","Acta Crystallographica Section E","2001","57","7","m305","m307","10.1107/S160053680100873X","","","0.71069","MoKα","","0.049","0.028","","","","0.081","","","","","","1.03","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2200566","22.97","0.006","20.005","0.004","8.048","0.002","90","","90","","90","","3698.2","1.5","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","trans-Dichloro-bis(triphenylphosphine)nickel(II) bis(dichloromethane) solvate","","- C38 H34 Cl6 Ni P2 -","- C38 H34 Cl6 Ni P2 -","- C152 H136 Cl24 Ni4 P8 -","4","0.5","YA6032","Batsanov, Andrei S.; Howard, Judith A. K.","<i>trans</i>-Dichlorobis(triphenylphosphine)nickel(II) bis(dichloromethane) solvate: redetermination at 120K","Acta Crystallographica Section E","2001","57","7","m308","m309","10.1107/S1600536801008741","","","0.71073","MoKα","","0.04","0.029","","","","0.074","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200567","7.058","0.004","16.212","0.008","17.029","0.009","90","","90","","90","","1948.5","1.8","293","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(R)-1-{(2-Oxo-1,2-dihydroquinolin-6-yl)[3-(trifluoromethyl)phenyl]methyl}- 1H-1,2,4-triazol-4-ium bromide","","- C19 H14 Br F3 N4 O -","- C19 H14 Br F3 N4 O -","- C76 H56 Br4 F12 N16 O4 -","4","1","YA6033","Oswald M. Peeters; Norbert M. Blaton; Camiel J. De Ranter","(<i>R</i>)-1-{(2-Oxo-1,2-dihydroquinolin-6-yl)[3-(trifluoromethyl)phenyl]methyl}-1<i>H</i>-1,2,4-triazol-4-ium bromide","Acta Crystallographica Section E","2001","57","7","o655","o656","10.1107/S1600536801010315","","","0.71073","MoKα","","0.068","0.034","","0.064","","0.064","","","1.04","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200568","9.4442","0.0009","13.725","0.001","15.703","0.001","90","","90","","90","","2035.4","0.3","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-{4-[(1S,2S)-2-(Dimethylamino)-1-(1H-imidazol-1-yl)propyl]phenyl}- 2-benzothiazolamine","","- C21 H23 N5 S -","- C21 H23 N5 S -","- C84 H92 N20 S4 -","4","1","YA6034","Oswald M. Peeters; Norbert M. Blaton; Camiel J. De Ranter","(+)-<i>N</i>-{4-[(1<i>S</i>,2<i>S</i>)-2-(Dimethylamino)-1-(1<i>H</i>-imidazol-1-yl)propyl]phenyl}-2-benzothiazolamine","Acta Crystallographica Section E","2001","57","8","o723","o724","10.1107/S1600536801011230","","","1.54184","CuKα","","0.058","0.049","","0.145","","0.145","","","1.07","","","1.07","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2200569","7.2397","0.0013","36.724","0.008","7.304","0.002","90","","115.69","0.02","90","","1750","0.7","291","2","291","2","","","","","","","","3","P 1 21 1","P 2yb","4","Ludongnin","octahydro-5'-hydroxy-7a-methyl-8'- methylene-spiro[ isobenzofuran-4( 1H ), 4' ( 3'H )-[ 1H-7, 9a ] methanocyclohepta[c]pyran ]-1', 3, 9'( 3aH, 4'aH )-trione","","- C20 H24 O6 -","- C20 H24 O6 -","- C80 H96 O24 -","4","2","YA6035","Shi, Hao; Pan, Yuan Jiang; Jin, Zhi Min","Natural diterpenoid ludongnin, octahydro-5'-hydroxy-7a-methyl-8'-methylenespiro[isobenzofuran-4(1<i>H</i>),4'(3'<i>H</i>)-[1<i>H</i>-7,9a]methanocyclohepta[<i>c</i>]pyran]-1',3,9'(3a<i>H</i>,4'a<i>H</i>)-trione","Acta Crystallographica Section E","2001","57","8","o685","o687","10.1107/S1600536801010078","","","0.71073","MoKα","","0.058","0.038","","","","0.081","","","","","","0.91","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200570","15.616","0.002","6.702","0.002","7.208","0.006","90","","91.87","0.03","90","","754","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-poly[[bis(1-(2-azidoethyl)tetrazole-N^4^)-copper(II)]-di-μ-chloro]","","- C6 H10 Cl2 Cu N14 -","- C6 H10 Cl2 Cu N14 -","- C12 H20 Cl4 Cu2 N28 -","2","0.5","YA6036","Ivashkevich, Dmitry O.; Lyakhov, Alexander S.; Gaponik, Pavel N.; Bogatikov, Andrey N.; Govorova, Alla A.","Layered structure of <i>catena</i>-poly[[bis[1-(2-azidoethyl)tetrazole-<i>N</i>^4^]copper(II)]-di-μ-chloro]","Acta Crystallographica Section E","2001","57","8","m335","m337","10.1107/S1600536801009965","","","0.71073","MoKα","","0.039","0.033","","","","0.097","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200571","10.096","0.001","26.316","0.002","16.927","0.002","90","","90.07","0.002","90","","4497.3","0.8","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","7-chloro-2-methyl-3-methylamino-2H-1,2,4-benzothiadiazine 1,1-dioxide","","- C9 H10 Cl N3 O2 S -","- C9 H10 Cl N3 O2 S -","- C144 H160 Cl16 N48 O32 S16 -","16","4","YA6037","Dupont, Léon; Somers, Fabian; Boverie, Stéphane; Pirotte, Bernard; Tinant, Bernard; de Tullio, Pascal","7-Chloro-2-methyl-3-methylamino-2<i>H</i>-1,2,4-benzothiadiazine 1,1-dioxide","Acta Crystallographica Section E","2001","57","7","o652","o654","10.1107/S1600536801010248","","","0.71069","MoKα","","0.044","0.036","","","","0.106","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200572","6.4875","0.0001","7.0151","0.0001","14.2991","0.0001","92.044","0.001","100.045","0.001","112.955","0.001","586.169","0.014","297","2","297","2","","","","","","","","4","P -1","-P 1","2","","Bis(p-phenylazoanilinium) oxalate","","- C26 H24 N6 O4 -","- C26 H24 N6 O4 -","- C26 H24 N6 O4 -","1","0.5","YA6039","Mahmoudkhani, Amir H.; Langer, Vratislav","Two-dimensional hydrogen-bonded arrays in <i>p</i>-phenylazoanilinium oxalate","Acta Crystallographica Section E","2001","57","9","o898","o900","10.1107/S1600536801013885","","","0.71073","MoKα","","0.052","0.041","","","","0.129","","","","","","1.04","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200573","12.722","0.002","12.037","0.003","28.551","0.004","90","","98.05","0.01","90","","4329.1","1.4","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Trans-diodo-pentakis(tetrahydrofuran)ytterbium(III)-tetraiodo- trans-bis(tetrahydrofuran)ytterbium(III)","","- C28 H56 I6 O7 Yb2 -","- C28 H56 I6 O7 Yb2 -","- C112 H224 I24 O28 Yb8 -","4","0.5","YA6041","Niemeyer, Mark","<i>trans</i>-Diiodopentakis(tetrahydrofuran)ytterbium(III) tetraiodo-<i>trans</i>-bis(tetrahydrofuran)ytterbium(III)","Acta Crystallographica Section E","2001","57","8","m363","m364","10.1107/S1600536801011254","","","0.71073","MoKα","","0.07","0.047","","","","0.126","","","","","","1.14","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200574","15.208","0.005","8.131","0.005","12.302","0.005","90","","111.554","0.005","90","","1414.8","1.1","163","2","163","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Pentafluorophenyl 3-chloro-3-phenylpropanoate","","- C15 H8 Cl F5 O2 -","- C15 H8 Cl F5 O2 -","- C60 H32 Cl4 F20 O8 -","4","1","YA6042","Chan, Bun; Tan, Eng W.; Blackman, Allan G.","Pentafluorophenyl 3-chloro-3-phenylpropanoate","Acta Crystallographica Section E","2001","57","8","o725","o726","10.1107/S1600536801011242","","","0.71069","MoKα","","0.043","0.033","","","","0.092","","","","","","1.06","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"2200575","15.5033","0.0003","7.5309","0.0002","15.9609","0.0004","90","","110.774","0.001","90","","1742.34","0.07","291","1","291","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C21 H19 N3 -","- C21 H19 N3 -","- C84 H76 N12 -","4","1","YA6043","Kolev, Tsonko; Glavcheva, Zornitza; Yancheva, Denitsa; Schürmann, Markus; Kleb, Dirk-Christian; Preut, Hans; Bleckmann, Paul","2-{3-[2-(1<i>H</i>-Indol-3-yl)vinyl]-5,5-dimethylcyclohex-2-enylidene}malononitrile","Acta Crystallographica Section E","2001","57","8","o760","o761","10.1107/S1600536801011291","","","0.71073","MoKα","","0.162","0.052","","","","0.13","","","","","","0.92","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200576","41.471","0.004","9.3431","0.0009","24.989","0.003","90","","102.077","0.002","90","","9468.1","1.7","150","2","150","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","2,2,6,6-Tetramethyl-3,5-di(2,6-diisopropylphenylimino)heptane","","- C35 H54 N2 -","- C35 H54 N2 -","- C420 H648 N24 -","12","1.5","YA6044","Bailey, Philip J.; Liddle, Stephen T.; Parsons, Simon","2,2,6,6-Tetramethyl-3,5-bis(2,6-diisopropylphenylimino)heptane at 150K","Acta Crystallographica Section E","2001","57","9","o863","o865","10.1107/S1600536801011783","","","0.71073","MoKα","","0.079","0.05","","","","0.124","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200577","13.078","0.006","17.899","0.007","22.79","0.09","90","","105.009","0.002","90","","5153","2","110","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C54 H41 Cl7 N8 O5 Zn -","- C54 H41 Cl7 N8 O5 Zn -","- C216 H164 Cl28 N32 O20 Zn4 -","4","1","YA6045","Ricard, David; Richard, Philippe; Boitrel, Bernard","(Methanol){α-5,10,15:β-20-tetrakis[2-(chloroacetamido)phenyl]porphyrin}zinc(II) chloroform solvate","Acta Crystallographica Section E","2001","57","9","m404","m406","10.1107/S1600536801012788","","","0.71073","MoKα","","","0.069","","","","0.187","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200578","13.061","0.002","13.898","0.002","4.891","0.0017","93.33","0.02","93.21","0.02","101.764","0.014","865.6","0.4","295","2","297","2","","","","","","","","4","P -1","-P 1","2","(8-quinolinyl)urea 3,5-dinitrosalicylate (1:1)","","","- C17 H13 N5 O8 -","- C17 H13 N5 O8 -","- C34 H26 N10 O16 -","2","1","YA6046","Smith, Graham; Bott, Raymond C.; Wermuth, Urs D.","The 1:1 proton-transfer complex of 3,5-dinitrosalicylic acid with (8-quinolinyl)urea","Acta Crystallographica Section E","2001","57","9","o895","o897","10.1107/S1600536801013666","","","0.71069","MoKα","","0.061","0.045","","","","0.125","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200579","13.666","0.003","16.277","0.003","18.575","0.004","90","","98.99","0.03","90","","4081.1","1.5","188","2","188","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","trans-bis(2,4,6,2'',4'',6''-hexaisopropyl-1,1':3',1''-terphenyl-2'-thiolato-S)- tetrakis(tetrahydrofuran-O)ytterbium(II)","","- C88 H130 O4 S2 Yb -","- C88 H130 O4 S2 Yb -","- C176 H260 O8 S4 Yb2 -","2","0.5","YA6051","Niemeyer, Mark","A sterically crowded ytterbium(II) thiolate: <i>trans</i>-bis(2,4,6,2'',4'',6''-hexaisopropyl-1,1':3',1''-terphenyl-2'-thiolato-<i>S</i>)tetrakis(tetrahydrofuran-<i>O</i>)ytterbium(II)","Acta Crystallographica Section E","2001","57","9","m396","m398","10.1107/S160053680101306X","","","0.71073","MoKα","","0.094","0.052","","","","0.128","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200580","12.3307","0.0014","12.6105","0.001","16.3613","0.0012","89.734","0.006","80.137","0.007","72.592","0.009","2388.8","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","trans-(μ^2^-tert-butoxy)bis(μ^2^-2,4,6,2'',4'',6''-hexamethyl-1,1':3';1''- terphenyl-2',2'-diyl)(μ^2^-iodo)tetracopper(I)","","- C52 H59 Cu4 I O -","- C52 H59 Cu4 I O -","- C104 H118 Cu8 I2 O2 -","2","1","YA6052","Niemeyer, Mark","A tetranuclear copper compound containing three different types of anions: <i>trans</i>-(μ-<i>tert</i>-butoxy)bis(μ-2,4,6,2'',4'',6''-hexamethyl-1,1':3',1''-terphenyl-2',2'-diyl)(μ-iodo)tetracopper(I)","Acta Crystallographica Section E","2001","57","9","m416","m418","10.1107/S1600536801013551","","","0.71073","MoKα","","0.078","0.035","","","","0.059","","","","","","0.72","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200581","6.0584","0.0006","6.0584","0.0006","11.3561","0.0007","90","","90","","120","","360.97","0.06","293","","293","2","","","","","","","","3","P 63 c m","P 6c -2","185","","","","- Mn O3 Yb -","- Mn O3 Yb -","- Mn6 O18 Yb6 -","6","0.5","","Aken, Bas B. van; Meetsma, Auke; Palstra, Thomas T. M.","Hexagonal YbMnO~3~ revisited","Acta Crystallographica, Section E","2001","57","","i87","i89","10.1107/S1600536801015094","","","","","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2200582","6.038","0.001","6.038","0.001","11.361","0.001","90","","90","","120","","358.7","0.09","293","","295","","","","","","","","","3","P 63 c m","P 6c -2","185","","","","- Lu Mn O3 -","- Lu Mn O3 -","- Lu6 Mn6 O18 -","6","0.5","","Aken, Bas B. van; Meetsma, Auke; Palstra, Thomas T.M.","Hexagonal LuMnO~3~ revisited","Acta Crystallographica, Section E","2001","57","","i101","i103","10.1107/S1600536801015896","","","","","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2200583","9.3532","0.0019","9.3532","0.0019","9.3532","0.0019","90","","90","","90","","818.2","0.3","293","2","293","2","","","","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Ru3 Sn7 -","- Ru3 Sn7 -","- Ru12 Sn28 -","4","0.0416667","BR6028","Eriksson, Lars; Lanner, Johanna","Ru~3~Sn~7~, a re-investigation","Acta Crystallographica Section E","2001","57","10","i85","i86","10.1107/S1600536801014246","","","0.71073","MoKα","","0.0328","0.0302","","","","0.0451","","","","","","2.51","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200584","10.659","0.002","14.55","0.001","16.992","0.003","90","","97.91","0.02","90","","2610.2","0.7","301","2","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H31 Br2 Cu N3 O2 Zn -","- C24 H31 Br2 Cu N3 O2 Zn -","- C96 H124 Br8 Cu4 N12 O8 Zn4 -","4","1","BR6030","Svoboda, Ingrid; Arıcı, Cengiz; Nazır, Hasan; Durmus, Zehra; Atakol, Orhan; Fuess, Hartmut","{[μ-<i>N,N</i>'-Bis(salicylidene)-2,2'-dimethyl-1,3-propanediamine](piperidine)copper(II)}dibromozinc(II)","Acta Crystallographica Section E","2001","57","12","m584","m586","10.1107/S1600536801019171","","","0.71073","MoKα","","","0.038","","","","0.095","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200585","22.461","0.004","11.295","0.002","11.394","0.002","90","","94.557","0.009","90","","2881.5","0.9","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- Co H20 K3 Mo6 O31 -","- Co K3 Mo6 O31 -","- Co4 K12 Mo24 O124 -","4","1","BR6031","Lee, Uk; Joo, Hea-Chung; Kwon, Jae-Sam; Cho, Mi-Ae","Tripotassium hexahydrogen hexamolybdocobaltate(III) heptahydrate, K~3~[H~6~CoMo~6~O~24~]·7H~2~O","Acta Crystallographica Section E","2001","57","12","i112","i114","10.1107/S1600536801019365","","","0.71069","MoKα","","0.0416","0.0313","","","","0.0816","","","","","","1.11","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200586","6.083","0.001","6.226","0.001","10.867","0.002","77.14","0.03","82.2","0.03","72.91","0.03","382.43","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- Cu H10 O9 Se -","- Cu H10 O9 Se -","- Cu2 H20 O18 Se2 -","2","1","","Kolitsch, Uwe","Copper(II) selenate pentahydrate, CuSeO~4~.5H~2~O","Acta Crystallographica, Section E","2001","57","","i104","i105","10.1107/S1600536801018347","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2200587","6.8666","0.0004","9.6596","0.0003","10.5866","0.0005","90","","105.827","0.002","90","","675.57","0.06","296.2","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- Mo4 O15 Tb2 -","- Mo4 O15 Tb2 -","- Mo8 O30 Tb4 -","2","0.5","BR6034","Haruo Naruke; Toshihiro Yamase","Tb~2~Mo~4~O~15~","Acta Crystallographica Section E","2001","57","12","i106","i108","10.1107/S1600536801018517","","","0.7107","MoKα","","","0.0226","","","","0.0604","","","","","","0.9","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200588","9.483","0.002","13.03","0.003","5.339","0.001","90","","90","","90","","659.7","0.2","293","2","293","2","","","","","","","Synthetic","4","P n m a","-P 2ac 2n","62","flinkite","","Flinkite","- As H4 Mn3 O8 -","- As H4 Mn3 O8 -","- As4 H16 Mn12 O32 -","4","0.5","","Kolitsch, Uwe","Redetermination of the mixed-valence manganese arsenate flinkite, Mn^II^~2~Mn^III^(OH)~4~(AsO~4~)","Acta Crystallographica, Section E","2001","57","","i115","i118","10.1107/S1600536801020050","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2200589","7.646","0.002","6.179","0.001","9.507","0.002","90","","90","","90","","449.15","0.17","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","pyrobelonite","","","- H Mn O5 Pb V -","- H Mn O5 Pb V -","- H4 Mn4 O20 Pb4 V4 -","4","0.5","","Kolitsch, Uwe","Refinement of pyrobelonite, PbMn^II^VO~4~(OH), a member of the descloizite group","Acta Crystallographica, Section E","2001","57","","i119","i121","10.1107/S1600536801020037","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2200590","10.0298","0.0015","6.3718","0.0015","11.2238","0.0014","90","","100.685","0.011","90","","704.9","0.2","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","2,6-diisopropylbenzene phosphoric acid","2,6-Diisopropylbenzene dihydrogen phosphate","","- C12 H19 O4 P -","- C12 H19 O4 P -","- C24 H38 O8 P2 -","2","1","BT6070","Onoda, Akira; Okamura, Taka-aki; Yamamoto, Hitoshi; Ueyama, Norikazu","One-dimensional P‒OH···O<b>=</b>P hydrogen bonds restricted by the bulky molecule 2,6-diisopropylphenyl dihydrogen phosphate","Acta Crystallographica Section E","2001","57","11","o1022","o1024","10.1107/S160053680101635X","","","0.71069","MoKα","","0.0667","0.0347","","","","0.1057","","","","","","1.023","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200591","7.208","0.001","8.0106","0.0012","12.256","0.002","79.099","0.007","74.695","0.004","69.379","0.006","635.2","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","2-cyano-2'-nitrodiazoaminobenzene","2-cyano-2'-nitrodiazoaminobenzene","","- C13 H9 N5 O2 -","- C13 H9 N5 O2 -","- C26 H18 N10 O4 -","2","1","BT6074","O'Brien, John G.; Grousnick, Katherine E.; Baughman, Russell G.","2-Cyano-2'-nitrodiazoaminobenzene","Acta Crystallographica Section E","2001","57","10","o919","o921","10.1107/S160053680101443X","","","0.71073","MoKα","","0.11","0.0581","","0.1963","","0.1594","","","1.055","","","1.182","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200592","11.8175","0.0006","13.7466","0.0007","7.1093","0.0004","90","","120.769","0.001","90","","992.34","0.09","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C H3 K2 O4.5 -","- C H3 K2 O4.5 -","- C8 H24 K16 O36 -","8","1","","Janet M. S. Skakle; Mhairi Wilson; Jörg Feldmann","Dipotassium carbonate sesquihydrate: rerefinement against new intensity data","Acta Crystallographica, Section E","2001","57","","i94","i97","10.1107/S1600536801016312","","","","","","","","","","","","","","","","","","","","","has coordinates","196234","2020-10-21","18:00:00",""
"2200593","5.5955","0.0011","10.684","0.002","12.224","0.002","90","","98.687","0.004","90","","722.4","0.2","294","2","294","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(R)-N-(1-Phenylethyl)quinoline-2-carboxamide","","- C18 H16 N2 O -","- C18 H16 N2 O -","- C36 H32 N4 O2 -","2","1","BT6079","Yang, Qi-Yun; Zhou, Zhong-Yuan; Qi, Jian-Ying","(<i>R</i>)-<i>N</i>-(1-Phenylethyl)quinoline-2-carboxamide","Acta Crystallographica Section E","2001","57","10","o971","o972","10.1107/S1600536801014325","","","0.71073","MoKα","","0.0547","0.038","","","","0.0898","","","","","","0.955","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200594","5.4186","0.0011","22.951","0.005","7.4518","0.0015","90","0.017","99.73","0.016","90","0.018","913.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C7 H11 N O6 -","- C7 H11 N O6 -","- C28 H44 N4 O24 -","4","1","BT6081","Rajagopal, K.; Krishnakumar, R. V.; Natarajan, S.","β-Alaninium maleate","Acta Crystallographica Section E","2001","57","10","o922","o924","10.1107/S1600536801014672","","","0.71073","MoKα","","0.0555","0.0384","","","","0.1895","","","","","","1.164","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200595","9.9482","0.001","11.2184","0.001","12.8536","0.001","97.702","0.007","105.515","0.007","94.503","0.007","1359.9","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H18 Cl2 N5 O6 P3 -","- C25 H18 Cl2 N5 O6 P3 -","- C50 H36 Cl4 N10 O12 P6 -","2","1","BT6084","Hökelek, Tuncer; Dal, Hakan; Kılıç, Zeynel","<i>cis</i>-ansa-2,4-Dichloro-2,4-[2,2'-methylenebis(4-nitrophenoxy)]-6,6-diphenylcyclo-2λ^5^,4λ^5^,6λ^5^-triphosphazatriene","Acta Crystallographica Section E","2001","57","11","o1063","o1066","10.1107/S1600536801017056","","","0.71073","MoKα","","0.0919","0.0666","","","","0.2579","","","","","","1.215","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200596","18.3417","0.0018","18.3164","0.0018","23.547","0.002","90","","90","","90","","7910.7","1.3","110","2","110","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","[Bis(diphenylphosphino)methane-2κ^2^P,P']-μ-carbonyl-1:2κC-carbonyl-1κC- [1(η^5^)-cyclopentadienyl](μ-phenylvinylidene-1:2κ^2^C)manganeseplatinum- (Mn—Pt) diethyl ether solvate","","- C44 H43 Mn O3 P2 Pt -","- C44 H43 Mn O3 P2 Pt -","- C352 H344 Mn8 O24 P16 Pt8 -","8","1","BT6085","Dolgushin, Fedor M.; Deykhina, Nina A.; Pogrebnyakov, Dmitry A.; Antonova, Alla B.","The binuclear μ-phenylvinylidene complex (η^5^-C~5~H~5~)(CO)(μ-CO)MnPt(μ-C=CHPh)(η^2^-Ph~2~PCH~2~PPh~2~)·Et~2~O","Acta Crystallographica Section E","2001","57","11","m541","m542","10.1107/S1600536801017500","","","0.71073","MoKα","","0.092","0.054","","","","0.129","","","","","","0.97","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200597","10.7602","0.0002","9.1559","0.0002","18.2953","0.0003","90","","99.2514","0.0012","90","","1779","0.06","291","1","291","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H24 Cl2 O S Sn2 -","- C9 H24 Cl2 O S Sn2 -","- C36 H96 Cl8 O4 S4 Sn8 -","4","1","BT6086","Mandolesi, Sandra; Studentkowski, Marc; Preut, Hans; Mitchell, Terence","A 1:1 adduct between 2,2-bis(chlorodimethylstannyl)propane and dimethyl sulfoxide","Acta Crystallographica Section E","2001","57","11","m543","m544","10.1107/S1600536801017603","","","0.71069","MoKα","","0.0687","0.0258","","","","0.0498","","","","","","0.856","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200598","9.3516","0.0009","9.7925","0.001","5.7651","0.0003","90","","90","","90","","527.94","0.08","120","2","120","2","","","","","","","","3","P n a 21","P 2c -2n","33","3-picoline","3-methylpyridine","","- C6 H7 N -","- C6 H7 N -","- C24 H28 N4 -","4","1","BT6087","Bond, Andrew D.; Davies, John E.","3-Picoline","Acta Crystallographica Section E","2001","57","11","o1087","o1088","10.1107/S1600536801017536","","","0.7107","MoKα","","0.0415","0.0398","","","","0.1059","","","","","","1.082","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200599","6.6593","0.0005","7.0878","0.0006","11.7358","0.0007","90","","90","","90","","553.93","0.07","120","2","120","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","2-picoline","2-methylpyridine","","- C6 H7 N -","- C6 H7 N -","- C24 H28 N4 -","4","1","BT6088","Bond, Andrew D.; Davies, John E.","2-Picoline","Acta Crystallographica Section E","2001","57","11","o1089","o1090","10.1107/S1600536801017548","","","0.7107","MoKα","","0.0679","0.0621","","","","0.1809","","","","","","1.095","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200600","43.717","0.005","8.0751","0.001","7.2651","0.0012","90","","96.86","0.006","90","","2546.4","0.6","291","1","291","1","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","","","- C18 H16 -","- C18 H16 -","- C144 H128 -","8","1","BT6089","Jovanovic, Jovan; Schürmann, Markus; Preut, Hans; Spiteller, Michael","Second modification of (<i>E</i>)-2,3,2',3'-tetrahydro-[1,1']biindenylidene","Acta Crystallographica Section E","2001","57","11","o1100","o1101","10.1107/S1600536801017767","","","0.71073","MoKα","","0.2648","0.05","","","","0.0968","","","","","","0.832","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200601","5.572","0.001","15.53","0.001","27.221","0.002","90","","90","","90","","2355.5","0.5","123","2","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C27 H26 O9 -","- C27 H26 O9 -","- C108 H104 O36 -","4","1","BT6091","Carr, Jenny M.; Draffin, Scott P.; Duggan, Peter J.; Fallon, Gary D.; Humphrey, David G.","<small>D</small>-Mannitol-1,2,6-tribenzoate","Acta Crystallographica Section E","2001","57","11","o1118","o1119","10.1107/S1600536801018074","","","0.71073","MoKα","","0.0478","0.0357","","","","0.0873","","","","","","1.079","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200602","7.5572","0.0015","9.0637","0.0018","10.997","0.002","74.17","0.03","84.5","0.03","89.74","0.03","721.2","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","bis(acetylacetonato)diaquanickel(II) monohydrate","","- C10 H20 Ni O7 -","- C10 H20 Ni O7 -","- C20 H40 Ni2 O14 -","2","1","CF6067","Zhou, Xing-Fu; Han, Ai-Jie; Chu, Dao-Bao; Huang, Zi-Xiang","Electrochemical synthesis and a redetermination of Ni(acac)~2~(H~2~O)~2~·H~2~O","Acta Crystallographica Section E","2001","57","11","m506","m508","10.1107/S1600536801016208","","","0.71073","MoKα","","0.0439","0.0402","","","","0.1111","","","","","","1.037","","","","has coordinates","206183","2020-10-21","18:00:00",""
"2200603","5.9498","0.0002","9.7014","0.0004","24.7207","0.0009","90","","90","","90","","1426.91","0.09","298","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H26 O2 -","- C15 H26 O2 -","- C60 H104 O8 -","4","1","CF6072","El Jamili, H.; Auhmani, A.; Dakir, M.; Benharref, A.; Kossareva, E.; Pierrot, M.","(1<i>R</i>,6<i>S</i>,7<i>R</i>)-Himachal-2-ène-6,7-diol","Acta Crystallographica Section E","2001","57","10","o904","o905","10.1107/S1600536801014374","","","0.71073","MoKα","","0.0488","0.0456","","","","0.1166","","","","","","1.136","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200604","21.266","0.009","21.266","0.009","7.873","0.005","90","","90","","120","","3083","3","298","","","","","","","","","","","3","P 32","P 32","145","","","","- C15 H26 O3 -","- C15 H26 O3 -","- C135 H234 O27 -","9","3","CF6073","El Jamili, H.; Auhmani, A.; Dakir, M.; Benharref, A.; Kossareva, E.; Pierrot, M.","(1<i>S</i>,2<i>S</i>,3<i>R</i>,6<i>S</i>,7<i>R</i>)-3,6-Epoxyhimachalane-2,7-diol","Acta Crystallographica Section E","2001","57","10","o925","o927","10.1107/S160053680101457X","","","0.71073","MoKα","","0.0389","0.0373","","","","0.0899","","","","","","1.094","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200605","5.995","0.002","10.242","0.004","14.292","0.005","93.37","0.006","90.595","0.006","103.557","0.006","851.4","0.5","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","r-1,c-2,t-3,t-4-1,3-bis(4-methoxyphenyl)-2,4-bis[2-(5-phenyl-1,3,4- oxadiazolyl)]cyclobutane","","- C38 H36 N4 O6 -","- C38 H36 N4 O6 -","- C38 H36 N4 O6 -","1","0.5","CF6094","Yan, Zheng; Jun-Peng, Zhuang; Wen-Qin, Zhang; Xue-Bing, Leng; Lin-Hong, Weng","<i>r</i>-1,<i>c</i>-2,<i>t</i>-3,<i>t</i>-4-1,3-Bis(4-methoxyphenyl)-2,4-bis(5-phenyl-1,3,4-oxadiazol-2-yl)cyclobutane 1,4-dioxane solvate","Acta Crystallographica Section E","2001","57","11","o1029","o1031","10.1107/S160053680101683X","","","0.71073","MoKα","","0.1523","0.0678","","","","0.1674","","","","","","0.968","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200606","8.733","0.0002","5.871","0.0003","15.307","0.0006","90","","90.535","0.001","90","","784.78","0.05","123","2","123","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","N,N'-bis(salicylidene)-1,4,butanediamine","","- C18 H20 N2 O2 -","- C18 H20 N2 O2 -","- C36 H40 N4 O4 -","2","0.5","CF6103","Kennedy, Alan R.; Reglinski, John","<i>N</i>,<i>N</i>'-Bis(salicylidene)-1-4-butanediamine","Acta Crystallographica Section E","2001","57","11","o1027","o1028","10.1107/S1600536801016269","","","0.71073","MoKα","","0.1181","0.0626","","0.1351","0.1058","","","","1.194","1.231","1.231","","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200607","7.287","0.007","10.725","0.009","7.452","0.008","90","","90.37","0.09","90","","582.4","1","5","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","2,6DMP","2,6 dimethylpyrazine","","- C6 H8 N2 -","- C6 H8 N2 -","- C24 H32 N8 -","4","1","CF6104","Kaiser-Morris, Erika; Nicolaï, Beatrice; Cousson, Alain; Paulus, Werner; Fillaux, Francois","2,6-Dimethylpyrazine at 5K: a neutron-diffraction study","Acta Crystallographica Section E","2001","57","11","o1116","o1117","10.1107/S1600536801017846","","neutron","0.8308","Neutron","","","0.0323","","","","0.016","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200608","7.288","0.005","10.73","0.01","7.444","0.007","90","","90.1","0.08","90","","582.1","0.9","20","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","2,6DMP","2,6-dimethylpyrazine","","- C6 H8 N2 -","- C6 H8 N2 -","- C24 H32 N8 -","4","1","CF6105","Kaiser-Morris, Erika; Nicolaï, Beatrice; Cousson, Alain; Paulus, Werner; Fillaux, Francois","2,6-Dimethylpyrazine at 20K: a neutron-diffraction study","Acta Crystallographica Section E","2001","57","11","o1113","o1115","10.1107/S1600536801017834","","neutron","0.8308","Neutron","","","0.0311","","","","0.0186","","","","","","1.0328","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200609","7.328","0.002","16.366","0.004","11.131","0.003","90","","99.33","0.02","90","","1317.3","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-[(2-nitrophenyl)hydrazono]-4H-naphthalen-1-one","","- C16 H11 N3 O3 -","- C16 H11 N3 O3 -","- C64 H44 N12 O12 -","4","1","CF6106","Yatsenko, A. V.; Paseshnichenko, K. A.","π‒π Stacks and C‒H···O bonded sheets in 4-[(2-nitrophenyl)hydrazono]-4<i>H</i>-naphthalen-1-one","Acta Crystallographica Section E","2001","57","11","o1025","o1026","10.1107/S160053680101621X","","","0.71073","MoKα","","0.0748","0.045","","","","0.1077","","","","","","1.309","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200610","10.0853","0.0002","10.0892","0.0002","30.1129","0.0007","88.403","0.002","88.589","0.009","90.021","0.001","3061.95","0.11","180","2","180","2","","","","","","","","4","P 1","P 1","1","","Pentacyclohexyloxyphosphorane","","- C30 H55 O5 P -","- C30 H55 O5 P -","- C120 H220 O20 P4 -","4","4","CF6107","Davies, John E.; Kirby, Anthony J.; Roussev, Christo D.","Pentacyclohexyloxyphosphorane","Acta Crystallographica Section E","2001","57","11","o994","o995","10.1107/S1600536801015951","","","0.71073","MoKα","","0.0499","0.0435","","","","0.1078","","","","","","1.063","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200611","11.6008","0.0008","13.459","0.003","12.0597","0.0012","90","","118.611","0.009","90","","1653","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","piperidine","2,6-Diphenyl-3-isopropylpiperidin-4-one","","- C20 H23 N O -","- C20 H23 N O -","- C80 H92 N4 O4 -","4","1","CF6108","M. Nilofar Nissa; D. Velmurugan; S. Narasimhan; V. Rajagopal; Moon-Jib Kim","2,6-Diphenyl-3-isopropylpiperidin-4-one","Acta Crystallographica Section E","2001","57","11","o996","o998","10.1107/S1600536801016026","","","0.71073","MoKα","","0.1832","0.0628","","","","0.1949","","","","","","0.96","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200612","8.1138","0.0002","9.5567","0.0002","11.9553","0.0003","90","","90","","90","","927.03","0.04","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1R,2R)-1,2-diammoniocyclohexane dichloride","","- C6 H16 Cl2 N2 -","- C6 H16 Cl2 N2 -","- C24 H64 Cl8 N8 -","4","1","CF6109","Farrugia, Louis J.; Cross, Ronald J.; Barley, Helen R. L.","(1<i>R</i>,2<i>R</i>)-1,2-Diammoniocyclohexane dichloride","Acta Crystallographica Section E","2001","57","11","o992","o993","10.1107/S1600536801015872","","","0.71073","MoKα","","0.0181","0.0174","","","","0.0465","","","","","","1.063","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200613","16.435","0.005","7.562","0.005","16.527","0.004","90","","90.28","0.02","90","","2054","1.6","150","2","150","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","cis-(2-amino-1,1-dimethylethylamine)-dichloro-palladium(II) ethanol solvate","","- C5 H15 Cl2 N2 O0.5 Pd -","- C5 H15 Cl2 N2 O0.5 Pd -","- C40 H120 Cl16 N16 O4 Pd8 -","8","1","CF6110","Farrugia, Louis J.; Cross, Ronald J.; Barley, Helen R. L.","<i>cis</i>-(2-Amino-1,1-dimethylethylamine)dichloropalladium(II) ethanol hemisolvate","Acta Crystallographica Section E","2001","57","11","m494","m495","10.1107/S1600536801015884","","","0.71073","MoKα","","0.0352","0.0258","","","","0.0583","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200614","17.6676","0.0007","17.6676","0.0007","17.6676","0.0007","90","","90","","90","","5514.8","0.4","293","2","293","2","","","","","","","","6","P b -3","-p 2bc 2ac 3","","","Tetraethylammonium trichloro(triphenylphosphine)nickelate(II)","","- C26 H35 Cl3 N Ni P -","- C25.9999 H34.9998 Cl3 N Ni P -","- C207.999 H279.998 Cl24 N8 Ni8 P8 -","8","","CF6111","Smith, Matt C.; Davies, Sian C.; David L. Hughes; David J. Evans","Tetraethylammonium trichloro(triphenylphosphine)nickelate(II)","Acta Crystallographica Section E","2001","57","11","m509","m510","10.1107/S1600536801016348","","","0.71069","Mo-Kα","","0.155","0.0546","","0.1767","","0.1767","","","0.958","","","1.203","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200615","9.401","0.001","15.77","0.001","16.845","0.001","90","","95.581","0.001","90","","2485.5","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Tetrabutylammonium(1+) tetrachloroaquaoxomolybdate(1-)","","- C16 H38 Cl4 Mo N O2 -","- C16 H38 Cl4 Mo N O2 -","- C64 H152 Cl16 Mo4 N4 O8 -","4","1","CF6112","Wu, Chuan-De; Zhang, Quan-Zheng; Lu, Can-Zhong; Zhuang, Hong-Hui; Huang, Jin-Shun","Tetrabutylammonium aquatetrachlorooxomolybdate(V)","Acta Crystallographica Section E","2001","57","11","m511","m513","10.1107/S1600536801016919","","","0.71073","MoKα","","","0.0496","","","","0.1239","","","","","","1.147","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200616","18.1968","0.0013","7.2601","0.0005","6.7498","0.0003","90","","90","","90","","891.72","0.1","150","2","150","2","","","","","","","","2","P n m a","-P 2ac 2n","62","γ-Terpinene","1-isopropyl-4-methyl-1,4-cyclohexadiene","","- C10 H16 -","- C10 H16 -","- C40 H64 -","4","0.5","CF6113","Bond, Andrew D.; Davies, John E.","γ-Terpinene","Acta Crystallographica Section E","2001","57","11","o1032","o1033","10.1107/S1600536801016920","","","0.7107","MoKα","","0.0692","0.0489","","","","0.1393","","","","","","1.062","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200617","6.052","0.0007","10.2748","0.0007","7.1621","0.0009","90","","91.335","0.004","90","","445.24","0.08","150","2","150","2","","","","","","","","3","P 1 21 1","P 2yb","4","(1R)-(-)-Fenchone","(-)-1,3,3-trimethyl-2-norbornanone","","- C10 H16 O -","- C10 H16 O -","- C20 H32 O2 -","2","1","CF6114","Bond, Andrew D.; Davies, John E.","(1<i>R</i>)-({-})-Fenchone","Acta Crystallographica Section E","2001","57","11","o1034","o1035","10.1107/S1600536801016932","","","0.7107","MoKα","","0.0605","0.0558","","","","0.1565","","","","","","1.097","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200618","4.126","0.001","17.779","0.003","10.268","0.003","90","","90","","90","","753.2","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","2-thiocoumarin","2H-chromene-2-thione","","- C9 H6 O S -","- C9 H6 O S -","- C36 H24 O4 S4 -","4","1","CF6115","Munshi, Parthapratim; Guru Row, T. N.","2<i>H</i>-Chromene-2-thione","Acta Crystallographica Section E","2001","57","12","o1175","o1176","10.1107/S1600536801019067","","","0.71073","MoKα","","0.1638","0.0541","","","","0.1855","","","","","","0.84","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200619","9.0763","0.0002","12.8096","0.0003","13.0012","0.0003","83.522","0.002","75.195","0.002","69.2873","0.0014","1366.51","0.06","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","Chloro(dimethylamino-1-ethylindenyl)(triphenylphosphine)nickel(II)","","- C31 H31 Cl N Ni P -","- C31 H31 Cl N Ni P -","- C62 H62 Cl2 N2 Ni2 P2 -","2","1","CF6116","Groux, Laurent F.; Zargarian, Davit","Chloro[1-(dimethylaminoethyl)indenyl](triphenylphosphine)nickel(II)","Acta Crystallographica Section E","2001","57","11","m547","m548","10.1107/S1600536801017925","","","1.54178","CuKα","","0.0609","0.0597","","0.1699","","0.168","","","1.057","","","1.069","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200620","11.5792","0.0006","13.0972","0.0008","9.0779","0.0005","96.78","0.005","93.245","0.004","82.833","0.004","1355.18","0.13","294","","294","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H30 B N O4 -","- C32 H28.3 B N O4 -","- C64 H56.6 B2 N2 O8 -","2","1","CF6117","Wolfgang Kliegel; Jörg Metge; Brian O. Patrick; Steven J. Rettig; James Trotter","An OBONC five-membered heterocycle","Acta Crystallographica Section E","2001","57","11","o1120","o1122","10.1107/S1600536801018037","","","1.5418","CuKα","","0.069","0.04","","0.056","","0.038","","","","","","0.966","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2200621","6.709","0.005","9.958","0.005","17.743","0.005","95.757","0.005","94.587","0.005","105.6","0.005","1128.9","1.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","spiropyrrolidine","Spiro[2-carbomethoxy-5-(4-methoxyphenyl)-3-phenylpyrrolidine-4,3'-chroman- 4'-one]","","- C27 H25 N O5 -","- C27 H25 N O5 -","- C54 H50 N2 O10 -","2","1","CF6118","M. Nilofar Nissa; V. Rajakannan; Moon-Jib Kim; D. Velmurugan","Spiro[2-carbomethoxy-5-(4-methoxyphenyl)-3-phenylpyrrolidine-4,3'-chroman-4'-one]","Acta Crystallographica Section E","2001","57","12","o1230","o1232","10.1107/S1600536801019961","","","0.71073","MoKα","","0.0695","0.0433","","","","0.128","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200622","9.245","0.002","8.4082","0.0017","26.633","0.0015","90","","94.802","0.011","90","","2063","0.6","173","1","173","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(2S*, 3R*, 4S*, 5R*)-3-(S*-1-benzyloxyethyl)-4-methyl-4-nitro-5- phenylproline methyl ester","","- C22 H26 N2 O5 -","- C22 H26 N2 O5 -","- C88 H104 N8 O20 -","4","1","CF6119","Linden, Anthony; Ayerbe, Mirari; Arrieta, Ana; Zubia, Aizpea; Vivanco, Silvia; Erquicia, Edurne; Aldaba, Eneko; Cossío, Fernando P.; Lecea, Begoña","(2<i>S</i>*,3<i>R</i>*,4<i>S</i>*,5<i>R</i>*)-3-(<i>S</i>*-1-Benzyloxyethyl)-4-methyl-4-nitro-5-phenylproline methyl ester","Acta Crystallographica Section E","2001","57","11","o1123","o1125","10.1107/S1600536801018104","","","0.71073","MoKα","","0.1019","0.0494","","","","0.1422","","","","","","1.059","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2200623","7.5489","0.0002","4.8968","0.0002","17.0874","0.0006","90","","93.8964","0.0019","90","","630.18","0.04","291","1","291","1","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 -","- C18 H16 -","- C36 H32 -","2","0.5","CF6120","Jovanovic, Jovan; Schürmann, Markus; Preut, Hans; Spiteller, Michael","1,3,1',3'-Tetrahydro-[2,2']biindenylidene","Acta Crystallographica Section E","2001","57","12","o1139","o1140","10.1107/S1600536801018311","","","0.71073","MoKα","","0.0687","0.038","","","","0.1009","","","","","","0.904","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200624","8.7773","0.0005","20.3849","0.0011","8.9935","0.0004","90","","107.427","0.003","90","","1535.3","0.14","180","2","180","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2,4,6-Collidine","2,4,6-Trimethylpyridine","","- C8 H11 N -","- C8 H11 N -","- C64 H88 N8 -","8","2","CF6121","Bond, Andrew D.; Davies, John E.","2,4,6-Collidine","Acta Crystallographica Section E","2001","57","12","o1141","o1142","10.1107/S1600536801018396","","","0.71073","MoKα","","0.0927","0.0707","","","","0.1931","","","","","","1.129","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200625","27.083","0.002","10.0911","0.001","20.304","0.002","90","","110.212","0.003","90","","5207.3","0.8","150","2","150","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C26 H20 S8 -","- C26 H20 S8 -","- C208 H160 S64 -","8","1","CF6122","Gelbrich, Thomas; Roberts-Bleming, Susan J.; Kalaji, Maher; Murphy, Patrick J.; Hursthouse, Michael B.","4,5,4',5'-Tetrakis(2-methyl-thiophen-3-yl)-[2,2']bi[[1,3]dithiolylidene]","Acta Crystallographica Section E","2001","57","12","o1143","o1144","10.1107/S1600536801018529","","","0.71073","MoKα","","0.1458","0.0716","","","","0.1378","","","","","","1.089","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200626","10.409","0.001","11.922","0.002","10.291","0.001","109.78","0.01","94.96","0.01","110.61","0.01","1093.7","0.3","294","","294","","","","","","","","","5","P -1","-P 1","2","","","","- C7 H12 Cl3 N O2 -","- C7 H12 Cl3 N O2 -","- C28 H48 Cl12 N4 O8 -","4","2","CF6123","Wolfgang Kliegel; Ulf Riebe; Brian O. Patrick; Steven J. Rettig; James Trotter","Chloral adduct of <i>N</i>-hydroxypiperidine","Acta Crystallographica Section E","2001","57","12","o1173","o1174","10.1107/S1600536801018864","","","1.54178","CuKα","","","0.043","","","","0.046","","","","","","1.95","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200627","17.669","0.008","7.921","0.002","15.598","0.004","90","","106.1","0.01","90","","2097.4","1.2","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","bis(N,N,N'-Trimethylethylenediamine)-lithium indenide","","- C19 H35 Li N4 -","- C19 H35 Li N4 -","- C76 H140 Li4 N16 -","4","0.5","","Boche, Gernot; Ledig, Burkhard; Marsch, Michael; Harms, Klaus","[Indenyllithium.2(N,N,N'-trimethylethylenediamine)]~\ιnfty~: N—H hydrogen bridges to the indenyl anion","Acta Crystallographica Section E","2001","57","12","m570","m572","10.1107/S1600536801018876","","","1.54178","CuKα","","0.0488","0.0401","","","","0.1138","","","","","","1.073","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"2200628","6.8206","0.0003","9.5663","0.0004","11.933","0.0004","97.092","0.001","97.502","0.001","100.954","0.002","749.03","0.05","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","8a-Ethyl 2-methyl (4aR,8aS)-3-oxoperhydro-2,8a-naphthalenedicarboxylate","","- C15 H22 O5 -","- C15 H22 O5 -","- C30 H44 O10 -","2","1","CF6125","H. Surya Prakash Rao; S. Rajamathe; S. Shanmuga Sundara Raj; Hoong-Kun Fun","8a-Ethyl 2-methyl (4a<i>R</i>,8a<i>S</i>)-3-oxoperhydro-2,8a-naphthalenedicarboxylate","Acta Crystallographica Section E","2001","57","12","o1235","o1236","10.1107/S1600536801020220","","","0.71073","MoKα","","0.0733","0.0562","","","","0.1119","","","","","","0.89","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200629","13.1141","0.0006","3.8137","0.0001","13.1699","0.0007","90","","90.033","0.002","90","","658.67","0.05","120","2","396","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,5-Dichloroaniline","","- C6 H5 Cl2 N -","- C6 H5 Cl2 N -","- C24 H20 Cl8 N4 -","4","1","CF6126","Philip J Cox","2,5-Dichloroaniline, a monoclinic structure with a pseudo-tetragonal unit cell","Acta Crystallographica Section E","2001","57","12","o1203","o1205","10.1107/S1600536801019511","","","0.71073","MoKα","","0.0284","0.0264","","","","0.0738","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200630","15.6898","0.0006","10.5854","0.0004","7.5745","0.0002","90","","90","","90","","1257.99","0.08","120","2","120","2","","","","","","","","2","P b c n","-P 2n 2ab","60","Styrene","Styrene","","- C8 H8 -","- C8 H8 -","- C64 H64 -","8","1","CF6127","Bond, Andrew D.; Davies, John E.","Styrene at 120K","Acta Crystallographica Section E","2001","57","12","o1191","o1193","10.1107/S1600536801019195","","","0.7107","MoKα","","0.0505","0.0376","","","","0.1004","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200631","5.1787","0.0005","9.9128","0.0018","18.918","0.005","90","","90","","90","","971.2","0.3","294","1","294","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)propanoic acid","","- C11 H11 N O3 -","- C11 H11 N O3 -","- C44 H44 N4 O12 -","4","1","CF6128","Gallagher, John F.; Murphy, Carol","Intermolecular hydrogen bonding in (2<i>S</i>)-2-(1-oxo-1<i>H</i>-2,3-dihydroisoindol-2-yl)propanoic acid","Acta Crystallographica Section E","2001","57","12","o1227","o1229","10.1107/S1600536801019754","","","0.71073","MolybdenumKα","","0.053","0.039","","","","0.087","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200632","15.4398","0.0017","12.8818","0.0014","8.1537","0.0009","90","","92.89","0.002","90","","1619.6","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(acetato-O)-diaqua-(2,2'-bipyridine,N,N')cobalt(II)","","- C14 H18 Co N2 O6 -","- C14 H18 Co N2 O6 -","- C56 H72 Co4 N8 O24 -","4","0.5","CF6129","Carballo, Rosa; Covelo, Berta; García-Martínez, Emilia; Vázquez-López, Ezequiel M.","Bis(acetato-<i>O</i>)diaqua(2,2'-bipyridyl-<i>N,N</i>')cobalt(II) (OC-13): a two-dimensional material","Acta Crystallographica Section E","2001","57","12","m597","m599","10.1107/S160053680101995X","","","0.71073","MoKα","","0.0402","0.0322","","","","0.0836","","","","","","1.032","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2200633","4.8118","0.0003","15.4697","0.0014","9.7712","0.0008","90","","101.798","0.005","90","","711.97","0.1","180","2","180","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","p-Xylene-α,α'-diol","1,4-Benzenedimethanol","","- C8 H10 O2 -","- C8 H10 O2 -","- C32 H40 O8 -","4","1","CF6130","Shan, Ning; Jones, William","1,4-Benzenedimethanol","Acta Crystallographica Section E","2001","57","12","o1233","o1234","10.1107/S1600536801019973","","","0.71073","MoKα","","0.0552","0.0401","","","","0.101","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200634","17.8146","0.0002","13.165","0.0002","20.2171","0.0004","90","","90.84","0.01","90","","4740.99","0.13","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5,15-bis(4-pyridyl)-2,8,12,18-tetra-n-butyl-3,7,13,17- tetramethylporphyrinato zinc(II) chloroform solvate","","- C51 H59 Cl3 N6 Zn -","- C51 H59 Cl3 N6 Zn -","- C204 H236 Cl12 N24 Zn4 -","4","1","CI6042","Wild, Kirstie Y.; Therrien, Bruno; Plieger, Paul G.; Officer, David L.; Burrell, Anthony K.","[5,15-Bis(4-pyridyl)-2,8,12,18-tetra-<i>n</i>-butyl-3,7,13,17-tetramethylporphyrinato]zinc(II) chloroform solvate","Acta Crystallographica Section E","2001","57","10","m478","m479","10.1107/S1600536801015264","","","0.71073","MoKα","","0.124","0.065","","","","0.169","","","","","","1.08","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200635","14.191","0.002","10.655","0.001","15.917","0.002","90","","90","","90","","2406.7","0.5","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","Dichlorobis(sarcosinato)zinc(II)","Dichlorobis(sarcosinato)zinc(II)","","- C6 H14 Cl2 N2 O4 Zn -","- C6 H14 Cl2 N2 O4 Zn -","- C48 H112 Cl16 N16 O32 Zn8 -","8","1","CI6057","Subha Nandhini, M.; Krishnakumar, R. V.; Natarajan, S.","Dichlorobis(sarcosinato)zinc(II)","Acta Crystallographica Section E","2001","57","10","m435","m437","10.1107/S1600536801014775","","","1.5418","CuKα","","0.031","0.028","","","","0.075","","","","","","1.18","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200636","7.309","0.001","8.541","0.001","13.412","0.001","90","","96.89","0.01","90","","831.21","0.16","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","octafluoronaphthalene : 1,8-diaminonaphthalene (1/1)","","- C20 H10 F8 N2 -","- C20 H10 F8 N2 -","- C40 H20 F16 N4 -","2","1","CI6058","Batsanov, Andrei S.; Collings, Jonathan C.; Howard, Judith A. K.; Marder, Todd B.","Octafluoronaphthalene‒1,8-diaminonaphthalene (1/1)","Acta Crystallographica Section E","2001","57","10","o950","o952","10.1107/S1600536801015100","","","0.71073","MoKα","","0.036","0.03","","","","0.083","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200637","7.9692","0.0008","11.1288","0.0011","13.5622","0.0013","107.529","0.002","104.567","0.002","101.135","0.002","1061.92","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-Methyl-3-(4-methylphenylsulfonyl)-2-(4-methylphenylsulfonylimino)benzimidazole","","- C22 H21 N3 O4 S2 -","- C22 H21 N3 O4 S2 -","- C44 H42 N6 O8 S4 -","2","1","CI6059","Beloso, Inmaculada; Castro, Jesús; Pérez-Lourido, Paulo","1-Methyl-3-(4-methylphenylsulfonyl)-2-(4-methylphenylsulfonylimino)benzimidazole","Acta Crystallographica Section E","2001","57","11","o1067","o1069","10.1107/S1600536801016075","","","0.71073","MoKα","","0.067","0.048","","","","0.127","","","","","","1","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200638","9.399","0.006","11.836","0.009","8.041","0.003","97.64","0.05","111.08","0.03","71.83","0.07","792.8","0.9","293","2","293","2","","","","","","","","3","P -1","-P 1","2","Pachypodol","4,5'-dihydroxy-3,3',7-trimethoxyflavone","","- C18 H16 O7 -","- C18 H16 O7 -","- C36 H32 O14 -","2","1","CI6060","Graham Smith; Ertong Wang; John P. Bartley; Raymond C. Bott","Pachypodol (4,5'-dihydroxy-3,3',7-trimethoxyflavone)","Acta Crystallographica Section E","2001","57","10","o973","o975","10.1107/S1600536801015252","","","0.71069","MoKα","","0.131","0.045","","","","0.155","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200639","12.18","0.007","10.98","0.003","7.729","0.003","99.75","0.01","108.7","0.02","79","0.3","954.6","1.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","tetra-mu-acetato-O:O'-bis(quinoline-N)diruthenium(II,III)hexafluorophosphate quinoline solvate","","- C35 H33 F6 N3 O8 P Ru2 -","- C35 H33 F6 N3 O8 P Ru2 -","- C35 H33 F6 N3 O8 P Ru2 -","1","0.5","CI6061","Gilfoy, Heather J.; Robertson, Katherine N.; Cameron, T. Stanley; Aquino, Manuel A.S.","Tetra-μ-acetato-<i>O</i>:<i>O</i>'-bis(quinoline-<i>N</i>)diruthenium(II,III) hexafluorophosphate quinoline solvate","Acta Crystallographica Section E","2001","57","11","m496","m497","10.1107/S1600536801016063","","","1.5418","CuKα","","0.057","0.043","","","","0.131","","","","","","1.05","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2200640","11.056","0.0009","5.3326","0.0004","11.4712","0.0007","90","0.01","101.07","0.01","90","0.01","663.73","0.09","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","L-phenylalaninium maleate","L-Phenylalaninium maleate","","- C13 H15 N O6 -","- C13 H15 N O6 -","- C26 H30 N2 O12 -","2","1","CI6062","M. Alagar; R. V. Krishnakumar; S. Natarajan","<small>L</small>-Phenylalaninium maleate","Acta Crystallographica Section E","2001","57","10","o968","o970","10.1107/S1600536801015240","","","1.5418","CuKα","","0.03","0.028","","","","0.078","","","","","","1.13","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200641","7.1468","0.0002","14.8464","0.0005","15.1091","0.0005","90","","97.41","0.001","90","","1589.75","0.09","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,5-Dichloro-3,6-diphenyl-3-azabicyclo[3.2.0]-hept-6-ene-2,4-dione","","- C18 H11 Cl2 N O2 -","- C18 H11 Cl2 N O2 -","- C72 H44 Cl8 N4 O8 -","4","1","CI6063","Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Bao-Guo Zhao; Jian-Hua Xu","1,5-Dichloro-3,6-diphenyl-3-azabicyclo[3.2.0]hept-6-ene-2,4-dione","Acta Crystallographica Section E","2001","57","10","o990","o991","10.1107/S1600536801015665","","","0.71073","MoKα","","0.076","0.055","","","","0.132","","","","","","0.89","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200642","7.5566","0.0005","10.3679","0.0007","12.7275","0.0008","102.273","0.001","100.562","0.001","100.703","0.001","931.28","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4-[α-benzoyl-α-(2-phenylethynyl)methylene]isoquinoline-1,3-dione","","- C25 H15 N O3 -","- C25 H15 N O3 -","- C50 H30 N2 O6 -","2","1","CI6064","Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Yan Zhang; Jian-Hua Xu","4-[α-Benzoyl-α-(2-phenylethynyl)methylene]isoquinoline-1,3-dione","Acta Crystallographica Section E","2001","57","11","o1055","o1057","10.1107/S1600536801016956","","","0.71073","MoKα","","0.099","0.074","","","","0.195","","","","","","0.91","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200643","4.7919","0.0009","15.775","0.003","25.228","0.005","90","","90","","90","","1907","0.6","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N,N'-Di-2-methoxyphenylpyridine-2,6-dicarboxamide","","- C21 H19 N3 O4 -","- C21 H19 N3 O4 -","- C84 H76 N12 O16 -","4","1","CI6065","Yang, Qi Yun; Zhou, Zhong Yuan; Qi, Jian Ying","<i>N</i>,<i>N</i>'-Bis(2-methoxyphenyl)pyridine-2,6-dicarboxamide","Acta Crystallographica Section E","2001","57","12","o1161","o1162","10.1107/S1600536801018694","","","0.71073","MoKα","","0.142","0.041","","","","0.104","","","","","","0.85","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200644","6.183","0.0012","9.648","0.0019","10.534","0.002","104.92","0.03","106.32","0.03","104.4","0.03","546.7","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","DL-valinium maleate","","- C9 H15 N O6 -","- C9 H15 N O6 -","- C18 H30 N2 O12 -","2","1","CI6067","M. Alagar; R. V. Krishnakumar; A. Mostad; S. Natarajan","<small>DL</small>-Valinium maleate at 150K","Acta Crystallographica Section E","2001","57","11","o1102","o1104","10.1107/S1600536801017391","","","0.71073","MoKα","","0.049","0.045","","","","0.134","","","","","","1.09","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200645","7.0167","0.0009","9.137","0.001","12.43","0.001","90.77","0.01","99.736","0.009","95.7","0.01","781.17","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","4-aminobenzenesulfonamide 3,5-dinitrosalicylate","","","- C13 H12 N4 O9 S -","- C13 H12 N4 O9 S -","- C26 H24 N8 O18 S2 -","2","1","CI6068","Graham Smith; Urs D. Wermuth; Jonathan M. White","The 1:1 proton-transfer compound of sulfanilamide with 3,5-dinitrosalicylic acid","Acta Crystallographica Section E","2001","57","11","o1036","o1038","10.1107/S1600536801016841","","","0.71069","MoKα","","0.045","0.037","","","","0.098","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200646","19.929","0.001","4.3417","0.0002","22.788","0.002","90","","91.4","0.01","90","","1971.2","0.2","293","2","293","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","1,3-bis(8-chlorotheophyllin-7-yl)propane","1,3-bis(8-chlorotheophyllin-7-yl)propane","","- C17 H18 Cl2 N8 O4 -","- C17 H18 Cl2 N8 O4 -","- C68 H72 Cl8 N32 O16 -","4","0.5","CI6069","Maulik, Prakas R.; Avasthi, Kamlakar; Sarkhel, Sanjay; Sharon, Ashoke; Rawat, Diwan S.; Bal, Chandralata","1,3-Bis(8-chlorotheophyllin-7-yl)propane: a molecule with no intramolecular stacking","Acta Crystallographica Section E","2001","57","12","o1163","o1165","10.1107/S1600536801018670","","","0.71073","MoKα","","0.047","0.037","","","","0.098","","","","","","1.07","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200647","8.9118","0.0018","9.4953","0.0019","23.628","0.005","90","","90","","90","","1999.4","0.7","123","2","123","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","Cinnamonylaceton","6-phenyl-hex-5-ene-2,3-dione","","- C12 H12 O2 -","- C12 H12 O2 -","- C96 H96 O16 -","8","1","CI6070","Arrieta, Antonio F.; Arvid Mostad","Orthorhombic form of 6-phenylhex-5-ene-2,4-dione","Acta Crystallographica Section E","2001","57","12","o1198","o1199","10.1107/S1600536801018669","","","0.71073","MoKα","","0.051","0.041","","","","0.137","","","","","","1.12","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200648","8.957","0.001","9.667","0.001","9.827","0.001","110.1","0.01","92.42","0.01","110.39","0.01","736.21","0.16","293","2","293","2","","","","","","","","3","P 1","P 1","1","Rearranged taxoid","10,13-Deacetyl abeo-baccatin IV","","- C28 H40 O12 -","- C28 H40 O12 -","- C28 H40 O12 -","1","1","CI6071","Chattopadhyay, Sunil K.; Sharon, Ashoke; Yadav, Umesh; Srivastava, Sachin; Mehta, Vijay K.; Maulik, Prakas R.","A taxane diterpenoid from the needles of <i>Taxus wallichiana</i>","Acta Crystallographica Section E","2001","57","12","o1158","o1160","10.1107/S1600536801018773","","","0.71073","MoKα","","0.039","0.038","","","","0.105","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200649","14.2875","0.0004","14.5396","0.0004","20.2212","0.0006","90","","101.504","0.001","90","","4116.3","0.2","223","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Chlorotri(p-methoxyphenyl)phosphinegold(I)","","- C21 H21 Au Cl O3 P -","- C21 H21 Au Cl O3 P -","- C168 H168 Au8 Cl8 O24 P8 -","8","1","CI6073","Soo Yei, Ho; Tiekink, Edward R. T.","Chloro[tris(<i>p</i>-methoxyphenyl)phosphine]gold(I)","Acta Crystallographica Section E","2001","57","11","m549","m550","10.1107/S1600536801017895","","","0.71069","MoKα","","0.036","0.028","","","","0.064","","","","","","0.95","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200650","9.5207","0.001","9.1141","0.001","14.1033","0.0014","90","","101.957","0.008","90","","1197.2","0.2","89","2","89","2","","","","","","","","6","P 1 21 1","P 2yb","4","oxazolidinone derivative","(3R,4S,5R,6R)-5-[(1R)-1-Chloro(phenylmethyl)]-3-[(4-methylphenyl) sulfonyl]-4-phenyl-1-aza-8-oxabicyclo[4.3.0]nonan-9-one","","- C27 H26 Cl N O4 S -","- C27 H26 Cl N O4 S -","- C54 H52 Cl2 N2 O8 S2 -","2","1","CI6075","Mariuska Reynoso-Paz; Marilyn M. Olmstead; Mark J. Kurth; Neil E. Schore","An enantiopure bicyclic pentasubstituted piperidine","Acta Crystallographica Section E","2001","57","12","o1177","o1178","10.1107/S1600536801019055","","","0.71073","MoKα","","0.037","0.03","","","","0.071","","","","","","0.97","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200651","7.949","0.005","11.54","0.007","12.118","0.007","83.2","0.011","85.971","0.012","77.557","0.011","1076.7","1.1","293","2","","","","","","","","","","4","P -1","-P 1","2","","3,6-di-2-pyridyl-1-H-4-(1,4-di-2-pyridyl-2,3-diaze-4-carbonyl)-1-yl- 1,2,4,5-tetrazine","","- C24 H18 N10 O -","- C24 H18 N10 O -","- C48 H36 N20 O2 -","2","1","CI6079","Li-Ya Wang; Chun-Xia Du; Yu-Qin Fu","3,6-Di-2-pyridyl-4-{[(2-pyridyl)carbonyldiazenyl](2-pyridyl)methyl}-1<i>H</i>-1,2,4,5-tetrazine: the proton-assisted hydrolysis product of 3,6-di-2-pyridyl-1,2,4,5-tetrazine (dptz)","Acta Crystallographica Section E","2001","57","12","o1237","o1239","10.1107/S1600536801020049","","","0.71073","MoKα","","0.175","0.056","","","","0.086","","","","","","0.88","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200652","11.782","0.004","10.288","0.003","20.461","0.003","90","","100.2","0.02","90","","2440.9","1.2","298","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 Cl N O -","- C14 H14 Cl N O -","- C112 H112 Cl8 N8 O8 -","8","2","CI6084","A. Thiruvalluvar; V. Parthasarathi; V. Kabaleeswaran; S. S. Rajan; A. Nagarajan; M. Krishna Pillay","5-(4-Chlorophenyl)-3-oxa-4-azatricyclo[5.2.1.0^2,6^]dec-4-ene","Acta Crystallographica Section E","2001","57","12","o1240","o1241","10.1107/S1600536801020268","","","1.5418","CuKα","","","0.047","","","","0.144","","","","","","1.05","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"2200653","11.6758","0.0001","12.9704","0.0001","15.2874","0.0002","110.272","0.0004","109.81","0.0005","92.8572","0.0004","2006.16","0.04","123","1","123","1","","","","","","","","6","P -1","-P 1","2","","Dichlorobis(triphenylphosphine oxide)zinc(II)","","- C44 H46 Cl2 O4 P2 Zn -","- C44 H46 Cl2 O4 P2 Zn -","- C88 H92 Cl4 O8 P4 Zn2 -","2","1","CV6052","Zeller, A.; Herdtweck, E.; Strassner, T.","Dichlorobis(triphenylphosphine oxide)zinc(II) tetrahydrofuran disolvate","Acta Crystallographica Section E","2001","57","10","m480","m482","10.1107/S1600536801015318","","","0.71073","MoKα","","0.0359","0.0326","","","","0.0872","","","","","","1.049","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200654","7.009","","19.8634","0.0004","16.2811","0.0003","90","","101.422","0.001","90","","2221.81","0.06","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Aqua(N,N'-disalicylideneethylenediamino-N,N'O,O')(4,5-imidazoledicarboxylato- O)manganese(III) monohydrate","","- C21 H21 Mn N4 O8 -","- C21 H21 Mn N4 O8 -","- C84 H84 Mn4 N16 O32 -","4","1","CV6053","Huang, Deguang; Zhang, Xiaofeng; Zhu, Hongping; Chen, Changneng; Liu, Qiutian","Aqua(<i>N,N</i>'-disalicylideneethylenediamino-<i>N,N</i>'<i>,O,O</i>')(4,5-imidazoledicarboxylato-<i>O</i>)manganese(III) monohydrate","Acta Crystallographica Section E","2001","57","10","m441","m443","10.1107/S1600536801014817","","","0.71073","MoKα","","0.0524","0.037","","","","0.1304","","","","","","0.967","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2200655","7.266","0.002","13.925","0.003","30.327","0.006","90","","90","","90","","3068.5","1.2","193","2","193","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","catena-Poly[[dicyanamidobis(3-hydroxypyridine-N)copper(II)]-μ-dicyanamido]","","- C14 H10 Cu N8 O2 -","- C14 H10 Cu N8 O2 -","- C112 H80 Cu8 N64 O16 -","8","1","CV6054","Albada, Gerard A. van; Mutikainen, Ilpo; Turpeinen, Urho; Reedijk, Jan","<i>catena</i>-Poly[[dicyanamidobis(3-hydroxypyridine-<i>N</i>)copper(II)]-μ-dicyanamido]","Acta Crystallographica Section E","2001","57","10","m421","m423","10.1107/S160053680101460X","","","1.5418","CuKα","","0.0543","0.0407","","","","0.1198","","","","","","0.81","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200656","14.173","0.002","11.146","0.002","16.571","0.003","90","","93.82","0.01","90","","2611.9","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Heptacarbonyl-κ^3^C,2κ^4^C-{μ-dicyclohexyl[(η^5^)-cyclopentadienyl]- phosphine-2κP}molybdenumrhenium(Mo—Re)","","- C24 H26 Mo O7 P Re -","- C24 H26 Mo O7 P Re -","- C96 H104 Mo4 O28 P4 Re4 -","4","1","CV6055","Flörke, Ulrich","Heptacarbonyl-κ^3^<i>C</i>,2κ^4^<i>C</i>-{μ-dicyclohexyl[1(η^5^)-cyclopentadienyl]phosphine-2κ<i>P</i>}molybdenumrhenium(<i>Mo</i>‒<i>Re</i>)","Acta Crystallographica Section E","2001","57","10","m424","m425","10.1107/S1600536801014684","","","0.71073","MoKα","","0.0902","0.0429","","","","0.0898","","","","","","0.964","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200657","12.4163","0.0002","8.3038","0.0002","16.4517","0.0003","90","","106.949","0.001","90","","1622.54","0.06","150","1","150","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diethylammonium diphenylphosphinate","","- C16 H22 N O2 P -","- C16 H22 N O2 P -","- C64 H88 N4 O8 P4 -","4","1","CV6056","Dorn, Hendrik; Lough, Alan J.; Manners, Ian","Diethylammonium diphenylphosphinate","Acta Crystallographica Section E","2001","57","10","o928","o929","10.1107/S1600536801014696","","","0.71073","MoKα","","0.047","0.0399","","","","0.1059","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200658","5.994","0.002","10.182","0.005","11.479","0.005","109.43","0.05","99.76","0.04","97.37","0.05","638.1","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Phenyl 2,4,6-tribromophenyl ether","","- C12 H7 Br3 O -","- C12 H7 Br3 O -","- C24 H14 Br6 O2 -","2","1","CV6057","Eriksson, Lars; Hu, Jiwei","Phenyl 2,4,6-tribromophenyl ether","Acta Crystallographica Section E","2001","57","10","o930","o932","10.1107/S1600536801014702","","","0.71073","MoKα","","0.0565","0.0334","","","","0.0655","","","","","","1.23","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200659","17.848","0.002","5.2214","0.0007","9.568","0.001","90","","105.7","0.01","90","","858.39","0.18","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H9 N O2 -","- C10 H9 N O2 -","- C40 H36 N4 O8 -","4","1","CV6058","Degen, Alexander; Bolte, Michael","The twinned crystal structure of 3-indolylacetic acid","Acta Crystallographica Section E","2001","57","11","o999","o1000","10.1107/S160053680101532X","","","0.71073","MoKα","","0.038","0.0286","","","","0.0743","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200660","42.138","0.002","19.4444","0.001","26.255","0.002","90","","110.969","0.01","90","","20087","2","150","2","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C90 H76 F36 N6 O12.5 Zn3 -","- C90 H76 F36 N6 O12.5 Zn3 -","- C720 H608 F288 N48 O100 Zn24 -","8","1","CV6059","Coles, Simon J.; Granifo, Juan; Hursthouse, Michael B.; Osborne, Anthony G.","<i>mer</i>-Bis{2,6-bis[1-(4-<i>tert</i>-butylphenylimino)ethyl]pyridine}zinc(II) bis[tris(hexafluoroacetylacetonato)zincate(II)] diethyl ether hemisolvate","Acta Crystallographica Section E","2001","57","11","m535","m537","10.1107/S1600536801015458","","","0.71069","MoKα","","","0.0612","","","","0.129","","","","","","0.758","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2200661","9.443","0.0003","10.139","0.0003","14.138","0.0007","96.023","0.001","95.676","0.001","112.223","0.002","1231.94","0.08","110","2","110","2","","","","","","","","3","P -1","-P 1","2","","N,N'-bis(4-cyanopyridylidene)benzil dihydrazone","","- C30 H20 N6 -","- C30 H20 N6 -","- C60 H40 N12 -","2","1","CV6060","Goutam Kumar Patra; Israel Goldberg","<i>N,N</i>'-Bis(4-cyanopyridylidene)benzil dihydrazone","Acta Crystallographica Section E","2001","57","10","o988","o989","10.1107/S1600536801015768","","","0.7107","MoKα","","0.1383","0.0561","","","","0.1536","","","","","","0.972","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200662","11.918","0.0002","15.97","0.0002","33.193","0.0006","90","","90","","90","","6317.64","0.17","110","2","110","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Tetrakis(4-acetylpyridine)diisothiocyanatocobalt(II)","","- C30 H28 Co N6 O4 S2 -","- C30 H28 Co N6 O4 S2 -","- C240 H224 Co8 N48 O32 S16 -","8","1","CV6061","Goutam Kumar Patra; Israel Goldberg","Tetrakis(4-acetylpyridine)diisothiocyanatocobalt(II)","Acta Crystallographica Section E","2001","57","10","m483","m484","10.1107/S1600536801015446","","","0.71073","MoKα","","0.1039","0.0456","","","","0.1147","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200663","19.997","0.002","6.2259","0.001","13.5028","0.001","90","","103.02","0.02","90","","1637.9","0.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Dichlorobis(DL-valine)zinc(II)","Dichlorobis(DL-valine)zinc(II)","","- C10 H22 Cl2 N2 O4 Zn -","- C10 H22 Cl2 N2 O4 Zn -","- C40 H88 Cl8 N8 O16 Zn4 -","4","0.5","CV6062","M. Subha Nandhini; R. V. Krishnakumar; S. Natarajan","Dichlorobis(<small>DL</small>-valine)zinc(II)","Acta Crystallographica Section E","2001","57","11","m498","m500","10.1107/S1600536801016099","","","1.5418","CuKα","","0.0533","0.0527","","","","0.1372","","","","","","1.109","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200664","22.9292","0.0006","9.5033","0.0003","7.5152","0.0002","90","","90","","90","","1637.59","0.08","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","p-Methoxybenzaldehyde-9-fluorenylidenehydrazone","","- C21 H16 N2 O -","- C21 H16 N2 O -","- C84 H64 N8 O4 -","4","1","CV6063","Hoong-Kun Fun; Suchada Chantrapromma; Ibrahim Abdul Razak; Anwar Usman; Wen Ma; Yu Peng Tian; Sheng Yi Zhang; Wu Jie Ying; Fu Xin Xie","<i>p</i>-Methoxybenzaldehyde 9-fluorenylidenehydrazone","Acta Crystallographica Section E","2001","57","11","o1043","o1044","10.1107/S1600536801016555","","","0.71073","MoKα","","0.116","0.0524","","","","0.1245","","","","","","0.94","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200665","7.1944","0.0006","7.592","0.0003","15.919","0.0015","90","","90","","90","","869.49","0.11","203","2","203","2","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","α-Pinene","(1S)-(-)-α-Pinene","","- C10 H16 -","- C10 H16 -","- C40 H64 -","4","1","","Bond, Andrew D.; Davies, John E.","(1S)-(-)-α-Pinene","Acta Crystallographica Section E","2001","57","11","o1039","o1040","10.1107/S1600536801016415","","","0.7107","MoKα","","0.0559","0.0457","","","","0.1029","","","","","","1.064","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200666","7.5079","0.0003","9.3361","0.0008","12.4875","0.0011","90","","90","","90","","875.31","0.11","185","2","185","2","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","β-Pinene: Nopinene","(1S)-(-)-β-Pinene","","- C10 H16 -","- C10 H16 -","- C40 H64 -","4","1","CV6065","Bond, Andrew D.; Davies, John E.","(1<i>S</i>)-(‒)-β-Pinene","Acta Crystallographica Section E","2001","57","11","o1041","o1042","10.1107/S1600536801016427","","","0.7107","MoKα","","0.0724","0.0603","","","","0.1552","","","","","","1.091","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200667","14.042","0.002","8.924","0.002","16.091","0.003","90","","94.41","0.002","90","","2010.4","0.7","173","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Hydrated sodium cytidine-5'-monophosphate","","- C9 H25 N3 Na2 O14.5 P -","- C9 H12 N3 Na2 O14.5 P -","- C36 H48 N12 Na8 O58 P4 -","4","2","CV6066","Gh. Borodi; A. Hernanz; I. Bratu; Mihaela Pop; R. Navarro","Hydrated sodium cytidine-5'-monophosphate","Acta Crystallographica Section E","2001","57","11","m514","m516","10.1107/S1600536801016786","","","0.7107","MoKα","","0.1644","0.0613","","","","0.186","","","","","","1.05","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2200668","7.7184","0.0015","7.8674","0.0016","25.374","0.005","90","","90","","90","","1540.8","0.5","120","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H19 Br O4 -","- C15 H19 Br O4 -","- C60 H76 Br4 O16 -","4","1","CV6067","Coles, Simon J.; Hursthouse, Michael B.","(2<i>S</i>)-1-(4-Bromophenyl)-2-hydroxy-2-[(2<i>S</i>,5<i>R</i>)-5-(1-hydroxy-1-methylethyl)-tetrahydrofuran-2-yl]ethanone","Acta Crystallographica Section E","2001","57","11","o1061","o1062","10.1107/S1600536801017020","","","0.71073","MoKα","","","0.0691","","","","0.1931","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200669","8.9295","0.0018","14.792","0.003","25.812","0.005","90","","90","","90","","3409.4","1.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C14 H27 Cl P Rh -","- C14 H27 Cl P Rh -","- C112 H216 Cl8 P8 Rh8 -","8","1","CV6068","Wendt Ola F.","Chloro(methyl)(η^5^-pentamethylcyclopentadienyl)(trimethylphosphine)rhodium(III)","Acta Crystallographica Section E","2001","57","11","m517","m518","10.1107/S1600536801016798","","","0.71073","MoKα","","0.1201","0.0537","","","","0.1652","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200670","5.3067","0.0002","9.3552","0.0006","20.0955","0.0012","90","","90","","90","","997.65","0.1","262","2","262","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C8 H13 Cl O3 -","- C8 H13 Cl O3 -","- C32 H52 Cl4 O12 -","4","1","CV6069","Davies, J. E.; Hook, D. F.; Ley, S. V.","(‒)-(4<i>S</i>)-1-Chloro-3-(2,2-dimethyl-1,3-dioxolan-4-yl)propan-2-one","Acta Crystallographica Section E","2001","57","11","o1098","o1099","10.1107/S1600536801017512","","","0.71073","MoKα","","0.058","0.0395","","0.1012","","0.0932","","","1.144","","","1.197","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200671","12.017","0.002","10.09","0.003","8.804","0.004","84.43","0.003","94.9","0.003","104.59","0.003","1026.1","0.6","293","2","290","","","","","","","","","4","P -1","-P 1","2","trimethoprim glutarate","2,4-diamino-5-(3,4,5-trimethoxybenzyl)pyrimidin-1-ium glutarate","","- C19 H26 N4 O7 -","- C19 H26 N4 O7 -","- C38 H52 N8 O14 -","2","1","CV6070","Justin Robert, Jebamony; Baskar Raj, Savarimuthu; Thomas Muthiah, Packianathan","N—H···O and O—H···O hydrogen bonds in crystal engineering: trimethoprim hydrogen glutarate","Acta Crystallographica Section E","2001","57","12","o1206","o1208","10.1107/S1600536801018001","","","1.5418","CuKα","","0.048","0.048","","0.1402","","0.1401","","","","","","1.113","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200672","7.229","0.001","23.242","0.001","20.373","0.001","90","","98.59","0.01","90","","3384.6","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Trimethoprim sulfate trihydrate","","","- C28 H44 N8 O13 S -","- C28 H44 N8 O13 S -","- C112 H176 N32 O52 S4 -","4","1","CV6071","Thomas Muthiah, Packianathan; Umadevi, Balakrishnan; Stanley, Nithianantham; Shui, Xiugi; Eggleston, Drake S","Hydrogen bonding patterns in trimethoprim sulfate trihydrate [trimethoprim = 2,4-diamino-5-(3,4,5-methoxybenzyl)pyrimidine]","Acta Crystallographica Section E","2001","57","12","o1179","o1182","10.1107/S1600536801018657","","","0.71069","MoKα","","0.0449","0.0361","","","","0.0916","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200673","7.7864","0.0008","7.0874","0.0007","14.5616","0.0015","90","","90.174","0.002","90","","803.58","0.14","293","2","293","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","C18 H14 Cl2 Co N2","dichlorobis(quinoline-N)cobalt(II)","","- C18 H14 Cl2 Co N2 -","- C18 H14 Cl2 Co N2 -","- C36 H28 Cl4 Co2 N4 -","2","0.5","CV6072","Wang, Wenguo; Huang, Deguang; Zhu, Hongping; Chen, Changneng; Liu, Qiutian","Monoclinic form of dichlorobis(quinoline-<i>N</i>)cobalt(II)","Acta Crystallographica Section E","2001","57","12","m587","m588","10.1107/S1600536801019420","","","0.71073","MoKα","","0.0362","0.0291","","","","0.0809","","","","","","1.022","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200674","10.6627","0.0012","18.549","0.002","14.742","0.002","90","","95.293","0.01","90","","2903.3","0.6","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tris(trimethylsilylmethyl)bis(tetrahydrofuran-O)ytterbium(III)","","- C20 H49 O2 Si3 Yb -","- C20 H49 O2 Si3 Yb -","- C80 H196 O8 Si12 Yb4 -","4","1","CV6074","Niemeyer, Mark","A trigonal-bipyramidal coordinated ytterbium(III) alkyl: tris(trimethylsilylmethyl)bis(tetrahydrofuran-<i>O</i>)ytterbium(III)","Acta Crystallographica Section E","2001","57","12","m553","m555","10.1107/S1600536801018566","","","0.71073","MoKα","","0.094","0.055","","","","0.127","","","","","","1.153","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200675","9.753","0.001","10.069","0.001","12.255","0.001","98.17","0.01","103.37","0.01","111.63","0.01","1053.5","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","O,O-Diphenyl 1-(3-phenylthioureido)ethanephosphonate","","- C21 H21 N2 O3 P S -","- C21 H21 N2 O3 P S -","- C42 H42 N4 O6 P2 S2 -","2","1","CV6077","Chęcińska, Lilianna; Małecka, Magdalena; Olszak, Tomasz A.; Kudzin, Zbigniew H.","<i>O,O</i>-Diphenyl 1-(3-phenylthioureido)ethanephosphonate","Acta Crystallographica Section E","2001","57","12","o1216","o1218","10.1107/S1600536801019729","","","1.54178","CuKα","","0.0779","0.051","","","","0.1301","","","","","","1.041","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200676","7.6104","0.0006","7.8699","0.0007","9.8571","0.0009","81.891","0.002","83.268","0.002","85.499","0.002","579.29","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-Chlorobenzoxazolo[3,2-b]isoquinolin-6-one","","- C15 H8 Cl N O2 -","- C15 H8 Cl N O2 -","- C30 H16 Cl2 N2 O4 -","2","1","CV6078","Thangavel Ravishankar; Kandasamy Chinnakali; A. Senthilvelan; Hoong-Kun Fun; Vayalakkavoor T. Ramakrishnan; Suchada Chantrapromma; Ibrahim Abdul Razak; Anwar Usman","2-Chlorobenzoxazolo[3,2-<i>b</i>]isoquinolin-6-one","Acta Crystallographica Section E","2001","57","12","o1209","o1210","10.1107/S1600536801019274","","","0.71073","MoKα","","0.097","0.069","","","","0.173","","","","","","0.93","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200677","10.061","0.001","20.561","0.001","11.375","0.001","90","","105.38","0.01","90","","2268.8","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","O,O-diphenyl 1-(3-phenylthioureido)-2-methylpropanephosphonate","","- C23 H25 N2 O3 P S -","- C23 H25 N2 O3 P S -","- C92 H100 N8 O12 P4 S4 -","4","1","CV6079","Chęcińska, Lilianna; Małecka, Magdalena; Olszak, Tomasz A.; Kudzin, Zbigniew H.","<i>O,O</i>-Diphenyl 2-methyl-1-(3-phenylthioureido)propanephosphonate","Acta Crystallographica Section E","2001","57","12","o1213","o1215","10.1107/S1600536801019730","","","1.54178","CuKα","","0.0714","0.0537","","","","0.141","","","","","","0.918","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200678","9.7151","0.0002","11.6911","0.0003","12.4332","0.0003","77.401","0.001","80.521","0.001","70.905","0.001","1295.65","0.05","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Trans-2-(2-bromo-4-methylphenyloxy)-cyclohexanol","","- C13 H17 Br O2 -","- C13 H17 Br O2 -","- C52 H68 Br4 O8 -","4","2","CV6080","Thangavel Ravishankar; Kandasamy Chinnakali; Kamaraj Sriraghavan; Vayalakkavoor T.Ramakrishnan; Hoong-Kun Fun; Suchada Chantrapromma; Ibrahim Abdul Razak; Anwar Usman","<i>trans</i>-2-(2-Bromo-4-methylphenyloxy)cyclohexanol","Acta Crystallographica Section E","2001","57","12","o1211","o1212","10.1107/S1600536801019432","","","0.71073","MoKα","","0.0909","0.0473","","","","0.1217","","","","","","0.995","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200679","7.6602","0.0015","11.12","0.002","12.572","0.003","94.09","0.03","102.64","0.03","95.77","0.03","1034.8","0.4","120","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C9 H10 O5 S -","- C9 H10 O5 S -","- C36 H40 O20 S4 -","4","2","DN6004","Coles, Simon J.; Guthmann, Holger; Hursthouse, Michael B.; Murphy, Patrick J.","2-Ethyl 5-methyl 3-hydroxythiophene-2,5-dicarboxylate","Acta Crystallographica Section E","2001","57","10","o976","o977","10.1107/S1600536801015379","","","0.71073","MoKα","","","0.0845","","","","0.2677","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200680","10.602","0.003","7.288","0.001","13.224","0.008","90","","93.8","0.02","90","","1019.5","0.7","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,4,6-trimethoxybenzoic acid","","- C10 H12 O5 -","- C10 H12 O5 -","- C40 H48 O20 -","4","1","DN6005","Jean-Claude, Wallet; Elies, Molins; Carlos, Miravitlles","2,4,6-Trimethoxybenzoic acid","Acta Crystallographica Section E","2001","57","11","o1073","o1074","10.1107/S1600536801016610","","","0.71073","MoKα","","0.0647","0.0458","","","","0.1501","","","","","","1.079","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200681","18.297","0.002","7.7645","0.0009","11.928","0.0008","90","","102.681","0.007","90","","1653.2","0.3","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(Pyridin-2-yl)-3-méthyl-4-(1-pyridin-2-yl-3-méthyl-1H-pyrazol-5-yl) -2H-3-pyrazoline-5(1H)-one","","- C18 H16 N6 O -","- C18 H16 N6 O -","- C72 H64 N24 O4 -","4","1","DN6006","Djerrari, B.; Essassi, E. M.; Fifani, J.; Pierrot, M.","3-Méthyl-1-(pyridin-2-yl)-4-(1-pyridin-2-yl-3-méthyl-1<i>H</i>-pyrazol-5-yl)-2<i>H</i>-3-pyrazolin-5(1<i>H</i>)-one","Acta Crystallographica Section E","2001","57","11","o1126","o1127","10.1107/S1600536801018062","","","0.71073","MoKα","","0.0718","0.0557","","","","0.1268","","","","","","1.116","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200682","10.8658","0.0007","9.4435","0.0005","11.7323","0.0008","90","","112.74","0.006","90","","1110.29","0.12","213","2","213","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(±)-(1RS,2SR)-1,2-Di(2'-methyl-3'-oxo-cyclohex-1'-enyl)-1,2-diphenylethan","","- C28 H30 O2 -","- C28 H30 O2 -","- C56 H60 O4 -","2","0.5","","Ibrahim, Hasim; Bach, Thorsten; Harms, Klaus","(±)-(1RS,2SR)-1,2-Bis(2'-methyl-3'-oxo-cyclohex-1'-enyl)-1,2-diphenylethane","Acta Crystallographica Section E","2001","57","12","o1145","o1146","10.1107/S1600536801018384","","","1.54178","CuKα","","0.0643","0.058","","","","0.165","","","","","","1.072","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2200683","11.514","0.0006","11.207","0.0004","11.848","0.0006","90","","109.341","0.002","90","","1442.55","0.12","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C31 H48 O4 -","- C31 H48 O4 -","- C62 H96 O8 -","2","1","DN6009","Daoubi, M.; Benharref, A.; Pierrot, M.","3β-Acétoxy nor-31-lanostène-7,11-dione","Acta Crystallographica Section E","2001","57","12","o1187","o1188","10.1107/S1600536801019122","","","0.7107","MoKα","","0.0617","0.0543","","","","0.1437","","","","","","1.066","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200684","12.7109","0.0001","14.1115","0.0002","27.0317","0.0003","90","","90","","90","","4848.67","0.1","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","mer,trans-{2,6-bis[(dimethylamino)methyl]pyridine}dichloropyridineruthenium(II) toluene solvate","","- C23 H32 Cl2 N4 Ru -","- C23 H32 Cl2 N4 Ru -","- C184 H256 Cl16 N32 Ru8 -","8","1","NA6084","Back, Stephan; Rheinwald, Gerd; del Río, Ignacio; van Koten, Gerard; Lang, Heinrich","[<i>mer,trans</i>-(NN'N)RuCl~2~(NC~5~H~5~)]·C~7~H~8~ {NN'N = 2,6-bis-[(dimethylamino)methyl]pyridine}","Acta Crystallographica Section E","2001","57","10","m444","m445","10.1107/S1600536801014878","","","0.71073","MoKα","","0.069","0.0515","","","","0.1171","","","","","","1.191","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200685","7.652","0.007","8.903","0.006","14.664","0.016","97.38","0.08","95.06","0.07","114.22","0.06","892.5","1.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis(N,N-diethylnicotinamide)bis(2-hydroxybenzoato)zinc(II)","","- C34 H42 N4 O10 Zn -","- C34 H42 N4 O10 Zn -","- C34 H42 N4 O10 Zn -","1","0.5","NA6091","Necefoglu, Hacali; Clegg, William; Scott, Andrew J.","Diaquabis(<i>N,N</i>-diethylnicotinamide)bis(2-hydroxybenzoato)zinc(II)","Acta Crystallographica Section E","2001","57","10","m462","m464","10.1107/S1600536801015021","","","0.71073","MoKα","","0.0534","0.0503","","","","0.1284","","","","","","1.116","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200686","7.211","0.003","8.588","0.004","16.515","0.007","96","0.02","100.79","0.02","112.09","0.03","913.6","0.7","160","2","160","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis(N,N-diethylnicotinamide)bis(4-nitrobenzoato)zinc(II)","","- C34 H40 N6 O12 Zn -","- C34 H40 N6 O12 Zn -","- C34 H40 N6 O12 Zn -","1","0.5","NA6092","Necefoglu, Hacali; Clegg, William; Scott, Andrew J.","Diaquabis(<i>N,N</i>-diethylnicotinamide)bis(4-nitrobenzoato)zinc(II)","Acta Crystallographica Section E","2001","57","10","m465","m466","10.1107/S1600536801015033","","","0.71073","MoKα","","0.0314","0.0258","","","","0.0676","","","","","","1.096","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200687","14.6542","0.0011","14.3344","0.0014","12.722","0.0012","90","","95.606","0.009","90","","2659.6","0.4","293","2","291","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis[(4-ethoxyphenyl)aminoacetyl]-4,5-dimethyl-o-phenylenediamine","","- C28 H34 N4 O4 -","- C28 H34 N4 O4 -","- C112 H136 N16 O16 -","4","1","NA6093","Kruszynski, Rafal; Bartczak, Tadeusz J.; Mikiciuk-Olasik, Elżbieta","<i>N,N</i>'-Bis[(4-ethoxyphenyl)aminoacetyl]-4,5-dimethyl-<i>o</i>-phenylenediamine","Acta Crystallographica Section E","2001","57","10","o953","o955","10.1107/S1600536801015306","","","1.54052","CuKα","","0.1154","0.0477","","","","0.1748","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200688","13.321","0.003","9.101","0.002","14.279","0.003","90","","112.77","0.03","90","","1596.2","0.7","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","r-1,c-2,c-3,t-4,5-pentachloro-6-phenyltetralin","","- C16 H11 Cl5 -","- C16 H11 Cl5 -","- C64 H44 Cl20 -","4","1","NA6094","Bruno, Giuseppe; Panzalorto, Manuela; Nicoló, Francesco; Giannetto, Michele","<i>r</i>-1,<i>c</i>-2,<i>c</i>-3,<i>t</i>-4,5-Pentachloro-6-phenyltetralin","Acta Crystallographica Section E","2001","57","11","o1045","o1046","10.1107/S1600536801016762","","","0.71073","MoKα","","0.0697","0.0468","","0.154","","0.1274","","","1.01","","","1.038","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200689","13.009","0.003","4.688","0.001","17.607","0.004","90","","103.6","0.02","90","","1043.7","0.4","290","1","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H14 N O4 P -","- C8 H14 N O4 P -","- C32 H56 N4 O16 P4 -","4","1","NA6095","Fábry, Jan; Krupková, Radmila; Vaněk, Přemysl","2,4-Dimethylanilinium dihydrogenphosphate","Acta Crystallographica Section E","2001","57","11","o1058","o1060","10.1107/S1600536801016191","","","0.710688","MoKα","","0.1004","0.0341","","","","0.0406","","","1.75","1.43","1.43","1.75","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200690","13.899","0.007","9.956","0.008","9.051","0.002","90","","108.726","0.008","90","","1186.2","1.2","293","2","293","2","","","","","","","","5","P 1 c 1","P -2yc","7","DL-phenylalaninium dihydrogen phosphate","DL-phenylalaninium dihydrogen phosphate","","- C9 H14 N O6 P -","- C9 H14 N O6 P -","- C36 H56 N4 O24 P4 -","4","2","NA6096","B. Ravikumar; B. Sridhar; R. K. Rajaram","<small>DL</small>-Phenylalaninium dihydrogen phosphate","Acta Crystallographica Section E","2001","57","11","o1078","o1080","10.1107/S1600536801016993","","","0.71073","MoKα","","0.0318","0.0277","","","","0.0744","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200691","9.6907","0.0009","10.3119","0.001","11.2549","0.0011","63.954","0.001","70.282","0.001","87.414","0.002","944.14","0.16","150","2","150","2","","","","","","","","6","P -1","-P 1","2","[Ni(II)(DMSO)6][2(NO3)][2(DMSO)]","","","- C16 H48 N2 Ni O14 S8 -","- C16 H48 N2 Ni O14 S8 -","- C16 H48 N2 Ni O14 S8 -","1","0.5","NA6097","Blake, Alexander J.; Felloni, Marina; Hubberstey, Peter; Schröder, Martin; Wilson, Claire","Hexakis(dimethyl sulfoxide)nickel(II) dinitrate dimethyl sulfoxide disolvate","Acta Crystallographica Section E","2001","57","12","m556","m557","10.1107/S1600536801016403","","","0.71073","MoKα","","0.0233","0.0211","","","","0.0574","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200692","7.5556","0.0003","8.0446","0.0003","22.9549","0.0008","90","","90","","90","","1395.24","0.09","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2-Hydroxy-2-[5-(1-hydroxy-1-methyl-ethyl)-tetrahydro-furan-2-yl]-1-phenyl- ethanone","","- C15 H20 O4 -","- C15 H20 O4 -","- C60 H80 O16 -","4","1","NA6098","Light, Mark E.; Hursthouse, Michael B.","(2<i>S</i>*)-2-Hydroxy-2-[(2<i>S</i>*,5<i>R</i>*)-5-(1-hydroxy-1-methylethyl)tetrahydrofuran-2-yl]-1-phenylethanone","Acta Crystallographica Section E","2001","57","12","o1194","o1195","10.1107/S1600536801017007","","","0.71073","MoKα","","0.0637","0.054","","","","0.1464","","","","","","1.029","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200693","10.973","0.002","12.764","0.003","20.721","0.004","90","","90","","90","","2902.2","1","150","2","150","2","","","","","","","","4","P n a 21","P 2c -2n","33","","(2S)-1-(4-fluorophenyl)-2-hydroxy-2-[(2S,5R)-5-(1-hydroxy-1-methylethyl)- tetrahydrofuran-2-yl]ethanone","","- C15 H19 F O4 -","- C15 H19 F O4 -","- C120 H152 F8 O32 -","8","2","NA6099","Light, Mark E.; Hursthouse, Michael B.","(2<i>S</i>)-1-(4-Fluorophenyl)-2-hydroxy-2-[(2<i>S</i>,5<i>R</i>)-5-(1-hydroxy-1-methylethyl)-tetrahydrofuran-2-yl]ethanone","Acta Crystallographica Section E","2001","57","12","o1196","o1197","10.1107/S1600536801017019","","","0.71073","MoKα","","0.1187","0.0487","","","","0.1128","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200694","7.59","0.0006","9.6858","0.0008","10.404","0.0009","74.141","0.002","83.65","0.002","78.772","0.002","720.32","0.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-Acetyl-1,2-dihydro-3-hydroxy-3-(benzofuran-3-yl)-2-oxo-(3H)indole","","- C18 H13 N O4 -","- C18 H13 N O4 -","- C36 H26 N2 O8 -","2","1","NA6100","Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Yan Zhang; Jian-Hua Xu","1-Acetyl-3-(benzofuran-3-yl)-1,2-dihydro-3-hydroxy-2-oxo-3<i>H</i>-indole","Acta Crystallographica Section E","2001","57","11","o1070","o1072","10.1107/S1600536801016324","","","0.71073","MoKα","","0.1221","0.0724","","","","0.174","","","","","","0.857","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200695","12.3394","0.0001","9.1468","0.0001","15.9725","0.0001","90","","110.335","0.001","90","","1690.4","0.03","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[methyl-N^β^-(dipropylaminophenyl-methylene)-dithiocarbazato]nickel(II)","","- C30 H44 N6 Ni S4 -","- C30 H44 N6 Ni S4 -","- C60 H88 N12 Ni2 S8 -","2","0.5","NA6101","Hoong-Kun Fun; Suchada Chantrapromma; Ibrahim Abdul Razak; Anwar Usman; Yin Wen Tang; Wen Ma; Jie Ying Wu; Yu Peng Tian","Bis{methyl <i>N</i>^{β^}-[4-(dipropylamino)benzylidene]dithiocarbazato}nickel(II)","Acta Crystallographica Section E","2001","57","11","m519","m521","10.1107/S1600536801016397","","","0.71073","MoKα","","0.0751","0.0595","","","","0.1437","","","","","","0.952","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200696","8.3806","0.0002","9.5768","0.0003","9.1466","0.0003","90","","99.479","0.0013","90","","724.08","0.04","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-Ethyl-2-(hydroxymethyl)-1,3-propanediol","","- C6 H14 O3 -","- C6 H14 O3 -","- C24 H56 O12 -","4","1","NA6102","Zakaria, Choudhury M.; Low, John N.; Glidewell, Christopher","2-Ethyl-2-(hydroxymethyl)-1,3-propanediol at 120K: three hydrogen bonds generate a three-dimensional structure","Acta Crystallographica Section E","2001","57","11","o1081","o1083","10.1107/S1600536801017044","","","0.71073","MoKα","","0.0471","0.0355","","","","0.1003","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200697","8.8878","0.0003","10.6008","0.0002","11.2792","0.0003","62.253","0.001","87.872","0.001","82.953","0.001","933.16","0.04","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Methyl 4-(3,5-dimethoxy-2-methylphenoxy)-2,6-dihydroxy-3-iodo-5-methylbenzoate","","- C18 H19 I O7 -","- C17.999 H19 I0.999 O7 -","- C35.998 H38 I1.998 O14 -","2","1","NA6103","Suchada Chantrapromma; Hoong-Kun Fun; Ibrahim Abdul Razak; Nisakorn Saewon; Chatchanok Karalai; Chanita Ponglimanont; Kan Chantrapromma","Disorder in methyl 4-(3,5-dimethoxy-2-methylphenoxy)-2,6-dihydroxy-3-iodo-5-methylbenzoate","Acta Crystallographica Section E","2001","57","11","o1047","o1049","10.1107/S1600536801016774","","","0.71073","MoKα","","0.1138","0.0881","","","","0.2257","","","","","","0.98","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200698","8.277","0.002","9.723","0.002","16.5","0.002","90","","90","","90","","1327.9","0.5","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H15 N O3 S2 -","- C12 H15 N O3 S2 -","- C48 H60 N4 O12 S8 -","4","1","NA6104","Hansen, Lars Kr.; Bayer, Annette; Gautun, Odd R.","<i>exo</i>-3,6-Dihydro-3-methyl-2-(toluene-4-sulfonyl)-1λ^4^,2-thiazine 1-oxide","Acta Crystallographica Section E","2001","57","11","o1109","o1110","10.1107/S1600536801017901","","","0.71069","MoKα","","0.0664","0.0568","","","","0.1621","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200699","13.5783","0.0003","15.2608","0.0003","17.5449","0.0004","90","","90","","90","","3635.58","0.14","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C15 H18 N10 Ni O -","- C15 H18 N10 Ni O -","- C120 H144 N80 Ni8 O8 -","8","1","NA6105","De-Zhong Niu; Bai-Wang Sun; Zai-Sheng Lu; Zhe-Ming Wang; Chun-Hua Yan","Diazido{<i>N,N</i>'-bis[2-(2-pyridyl)ethylene]-1,3-diaminopropane}nickel(II) monohydrate","Acta Crystallographica Section E","2001","57","12","m589","m590","10.1107/S1600536801019663","","","0.71073","MoKα","","0.0719","0.0376","","","","0.1003","","","","","","1.015","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200700","12.513","0.004","4.977","0.003","16.388","0.009","90","","103.38","0.06","90","","992.9","0.9","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","1H-Benzimidazole-2-methanediol monohydrochloride monohydrate","1H-Benzimidazole-2-methanediol monohydrochloride monohydrate","","- C8 H11 Cl N2 O3 -","- C8 H11 Cl N2 O3 -","- C32 H44 Cl4 N8 O12 -","4","1","NA6106","Blake, Alexander J.; Hill, Stuart J.; Hubberstey, Peter","2-Dihydroxymethyl-3<i>H</i>-benzoimidazol-1-ium chloride monohydrate","Acta Crystallographica Section E","2001","57","12","o1258","o1260","10.1107/S1600536801020074","","","0.71073","MoKα","","0.049","0.037","","","","0.1","","","","","","1.21","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200701","7.9428","0.0012","8.6647","0.0014","12.1383","0.0018","75.19","0.006","87.432","0.006","65.639","0.006","734","0.2","133","2","133","2","","","","","","","","6","P -1","-P 1","2","","Bis(triethanolamine-N,O,O')zinc(II) saccharinate","","- C26 H38 N4 O12 S2 Zn -","- C26 H38 N4 O12 S2 Zn -","- C26 H38 N4 O12 S2 Zn -","1","0.5","NA6107","Topcu, Yildiray; Yilmaz, Veysel T.; Thöne, Carsten","Bis(triethanolamine-<i>N</i>,<i>O</i>,<i>O</i>')zinc(II) disaccharinate","Acta Crystallographica Section E","2001","57","12","m600","m602","10.1107/S1600536801019857","","","0.71073","MoKα","","0.0458","0.0402","","","","0.1128","","","","","","1.064","","","","has coordinates","198632","2020-10-21","18:00:00",""
"2200702","13.782","0.003","14.805","0.003","6.317","0.001","90","","90","","90","","1288.9","0.4","120","2","120","2","","","","","","","","3","F d d 2","F 2 -2d","43","2,6-Lutidine","2,6-Dimethylpyridine","","- C7 H9 N -","- C7 H9 N -","- C56 H72 N8 -","8","0.5","NA6108","Bond, Andrew D.; Davies, John E.; Kirby, Anthony J.","2,6-Lutidine","Acta Crystallographica Section E","2001","57","12","o1242","o1244","10.1107/S1600536801019869","","","0.71073","MoKα","","0.0618","0.0567","","","","0.1397","","","","","","1.105","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200703","6.871","0.0006","8.835","0.001","19.042","0.002","90","","90","","90","","1156","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-acetyl-7-methylbenzo[e]indol","","- C15 H13 N O -","- C15 H13 N O -","- C60 H52 N4 O4 -","4","1","NA6110","Višnjevac, Aleksandar; Basarić, Nikola; Kojić-Prodić, Biserka; Šindler-Kulyk, Marija","Photochemical formation of 2-acetyl-7-methylbenz[<i>e</i>]indole","Acta Crystallographica Section E","2001","57","12","o1252","o1254","10.1107/S1600536801020153","","","1.5418","CuKα","","0.0856","0.0561","","","","0.1678","","","","","","1.084","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200704","11.094","0.001","11.943","0.001","9.3399","0.0009","110.864","0.005","113.51","0.005","68.358","0.004","1022.57","0.17","193.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C22 H30 O4 -","- C22 H30 O4 -","- C44 H60 O8 -","2","1","OB6063","Miyake, Yasuhito; Hosoda, Asao; Nomura, Eisaku; Taniguchi, Hisaji","Ethyl 3-(4-geranyloxy-3-methoxyphenyl)-2-propenoate","Acta Crystallographica Section E","2001","57","11","o1096","o1097","10.1107/S1600536801017184","","","1.5418","CuKα","","","0.0591","","","","0.1205","","","","","","1.645","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200705","10.8346","0.0006","6.7519","0.0003","24.363","0.001","90","","101.781","0.002","90","","1744.71","0.14","143.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H19 Ca N O6 -","- C17 H19 Ca N O6 -","- C68 H76 Ca4 N4 O24 -","4","1","OB6064","Yano, Shigenobu; Numata, Momoko; Kato, Masako; Motoo, Shiro; Nishimura, Toshio","<i>catena</i>-Poly[[aqua(benzoato)(<i>N</i>,<i>N</i>'-dimethylformamide)calcium(II)]-μ-benzoato]","Acta Crystallographica Section E","2001","57","10","m488","m490","10.1107/S1600536801014660","","","0.7107","MoKα","","","0.0445","","","","0.0487","","","","","","0.944","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200706","10.156","0.002","19.733","0.001","9.486","0.001","90","","90","","90","","1901.1","0.4","294.2","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H23 N2 O5 P -","- C19 H23 N2 O5 P -","- C76 H92 N8 O20 P4 -","4","1","OB6066","Kiriko Kurokawa; Nobuko Kanehisa; Masaaki Sawa; Hirosato Kondo; Yasushi Kai","(+)-(3<i>R</i>)-<i>N</i>-Hydroxy-2-[(<i>S</i>)-ethoxy(4-methoxyphenyl)phosphoryl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide","Acta Crystallographica Section E","2001","57","10","o906","o908","10.1107/S1600536801014222","","","1.5418","CuKα","","","0.0406","","","","0.1017","","","","","","1.647","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200707","15.222","0.002","16.848","0.002","15.93","0.002","90","","114.27","0.01","90","","3724.3","0.9","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20.25 H22 N3 O3.25 -","- C20.25 H22 N3 O3.25 -","- C162 H176 N24 O26 -","8","4","OB6067","Hansen, Lars Kr.; Størmer, Fredrik C.; Petersen, Dirk; Aasen, Arne J.","Cycloechinulin, a Trp-Ala-derived alkaloid from the fungus <i>Aspergillus ochraceus</i>","Acta Crystallographica Section E","2001","57","10","o909","o912","10.1107/S1600536801014234","","","0.71069","MoKα","","0.1767","0.0636","","","","0.2089","","","","","","0.826","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200708","7.949","0.005","11.067","0.005","14.116","0.005","74.22","0.05","86.26","0.05","84.67","0.05","1188.8","1.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","trans-Dichloro(meso-2,3,7,11,12-pentamethyl-3,7,11,17-tetra- azabicyclo[11.3.1]heptadeca-1(17),13,15-triene-κ^4^N^3,7,11,17^)rhodium(III) hexafluorphosphate","","- C18 H32 Cl2 F6 N4 P Rh -","- C18 H32 Cl2 F6 N4 P Rh -","- C36 H64 Cl4 F12 N8 P2 Rh2 -","2","1","OB6068","Blake, Alexander J.; Hyde, Timothy I.; Schröder, Martin","<i>trans</i>-Dichloro(<i>meso</i>-2,3,7,11,12-pentamethyl-3,7,11,17-tetraazabicyclo[11.3.1]heptadeca-1(17),13,15-triene-κ^4^<i>N</i>^3,7,11,17^)rhodium(III) hexafluorophosphate","Acta Crystallographica Section E","2001","57","10","m459","m461","10.1107/S1600536801014568","","","0.71073","MoKα","","0.0934","0.0649","","","","0.182","","","","","","0.996","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200709","13.509","0.005","10.519","0.003","8.099","0.002","90","","101.54","0.015","90","","1127.6","0.6","293","","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","5-fluorocytosinium salicylate","","","- C11 H10 F N3 O4 -","- C11 H10 F N3 O4 -","- C44 H40 F4 N12 O16 -","4","1","OB6069","Prabakaran, P.; Murugesan, S.; Muthiah, P. Thomas; Bocelli, G.; Righi, L.","Intermolecular N‒H···O hydrogen-bonding interactions in 5-fluorocytosinium salicylate","Acta Crystallographica Section E","2001","57","10","o933","o936","10.1107/S1600536801014465","","","1.54178","CuKα","","0.0465","0.0342","","","","0.1026","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200710","8.4086","0.0004","11.2321","0.0006","18.7217","0.0007","90","","90","","90","","1768.19","0.14","123.2","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C6 H26 Co I3 N6 O -","- C6 H26 Co I3 N6 O -","- C24 H104 Co4 I12 N24 O4 -","4","1","OB6070","Ryo Matsuki; Shiro, Motoo; Asahi, Toru; Asai, Hiroshi","Absolute configuration of Λ-(+)~589~-tris(ethylenediamine)cobalt(III) triiodide monohydrate","Acta Crystallographica Section E","2001","57","10","m448","m450","10.1107/S1600536801015008","","","0.7107","MoKα","","","0.0229","","","","0.0662","","","","","","1.039","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2200711","7.9772","0.0002","13.5738","0.0002","8.2288","0.0002","90","","91.583","0.002","90","","890.68","0.03","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dinitratodioxobis(4-picoline N-oxide)uranium(VI)","","- C12 H14 N4 O10 U -","- C12 H14 N4 O10 U -","- C24 H28 N8 O20 U2 -","2","0.5","OB6071","Rickard, Clifton E. F.","Dinitratodioxobis(4-picoline <i>N</i>-oxide)uranium(VI)","Acta Crystallographica Section E","2001","57","10","m446","m447","10.1107/S1600536801014805","","","0.71073","MoKα","","0.0267","0.0224","","","","0.0524","","","","","","1.236","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200712","14.914","0.005","13.56","0.006","8.994","0.004","90","","122.75","0.02","90","","1529.8","1.1","296","2","296","2","","","","","","","","6","C 1 c 1","C -2yc","9","","trans-dichlorobis(1,4-butanediamine)cobalt(III) chloride monohydrate","","- C8 H26 Cl3 Co N4 O -","- C8 H26 Cl3 Co N4 O -","- C32 H104 Cl12 Co4 N16 O4 -","4","1","OB6072","Fujimoto, Kazuya; Nagata, Kiyonori; Suzuki, Honoh; Kanamori, Kan","<i>trans</i>-Bis(1,4-butanediamine)dichlorocobalt(III) chloride monohydrate","Acta Crystallographica Section E","2001","57","10","m467","m469","10.1107/S1600536801015227","","","0.71073","MoKα","","0.0372","0.0331","","","","0.0824","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200713","9.739","0.002","13.647","0.004","14.5479","0.0019","90","","107.79","0.013","90","","1841.1","0.7","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","trans-bis(isothiocyanato)bis(1,4-butanediamine)cobalt(III) thiocyanate","","- C11 H24 Co N7 S3 -","- C11 H24 Co N7 S3 -","- C44 H96 Co4 N28 S12 -","4","1","OB6073","Fujimoto, Kazuya; Nagata, Kiyonori; Suzuki, Honoh; Kanamori, Kan","<i>trans</i>-Bis(1,4-butanediamine)bis(isothiocyanato)cobalt(III) thiocyanate","Acta Crystallographica Section E","2001","57","10","m470","m471","10.1107/S1600536801015239","","","0.71073","MoKα","","0.0587","0.0333","","","","0.0939","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200714","7.065","0.001","15.148","0.003","11.113","0.002","90","","98.09","0.01","90","","1177.5","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H26 N2 Ni O12 -","- C20 H26 N2 Ni O12 -","- C40 H52 N4 Ni2 O24 -","2","0.5","OB6074","Liao, Ju-Hsiou; Su, Ching-Ting; Hsu, Che-Chih","<i>catena</i>-Poly[[[diaquabis[<i>cis</i>-2-methyl-but-2-enedioate(1‒)-<i>O</i>]nickel(II)]-μ-4,4'-bipyridine-<i>N</i>:<i>N</i>'] dihydrate]","Acta Crystallographica Section E","2001","57","11","m501","m503","10.1107/S1600536801015835","","","0.71073","MoKα","","0.0461","0.0292","","0.0637","","0.0583","","","","","","1.042","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200715","8.411","0.002","8.819","0.002","14.886","0.004","84.684","0.006","82.425","0.006","68.439","0.006","1016.8","0.4","91","2","91","2","","","","","","","","4","P -1","-P 1","2","Nitrilotrisacetanilide","Nitrilotriacetanilide","","- C24 H24 N4 O3 -","- C24 H24 N4 O3 -","- C48 H48 N8 O6 -","2","1","OB6075","John M. Rowland; Gerardo J. Ibanez; Marilyn M. Olmstead; Michael Ruf; Pradip K. Mascharak","Nitrilotriacetanilide","Acta Crystallographica Section E","2001","57","11","o1001","o1003","10.1107/S1600536801015781","","","0.71073","MoKα","","0.087","0.067","","","","0.239","","","","","","1.234","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200716","19.791","0.001","5.322","0.0003","10.974","0.001","90","","113.923","0.006","90","","1056.57","0.13","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","bis(β-Alanine) H+ nitrate","β-Alanine β-alaninium nitrate","","- C6 H15 N3 O7 -","- C6 H15 N3 O7 -","- C24 H60 N12 O28 -","4","0.5","OB6076","B. Sridhar; N. Srinivasan; R. K. Rajaram","Bis(β-alanine) hydrogen nitrate","Acta Crystallographica Section E","2001","57","11","o1004","o1006","10.1107/S1600536801015793","","","0.71073","MoKα","","0.04","0.0334","","","","0.0916","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200717","7.569","0.002","9.397","0.002","12.31","0.003","90","","92.62","0.02","90","","874.6","0.4","295","2","295","2","","","","","","","","3","P 1 21 1","P 2yb","4","ludongnin B","spiro[isobenzofuran-4 (1H),4'(3'H)-[1H-7,9a] methanocyclohepta[c]pyran]-1',3,9'(3aH,4'aH)-trione, octahydro-7a,8'-dimethyl","","- C20 H26 O5 -","- C20 H26 O5 -","- C40 H52 O10 -","2","1","OB6077","Shi, Hao; Pan, Yuan Jiang; Zhang, Xue Qin; Yu, Kai Bei","Octahydro-7a,8'-dimethylspiro[isobenzofuran-4(1<i>H</i>),4'(3'<i>H</i>)-[1<i>H</i>-7,9a]methanocyclohepta[<i>c</i>]pyran]-1',3,9'(3a<i>H</i>,4'a<i>H</i>)-trione","Acta Crystallographica Section E","2001","57","11","o1007","o1009","10.1107/S1600536801015847","","","0.71073","MoKα","","0.1146","0.0529","","","","0.1283","","","","","","0.872","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200718","26.198","0.005","26.198","0.005","11.024","0.007","90","","90","","120","","6552","5","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","(R/S)-3-(3-Methyl-2-butylamino)-4H-pyrido[4,3-e]-1,2,4-thiadiazine 1,1-dioxide hydrate","","- C11 H18 N4 O3 S -","- C11 H18 N4 O3 S -","- C198 H324 N72 O54 S18 -","18","1","OB6078","Dupont, Léon; De Tullio, Pascal; Tinant, Bernard; Pirotte, Bernard","(<i>R</i>/<i>S</i>)-3-(3-Methyl-2-butylamino)-4<i>H</i>-pyrido[4,3-<i>e</i>]-1,2,4-thiadiazine 1,1-dioxide monohydrate","Acta Crystallographica Section E","2001","57","11","o1050","o1051","10.1107/S1600536801016622","","","1.5418","CuKα","","0.1055","0.0774","","","","0.2508","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200719","10.063","0.002","19.007","0.004","20.344","0.004","71.469","0.014","83.522","0.016","84.235","0.016","3657.2","1.3","160","2","160","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H40 B9 P -","- C40 H39 B9 P -","- C160 H156 B36 P4 -","4","2","OB6079","Rosair, Georgina M.; Schmidt, Falk H.; Welch, Alan J.","Tetraphenylphosphonium 7-phenylethynyl-8-phenyl-7,8-<i>nido</i>-dicarbadecahydroundecaborate(1‒)","Acta Crystallographica Section E","2001","57","12","o1168","o1170","10.1107/S160053680101902X","","","0.71073","MoKα","","0.2342","0.0867","","","","0.1809","","","","","","0.972","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200720","7.366","0.002","9","0.002","21.456","0.002","90","","93.73","0.02","90","","1419.4","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","8-Hydroxyquinoline-5-sulfonic acid nickel(II)","[Tetraaqua(quinolinolato-N,O]-5-sulfonic nickel(II)]monohydrate","","- C9 H15 N Ni O9 S -","- C9 H15 N Ni O9 S -","- C36 H60 N4 Ni4 O36 S4 -","4","1","OB6080","Baskar Raj, Savarimuthu; Thomas Muthiah, Packianathan; Bocelli, Gabriele; Righi, Lara","Tetraaqua(8-hydroxyquinoline-5-sulfonato-<i>N,O</i>)nickel(II) monohydrate","Acta Crystallographica Section E","2001","57","12","m591","m594","10.1107/S1600536801017792","","","0.71069","MoKa","","0.0267","0.0228","","","","0.0624","","","","","","1.024","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200721","7.23","0.006","63.045","0.005","5.041","0.004","90","","90","","90","","2298","3","296.2","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C23 H48 O2 -","- C23 H48 O2 -","- C92 H192 O8 -","4","1","OB6081","Nakamura, Naotake; Uno, Kenjiro; Ogawa, Yoshihiro","Tricosane-1,23-diol","Acta Crystallographica Section E","2001","57","11","o1091","o1093","10.1107/S1600536801017457","","","1.5418","CuKα","","","0.044","","","","0.192","","","","","","1.413","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200722","7.521","0.0006","7.521","0.0006","25.2821","0.0013","90","","90","","120","","1238.5","0.15","297","","297","","","","","","","","","3","P 31","P 31","144","futoenone","(2R,4R,5S,5aR)-rel-(-)-4-(1,3-benzodioxol-5-yl)-2,3,4,5- tetrahydro-7-methoxy-5-methyl-8H-2,5a-methano-benzoepin-8-one","","- C20 H20 O5 -","- C20 H20 O5 -","- C60 H60 O15 -","3","1","OB6082","Song, Qi; Billodeaux, Damon R.; Fronczek, Frank R.; Fischer, Nikolaus H.","Futoenone, a neolignan from <i>Magnolia soulangiana</i>","Acta Crystallographica Section E","2001","57","11","o1094","o1095","10.1107/S1600536801017482","","","1.5418","CuKα","","0.033","0.033","","","","0.085","","","","","","1.102","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200723","11.7436","0.0017","11.7436","0.0017","30.932","0.008","90","","90","","120","","3694.4","1.2","293","2","293","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C12 H23.1 Cl4 N6 O2.55 Ru Zn -","- C12 H23.1 Cl4 N6 O2.55 Ru Zn -","- C72 H138.6 Cl24 N36 O15.3 Ru6 Zn6 -","6","0.333333","OB6083","Anzellotti, Atilio; Briceño, Alexander","Hexakis(acetonitrile)ruthenium(II) tetrachlorozincate 2.55-hydrate","Acta Crystallographica Section E","2001","57","11","m538","m540","10.1107/S1600536801017469","","","0.71069","MoKα","","0.0893","0.0583","","","","0.1567","","","","","","1.021","","","","has coordinates","194389","2020-10-21","18:00:00",""
"2200724","9.3436","0.0008","13.4554","0.0012","14.2888","0.0012","90","","94.748","0.002","90","","1790.3","0.3","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,5,8,19-Tetraaza-2,9,18-trione-[5^5,13^][11]metacyclophane monohydrate","","- C18 H26 N4 O4 -","- C18 H26 N4 O4 -","- C72 H104 N16 O16 -","4","1","OB6084","Kim, Tae Ho; Yang, Sun Young; Lee, Shim Sung; Kim, Jae Sang; Kim, Jineun","2,9,18-Trioxo-3,5,8,19-tetraaza-[5^5,13^][11]metaphane monohydrate","Acta Crystallographica Section E","2001","57","12","o1200","o1202","10.1107/S1600536801019183","","","0.71073","MoKα","","0.0786","0.0434","","","","0.1164","","","","","","1.012","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200725","8.236","0.0007","9.5392","0.0007","11.9512","0.001","98.499","0.001","94.67","0.001","106.104","0.001","884.76","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Quinolinium trichloroquinoline-zinc(II)","","- C18 H15 Cl3 N2 Zn -","- C18 H15 Cl3 N2 Zn -","- C36 H30 Cl6 N4 Zn2 -","2","1","OB6086","Wang, Wenguo; Zhang, Xiaofeng; Huang, Deguang; Zhu, Hongping; Chen, Changneng; Liu, Qiutian","Quinolinium trichloro(quinoline)zinc(II)","Acta Crystallographica Section E","2001","57","12","m561","m563","10.1107/S1600536801018414","","","0.71073","MoKα","","0.0708","0.0453","","","","0.1467","","","","","","0.913","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2200726","7.874","0.002","12.624","0.003","7.117","0.003","105.87","0.04","92.67","0.03","87.93","0.03","679.5","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Cytosine Cadmium Dibromide","Bis-(4-amino-2(1H)-pyridinone)dibromocadmium(II)","","- C8 H10 Br2 Cd N6 O2 -","- C8 H10 Br2 Cd N6 O2 -","- C16 H20 Br4 Cd2 N12 O4 -","2","1","OB6087","Thomas Muthiah, Packianathan; Justin Robert, Jebamony; Baskar Raj, Savarimuthu; Bocelli, Gabriele; Rita Ollá","Metal‒nucleobase interaction: dibromobis(cytosine)cadmium(II)","Acta Crystallographica Section E","2001","57","12","m558","m560","10.1107/S1600536801018360","","","0.71075","MoKα","","0.061","0.061","","0.158","","0.158","","","","","","0.958","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200727","15.6757","0.0012","10.4805","0.0008","7.5277","0.0006","90","","90","","90","","1236.72","0.17","83","2","83","2","","","","","","","","2","P b c n","-P 2n 2ab","60","styrene","styrene","","- C8 H8 -","- C8 H8 -","- C64 H64 -","8","1","OB6089","Nobuhiro Yasuda; Hidehiro Uekusa; Yuji Ohashi","Styrene at 83K","Acta Crystallographica Section E","2001","57","12","o1189","o1190","10.1107/S1600536801019237","","","0.71069","MoKα","","0.0433","0.0388","","","","0.0986","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200728","11.7627","0.0002","9.622","0.0002","18.7387","0.0003","90","","103.034","0.001","90","","2066.22","0.07","183","2","183","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Erythro-2-(2,6-Dimethoxyphenoxy)-1-(3,4,5-trimethoxyphenyl)-1,3-propandiol","","","- C20 H26 O8 -","- C20 H26 O8 -","- C80 H104 O32 -","4","1","OB6090","Langer, Vratislav; Lundquist, Knut","<i>erythro</i>-2-(2,6-Dimethoxyphenoxy)-1-(3,4,5-trimethoxyphenyl)-1,3-propanediol","Acta Crystallographica Section E","2001","57","12","o1219","o1221","10.1107/S1600536801019390","","","0.71073","MoKα","","0.0617","0.0443","","","","0.1245","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200729","10.509","0.006","10.763","0.005","13.146","0.007","90","","107.26","0.04","90","","1420","1.3","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N-dimethyl-N-{4-[(E)-(4-methyl-3-nitrophenyl)diazenyl]phenyl}amine","","- C15 H16 N4 O2 -","- C15 H16 N4 O2 -","- C60 H64 N16 O8 -","4","1","OB6093","Oleg Ya. Borbulevych; Mikhail Yu. Antipin","Redetermination of <i>N,N</i>-dimethyl-<i>N</i>-{4-[(<i>E</i>)-(4-methyl-3-nitrophenyl)diazenyl]phenyl}amine at 193 K: another example of dynamic disorder of substituted azobenzene compounds","Acta Crystallographica Section E","2001","57","12","o1250","o1251","10.1107/S1600536801020128","","","0.71073","MoKα","","0.1329","0.055","","","","0.1544","","","","","","0.867","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200730","15.284","0.0004","13.9364","0.0004","6.0585","0.0002","90","","90","","90","","1290.48","0.07","223","2","223","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C12 H9 As O S3 -","- C12 H9 As O S3 -","- C48 H36 As4 O4 S12 -","4","0.5","OB6094","Mahalakshmi, H.; Jain, Vimal K.; Tiekink, Edward R. T.","Tri(2-thienyl)arsine oxide","Acta Crystallographica Section E","2001","57","12","o1222","o1223","10.1107/S160053680101978X","","","0.71069","MoKα","","0.036","0.035","","","","0.089","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200731","10.1697","0.0005","11.7231","0.0006","12.3281","0.0006","71.71","0.001","77.917","0.001","65.803","0.001","1267.36","0.11","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H43 Au N P S2 -","- C23 H43 Au N P S2 -","- C46 H86 Au2 N2 P2 S4 -","2","1","OB6095","Ho, Soo Yei; Tiekink, Edward R. T.","(<i>N,N</i>-Diethyldithiocarbamato)(tricyclohexylphosphine)gold(I)","Acta Crystallographica Section E","2001","57","12","m603","m604","10.1107/S1600536801019833","","","0.71069","MoKα","","0.044","0.042","","","","0.115","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200732","8.404","0.002","7.672","0.002","17.592","0.003","90","","102.62","0.019","90","","1106.8","0.4","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H15 N3 O2 -","- C11 H15 N3 O2 -","- C44 H60 N12 O8 -","4","1","OB6096","Hökelek, Tuncer; Zülfikaroğlu, Ayşin; Batı, Hümeyra","1-(2,6-Dimethylphenylamino)propane-1,2-dione dioxime","Acta Crystallographica Section E","2001","57","12","o1247","o1249","10.1107/S1600536801020104","","","0.71073","MoKα","","0.0734","0.056","","","","0.1891","","","","","","1.133","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200733","14.609","0.002","8.4266","0.0012","6.9097","0.0008","90","","90","","90","","850.61","0.19","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C5 H6 N4 O7 -","- C5 H6 N4 O7 -","- C20 H24 N16 O28 -","4","1","OM6044","Gilardi, Richard D.; Butcher, Ray J.","2,5-Dinitro-7,9-dioxa-2,5-diazabicyclo[4.3.0]nonan-8-one","Acta Crystallographica Section E","2001","57","10","o913","o915","10.1107/S1600536801014131","","","0.71073","MoKα","","0.0672","0.0455","","","","0.1111","","","","","","1.037","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200734","5.5459","0.0002","10.3058","0.0003","6.8702","0.0003","90","","100.131","0.002","90","","386.54","0.02","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(Z)-2-nitroethenamine","(Z)-2-nitroethenamine","","- C2 H4 N2 O2 -","- C2 H4 N2 O2 -","- C8 H16 N8 O8 -","4","1","OM6046","Evans, Robin N.; Gilardi, Richard","(<i>Z</i>)-2-Nitroethenamine","Acta Crystallographica Section E","2001","57","10","o956","o958","10.1107/S1600536801015124","","","1.54178","CuKα","","0.0457","0.0441","","","","0.1192","","","","","","1.088","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200735","3.982","0.002","3.982","0.002","6.445","0.003","90","","90","","120","","88.49","0.08","293","2","293","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Fe0.05 Mn0.95 S -","- Fe0.05 Mn0.95 S -","- Fe0.1 Mn1.9 S2 -","2","0.166667","","Eriksson, Lars; Kalinowski, Mariusz P.","Mn~1-x~ Fe~x~ S, x ≃0.05, an example of the anti-wurtzite structure","Acta Crystallographica, Section E","2001","57","","i92","i93","10.1107/S1600536801016051","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2200736","16.1497","0.0014","8.6805","0.0007","35.047","0.003","90","","90","","90","","4913.2","0.7","203","2","203","2","","","","","","","","4","P c a 21","P 2c -2ac","29","(acenaphtylenide)2Ca.2THF","rac-[bis(3,3'-biacenaphthylenido)]bis(tetrahydrofuran-O)calcium","","- C32 H32 Ca O2 -","- C32 H32 Ca O2 -","- C256 H256 Ca8 O16 -","8","2","OM6048","Sinnema, Piet-Jan; Twamley, Brendan; Shapiro, Pamela J.","ansa-Calcocenes: <i>rac</i>-[bis(3,3'-biacenaphthylenido)]bis(tetrahydrofuran)calcium","Acta Crystallographica Section E","2001","57","10","m438","m440","10.1107/S1600536801014751","","","0.71073","MoKα","","0.091","0.054","","","","0.128","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200737","16.903","0.003","10.182","0.002","17.971","0.003","90","","104.9","0.01","90","","2988.9","0.9","293","2","20","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1,1,1,3,3,3-Hexafluoro-2-(4-nitrophenyl)-N-phenylisopropylamine","","- C15 H10 F6 N2 O2 -","- C15 H10 F6 N2 O2 -","- C120 H80 F48 N16 O16 -","8","1","OM6049","Pavkovic, Stephen F.; Nelson, Derek W.; Owens, James R.","1,1,1,3,3,3-Hexafluoro-2-(4-nitrophenyl)-<i>N</i>-phenylisopropylamine","Acta Crystallographica Section E","2001","57","10","o941","o942","10.1107/S1600536801014763","","","0.7107","MoKα","","0.1632","0.0586","","","","0.1734","","","","","","0.983","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200738","6.9184","0.0003","8.8703","0.0003","18.7337","0.0009","90","","95.444","0.003","90","","1144.47","0.08","173","","173","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H28 B2 N2 O2 -","- C26 H28 B2 N2 O2 -","- C52 H56 B4 N4 O4 -","2","0.5","OM6050","Wolfgang Kliegel; Lutz Preu; Ulf Riebe; Brian O. Patrick; Steven J. Rettig; James Trotter","A BONBON 6-membered ring heterocycle","Acta Crystallographica Section E","2001","57","10","o943","o944","10.1107/S1600536801014866","","","0.7107","MoKα","","0.059","0.037","","0.118","","0.058","","","1.91","","","1.91","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200739","6.914","0.001","6.299","0.001","24.933","0.004","90","","90.719","0.015","90","","1085.8","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Hexaaquanickel(II) bis(p-tolylsulfonate)","","- C14 H26 Ni O12 S2 -","- C14 H26 Ni O12 S2 -","- C28 H52 Ni2 O24 S4 -","2","0.5","OM6052","Batsanov, Andrei S.; Howard, Judith A. K.; Moore, Nichola S.; Kilner, Melvyn","Hexaaquanickel(II) bis(<i>p</i>-tolylsulfonate)","Acta Crystallographica Section E","2001","57","10","m485","m487","10.1107/S160053680101529X","","","0.71073","MoKα","","0.0761","0.0501","","","","0.1005","","","","","","1.191","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200740","7.7561","0.0001","10.8931","0.0002","34.012","0.0006","90","","90","","90","","2873.6","0.08","120","","120","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-Propenyl 4-ferrocenyl-4-oxobutanoate","","- C17 H18 Fe O3 -","- C17 H18 Fe O3 -","- C136 H144 Fe8 O24 -","8","1","OM6053","Giraldés, José; McLaughlin, Mark L.; Fronczek, Frank R.","2-Propenyl 4-ferrocenyl-4-oxobutanoate","Acta Crystallographica Section E","2001","57","10","m426","m427","10.1107/S1600536801014659","","","0.71073","MoKα","","0.073","0.039","","","","0.091","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200741","11.6372","0.0003","10.4879","0.0005","9.9749","0.0004","90","","100.657","0.003","90","","1196.44","0.08","100","1","100","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(2-Cyclohex-1-enylvinyl)-[1,3,6,2]dioxazaborocane","","- C12 H20 B N O2 -","- C12 H20 B N O2 -","- C48 H80 B4 N4 O8 -","4","1","OM6054","Thadani, Avinash N.; Batey, Robert A.; Lough, Alan J.","2-(2-Cyclohex-1-enylvinyl)[1,3,6,2]dioxazaborocane","Acta Crystallographica Section E","2001","57","11","o1010","o1011","10.1107/S1600536801015136","","","0.71073","MoKα","","0.0566","0.04","","","","0.1022","","","","","","1.052","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200742","11.756","0.0018","12.772","0.002","12.8527","0.0018","90","","91.82","0.012","90","","1928.8","0.5","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","3-(2'-Bromophenyl)-4-(tri-iso-propylsilyl)-sydnone","3-(2-Bromophenyl)-4-(triisopropylsilyl)sydnone","","- C17 H25 Br N2 O2 Si -","- C17 H25 Br N2 O2 Si -","- C68 H100 Br4 N8 O8 Si4 -","4","1","OM6056","Grossie, David A.; Turnbull, Kenneth; Krein, Douglas M.","3-(2-Bromophenyl)-4-(triisopropylsilyl)sydnone","Acta Crystallographica Section E","2001","57","10","o985","o987","10.1107/S160053680101563X","","","0.71069","MoKα","","0.1481","0.0422","","","","0.12","","","","","","0.755","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200743","12.113","0.003","12.853","0.0016","13.0084","0.0014","85.113","0.011","69.29","0.012","66.945","0.013","1739.7","0.6","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","Tetrakis(triphenylphosphine)-bis(μ-tricyanomethanido)dicopper(I)","","- C80 H60 Cu2 N6 P4 -","- C80 H60 Cu2 N6 P4 -","- C80 H60 Cu2 N6 P4 -","1","0.5","OM6057","Karl E. Bessler; Leandro A. de P. Calzavara; Victor M. Deflon; Elke Niquet","Bis(μ-tricyanomethanido)tetrakis(triphenylphosphine)dicopper(I)","Acta Crystallographica Section E","2001","57","11","m522","m523","10.1107/S1600536801016373","","","1.54184","CuKα","","0.0531","0.0521","","","","0.1523","","","","","","1.096","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200744","9.1739","0.0003","22.1696","0.0007","9.4404","0.0003","90","","104.592","0.001","90","","1858.07","0.1","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Di-μ-chloro-bis{chloro[1,2-diphenyl-2-(phenylamino)ethanoximato]copper(II)}","","- C40 H36 Cl4 Cu2 N4 O2 -","- C40 H36 Cl4 Cu2 N4 O2 -","- C80 H72 Cl8 Cu4 N8 O4 -","2","0.5","OM6058","Puschmann, Horst; Batsanov, Andrei S.; Howard, Judith A.K.; Soto, Bernardino; Bonne, Raul; Au-Alvarez, Oscar","Di-μ-chloro-bis{chloro[1,2-diphenyl-2-(phenylamino)ethanoximato]copper(II)}","Acta Crystallographica Section E","2001","57","11","m524","m526","10.1107/S1600536801016890","","","0.71073","MoKα","","0.0318","0.0266","","","","0.0625","","","","","","1.069","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200745","7.0429","0.0005","7.0429","0.0005","10.0166","0.0007","90","","90","","120","","430.28","0.05","293","2","293","2","","","","","","","Synthetic","3","P 31 2 1","P 31 2""","152","Schuetteite","Trimercury(II) dioxide sulfate(VI)","Schuetteite","- Hg3 O6 S -","- Hg3 O6 S -","- Hg9 O18 S3 -","3","0.5","OM6059","Weil, Matthias","Schuetteite, Hg~3~(SO~4~)O~2~, a re-investigation","Acta Crystallographica Section E","2001","57","11","i98","i100","10.1107/S1600536801017561","","","0.71073","MoKα","","0.0237","0.0212","","","","0.0512","","","","","","1.039","","","","has coordinates,has Fobs","282068","2023-03-26","10:12:33",""
"2200746","13.575","0.0008","7.957","0.0004","11.0684","0.0006","90","","93.436","0.001","90","","1193.42","0.11","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H10 N6 O8 -","- C7 H10 N6 O8 -","- C28 H40 N24 O32 -","4","1","OM6062","Gilardi, Richard D.; Axenrod, Theodore; Sun, Jianguang; Flippen-Anderson, Judith L.","1,3,5,7-tetranitro-3,7-diazabicyclo[3.3.1]nonane","Acta Crystallographica Section E","2001","57","11","o1107","o1108","10.1107/S1600536801017780","","","0.71073","MoKα","","0.069","0.0563","","","","0.1472","","","","","","1.095","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200747","11.9782","0.0002","9.9382","0.0001","30.5174","0.0004","90","","100.812","0.001","90","","3568.35","0.08","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H28 N4 O4 -","- C15 H28 N4 O4 -","- C120 H224 N32 O32 -","8","2","OM6063","Flippen-Anderson, Judith L.; Axenrod, Theodore; Sun, Jianguang; Gilardi, Richard D.","3,7-Di-<i>tert</i>-butyl-1,5-dinitro-3,7-diazabicyclo[3.3.1]nonane","Acta Crystallographica Section E","2001","57","11","o1128","o1129","10.1107/S1600536801018153","","","1.54178","CuKα","","0.072","0.064","","","","0.195","","","","","","1.105","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200748","7.3586","0.0007","11.9176","0.0011","12.4369","0.0013","90","","90","","90","","1090.68","0.18","213","2","213","2","","","","","","","","5","C c c m","-C 2 2c","66","","cobaltocenium tetrafluoroborate","","- C10 H10 B Co F4 -","- C10 H10 B Co F4 -","- C40 H40 B4 Co4 F16 -","4","0.25","OM6064","Cotton, F. Albert; Daniels, Lee M.; Wilkinson, Chad C.","A highly disordered cobaltocenium salt","Acta Crystallographica Section E","2001","57","11","m529","m530","10.1107/S1600536801017172","","","0.71073","MoKα","","0.0395","0.0284","","","","0.084","","","","","","1.093","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200749","17.8678","0.0017","6.7905","0.0018","16.382","0.002","90","","120.114","0.01","90","","1719.4","0.6","100","","100","","","","","","","","","3","C 1 2 1","C 2y","5","Denudatin A","(2S,3R,3aR)-2-(1,3-benzodioxol-5-yl)-3,3a-dihydro-3a-methoxy-3- methyl-5-(2-propenyl)-6(2H)-benzofuranone","","- C20 H20 O5 -","- C20 H20 O5 -","- C80 H80 O20 -","4","1","OM6065","Song, Qi; Fronczek, Frank R.; Fischer, Nikolaus H.","Denudatin <i>A</i>, a neolignan from <i>Magnolia soulangiana</i>","Acta Crystallographica Section E","2001","57","11","o1105","o1106","10.1107/S1600536801017779","","","0.71073","MoKα","","0.108","0.061","","","","0.166","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200750","26.8737","0.001","14.6191","0.0006","10.1557","0.0004","90","","110.323","0.001","90","","3741.5","0.3","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15 H31 I N2 O -","- C15 H31 I N2 O -","- C120 H248 I8 N16 O8 -","8","1","OM6066","Flippen-Anderson, Judith L.; Axenrod, Theodore; Qi, Lida; Gilardi, Richard D.","1,5-Di-<i>tert</i>-butyl-3-hydroxy-7-methylene-1-azonia-5-azacyclooctane iodide","Acta Crystallographica Section E","2001","57","12","o1147","o1148","10.1107/S1600536801018190","","","0.71073","MoKα","","0.059","0.044","","","","0.117","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200751","24.2121","0.0016","5.3063","0.0004","19.7644","0.0012","90","","118.023","0.001","90","","2241.6","0.3","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C10 H18 N2 O4 -","- C10 H18 N2 O4 -","- C80 H144 N16 O32 -","8","1","OM6067","Gilardi, Richard D.; Axenrod, Theodore; Sun, Jianguang; Flippen-Anderson, Judith L.","5,5-Dihydroxy-1,3-dipropionyl-1,3-diazacyclohexane","Acta Crystallographica Section E","2001","57","12","o1183","o1184","10.1107/S1600536801019006","","","0.71073","MoKα","","0.0884","0.0656","","","","0.1346","","","","","","1.237","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200752","17.956","0.0002","9.7885","0.0001","18.2898","0.0001","90","","108.507","0.001","90","","3048.41","0.05","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H18 N4 O8 -","- C12 H18 N4 O8 -","- C96 H144 N32 O64 -","8","2","OM6068","Gilardi, Richard D.; Axenrod, Theodore; Guan, Xiao-Pei; Flippen-Anderson, Judith L.","1,5-Diacetyl-7,7-dinitro-1,5-diazacyclooctan-3-one ethylene acetal","Acta Crystallographica Section E","2001","57","12","o1185","o1186","10.1107/S1600536801019018","","","1.54178","CuKα","","0.0445","0.0404","","","","0.1134","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200753","20.642","0.0006","11.5573","0.0004","17.7307","0.0005","90","","104.666","0.001","90","","4092.1","0.2","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Di-μ-chloro-bis{chloro[1,2-diphenyl-2-(4-chlorophenylamino)ethanoximato]- copper(II)}","","- C40 H34 Cl6 Cu2 N4 O2 -","- C40 H34 Cl6 Cu2 N4 O2 -","- C160 H136 Cl24 Cu8 N16 O8 -","4","0.5","OM6069","Puschmann, Horst; Batsanov, Andrei S.; Howard, Judith A. K.; Soto, Bernardino; Bonne, Raul; Au-Alvarez, Oscar","Di-μ-chloro-bis{chloro[1,2-diphenyl-2-(4-chlorophenylamino)ethanoximato]copper(II)}","Acta Crystallographica Section E","2001","57","11","m551","m552","10.1107/S1600536801018050","","","0.71073","MoKα","","0.0254","0.023","","","","0.0634","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200754","14.8811","0.0005","12.9287","0.0004","21.7718","0.0006","90","","101.569","0.001","90","","4103.6","0.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H40 Cl4 Cu2 N4 O2 -","- C42 H40 Cl4 Cu2 N4 O2 -","- C168 H160 Cl16 Cu8 N16 O8 -","4","1","OM6070","Puschmann, Horst; Howard, Judith A. K.; Soto, Bernardino; Bonne, Raul; Au-Alvarez, Oscar","Di-μ-chloro-bis{chloro[2-(4-methylphenylamino)-1,2-diphenylethanoximato]copper(II)}","Acta Crystallographica Section E","2001","57","12","m581","m583","10.1107/S1600536801019092","","","0.71073","MoKα","","0.0854","0.0416","","","","0.0981","","","","","","1.015","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200755","14.2861","0.0004","11.8522","0.0004","17.2215","0.0006","90","","90","","90","","2915.97","0.16","173","2","173","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C26 H26 Mo2 N8 O7 -","- C26 H26 Mo2 N8 O7 -","- C104 H104 Mo8 N32 O28 -","4","0.5","TK6034","Guo, ShengLi; Wagner, Matthias; Bolte, Michael","Bis(μ-1-acetimido-4-phenylpyrazolone-<i>N</i>^2^:<i>O</i>)-μ-oxo-tetraoxodimolybdenum(VI) as its diacetonitrile adduct: a novel dinuclear molybdenum complex bridged by a 1-acetimido-4-phenylpyrazolone ligand","Acta Crystallographica Section E","2001","57","10","m428","m430","10.1107/S1600536801014428","","","0.71073","MoKα","","0.037","0.032","","","","0.088","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200756","9.431","0.002","10.307","0.002","8.291","0.001","110.29","0.01","113.75","0.01","67.1","0.02","662","0.2","296","","","","","","","","","","","3","P -1","-P 1","2","","","","- C7 H6 O4 -","- C7 H6 O4 -","- C28 H24 O16 -","4","2","TK6035","Okabe, Nobuo; Kyoyama, Hasuyo","2,3-Dihydroxybenzoic acid","Acta Crystallographica Section E","2001","57","12","o1224","o1226","10.1107/S1600536801018682","","","0.7107","MoKα","","","0.044","","","","0.175","","","","","","1.07","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200757","14.0385","0.0002","19.1269","0.0002","13.8322","0.0001","90","","90.728","0.001","90","","3713.83","0.07","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H35 Mo N O3 P2 -","- C44 H35 Mo N O3 P2 -","- C176 H140 Mo4 N4 O12 P8 -","4","1","TK6037","Evans, Cameron; Nicholson, Brian K.; Oliver, Allen G.","Bis(triphenylphosphine)iminium tricarbonylcyclopentadienylmolybdate","Acta Crystallographica Section E","2001","57","11","m504","m505","10.1107/S1600536801016178","","","0.71073","MoKα","","0.052","0.037","","","","0.09","","","","","","1.08","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200758","7.868","0.004","8.489","0.004","12.281","0.006","104.38","0.01","92.3","0.01","110.07","0.01","739.2","0.6","168","2","168","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 6-nitro-2-phenylaminoimidazo[1,2-a]pyridine-3-carboxylate","","- C16 H14 N4 O4 -","- C16 H14 N4 O4 -","- C32 H28 N8 O8 -","2","1","TK6038","David W Jeffery; Rolf H Prager; Max R Taylor","Ethyl 6-nitro-2-phenylaminoimidazo[1,2-<i>a</i>]pyridine-3-carboxylate","Acta Crystallographica Section E","2001","57","10","o980","o982","10.1107/S1600536801015574","","","0.71073","MoKα","","0.086","0.052","","0.095","","0.088","","","1.01","","","1.11","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200759","16.825","0.001","13.55","0.001","8.173","0.001","90","","95.02","0.01","90","","1856.1","0.3","123","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H25 N O4 -","- C21 H25 N O4 -","- C84 H100 N4 O16 -","4","1","TK6039","Fallon, Gary D.; Ventrice, Tina; Jackson, W. Roy; Campi, Eva M.; Patti, Antonio F.","12-Benzoyl-2,3,5,6,9,10,11,12-octahydro-8<i>H</i>-1,4,7,12-benzotrioxaazacyclotetradecine","Acta Crystallographica Section E","2001","57","10","o983","o984","10.1107/S1600536801015586","","","0.71073","MoKα","","","0.05","","","","0.114","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200760","14.461","0.003","15.863","0.003","19.166","0.003","90","","108.98","0.02","90","","4157.5","1.4","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Diphenic acid‒acridine(1/1)","Diphenic acid‒acridine (1/1)","","- C54 H38 N2 O8 -","- C54 H38 N2 O8 -","- C216 H152 N8 O32 -","4","1","TK6040","Shaameri, Zurina; Shan, Ning; Jones, William","Diphenic acid‒acridine (1/1)","Acta Crystallographica Section E","2001","57","11","o1075","o1077","10.1107/S160053680101618X","","","0.71073","MoKα","","0.198","0.064","","","","0.211","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200761","7.2233","0.0019","10.354","0.003","18.825","0.002","90","","91.334","0.019","90","","1407.5","0.6","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","alloevodionol methyl ether","1-(5,7-dimethoxy-2,2-dimethyl-2H-1-benzopyran-8-yl)-ethanone","","- C15 H18 O4 -","- C15 H18 O4 -","- C60 H72 O16 -","4","1","TK6041","Graham Smith; Ertong Wang; John P. Bartley; Raymond C. Bott","Alloevodionol methyl ether","Acta Crystallographica Section E","2001","57","11","o1111","o1112","10.1107/S160053680101786X","","","0.71069","MoKα","","0.1645","0.063","","","","0.2243","","","","","","1.389","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200762","11.166","0.001","11.409","0.001","11.724","0.001","107.63","0.01","110.44","0.01","96.68","0.01","1291.9","0.3","123","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C68 H50 N4 O2 Sn -","- C68 H50 N4 O2 Sn -","- C68 H50 N4 O2 Sn -","1","0.5","TK6042","Fallon, Gary D.; Lee, Marcia A.-P.; Langford, Steven J.","Bis(2-naphthoxy)[5,10,15,20-tetra-<i>p</i>-tolylporphyrinato]tin(IV)","Acta Crystallographica Section E","2001","57","12","m564","m565","10.1107/S1600536801017214","","","0.71073","MoKα","","","0.027","","","","0.067","","","","","","1.03","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200763","14.9106","0.001","8.9361","0.0006","30.252","0.002","90","","102.074","0.009","90","","3941.7","0.5","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H24 B4 F4 Mo O2 -","- C18 H24 B4 F4 Mo O2 -","- C144 H192 B32 F32 Mo8 O16 -","8","2","WN6036","Anderson, Kirsty M.; Kündig, E. Peter; Norman, Nicholas C.; Orpen, A. Guy; Pardoe, Jennifer A.J.; Smith, David W.; Timms, Peter L.","Dicarbonylbis(1,4-difluoro-2,3,5,6-tetramethyl-1,4-diboracyclohexa-2,5-diene)molybdenum","Acta Crystallographica Section E","2001","57","10","m419","m420","10.1107/S1600536801014167","","","0.71073","MoKα","","0.0318","0.0231","","","","0.0526","","","","","","0.977","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200764","9.432","0.002","20.957","0.005","14.728","0.003","90","","98.899","0.009","90","","2876.2","1.1","173","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tris(2,4-pentadionato)(1,10-phenanthroline)samarium(III)","","- C27 H29 N2 O6 Sm -","- C27 H29 N2 O6 Sm -","- C108 H116 N8 O24 Sm4 -","4","1","WN6044","Urs, Usha K.; Shalini, K.; Cameron, T. S.; Shivashankar, S. A.; Guru Row, T. N.","Low-temperature structure of a twinned crystal of tris(2,4-pentanedionato)(1,10-phenanthroline)samarium(III)","Acta Crystallographica Section E","2001","57","10","m457","m458","10.1107/S1600536801014398","","","0.71069","MoKα","","","0.0729","","","","0.2006","","","","","","1.323","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"2200765","11.709","0.005","14.551","0.004","17.558","0.006","90","","107.38","0.03","90","","2854.9","1.8","220","2","220","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[1,2-Bis(diphenylphosphino)ethane]dibromonickel(II) tetrahydrofuran solvate","","- C30 H32 Br2 Ni O P2 -","- C30 H32 Br2 Ni O P2 -","- C120 H128 Br8 Ni4 O4 P8 -","4","1","WN6045","Sophie Beaudoin; Davit Zargarian; Francine Bélanger-Gariépy; Frédéric-Georges Fontaine","[1,2-Bis(diphenylphosphino)ethane]dibromonickel(II) tetrahydrofuran solvate","Acta Crystallographica Section E","2001","57","10","m433","m434","10.1107/S1600536801014581","","","1.54056","CuKα1","","0.0578","0.0516","","0.1419","","0.138","","","1.016","","","1.079","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200766","7.6427","0.0014","11.035","0.002","37.95","0.005","90","","90","","90","","3200.6","0.9","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(2SR,4RS)-(4-Iodo-5,5-dimethyl-2-hexylsulfonyl)benzene","","- C14 H21 I O2 S -","- C14 H21 I O2 S -","- C112 H168 I8 O16 S8 -","8","1","WN6046","Guido J. Reiß; Marek Masnyk","(2<i>SR</i>,4<i>RS</i>)-(4-Iodo-5,5-dimethyl-2-hexylsulfonyl)benzene","Acta Crystallographica Section E","2001","57","10","o959","o960","10.1107/S1600536801015069","","","0.71073","MoKα","","0.0722","0.0374","","","","0.0686","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200767","6.1329","0.0008","14.3524","0.0013","9.4381","0.001","90","","103.919","0.009","90","","806.37","0.16","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(2R,4R)-(4-Iodo-5,5-dimethyl-2-hexylsulfonyl)benzene","","- C14 H21 I O2 S -","- C14 H21 I O2 S -","- C28 H42 I2 O4 S2 -","2","1","WN6047","Guido J. Reiß; Marek Masnyk","(2<i>R</i>,4<i>R</i>)-(4-Iodo-5,5-dimethyl-2-hexylsulfonyl)benzene","Acta Crystallographica Section E","2001","57","10","o961","o963","10.1107/S1600536801015070","","","0.71073","MoKα","","0.046","0.035","","","","0.0656","","","","","","1.067","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200768","9.9226","0.0005","10.8473","0.0007","13.3665","0.0007","90","","106.578","0.003","90","","1378.88","0.14","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Quinoline","Quinoline","","- C9 H7 N -","- C9 H7 N -","- C72 H56 N8 -","8","2","WN6048","Davies, John E.; Bond, Andrew D.","Quinoline","Acta Crystallographica Section E","2001","57","10","o947","o949","10.1107/S1600536801014891","","","0.7107","MoKα","","0.0636","0.0448","","","","0.1239","","","","","","1.039","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200769","12.57","0.002","14.285","0.003","17.502","0.004","85.082","0.01","69.225","0.012","87.07","0.02","2926.8","1","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","Aqua{5,15-bis[4-(2-trimethylsilylacetylene)phenyl]-2,8,12,18-tetrakis(2- methoxycarbonylethyl)-3,7,13,17-tetramethyl-10,20-dioxoporphyrinato}zinc(II)","","- C62 H68 N4 O11 Si2 Zn -","- C62 H68 N4 O11 Si2 Zn -","- C124 H136 N8 O22 Si4 Zn2 -","2","1","WN6049","Bond, Andrew D.; Feeder, Neil; Teat, Simon J.; Clyde-Watson, Zoe; Bampos, Nick; Sanders, Jeremy K. M.","Aqua{5,15-bis[4-(2-trimethylsilylacetylene)phenyl]-2,8,12,18-tetrakis(2-methoxycarbonylethyl)-3,7,13,17-tetramethyl-10,20-dioxoporphyrinato}zinc(II)","Acta Crystallographica Section E","2001","57","10","m454","m456","10.1107/S1600536801014854","","","0.6879","synchrotron","","0.0756","0.0539","","","","0.1354","","","","","","0.915","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2200770","11.0977","0.0002","23.7744","0.0002","17.1024","0.0001","90","","94.347","0.001","90","","4499.34","0.09","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C45 H38 Br2 Cu2 N10 O4 -","- C45 H38 Br2 Cu2 N10 O4 -","- C180 H152 Br8 Cu8 N40 O16 -","4","1","WN6050","Guido Kickelbick","The unexpected fixation of CO~2~ employing a Cu^I^Br(bpy)~2~ complex","Acta Crystallographica Section E","2001","57","10","m475","m477","10.1107/S1600536801015276","","","0.71073","MoKα","","0.0577","0.0473","","","","0.1098","","","","","","1.173","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200771","7.6547","0.0001","19.1163","0.0002","10.8285","0.0001","90","","106.041","0.001","90","","1522.83","0.03","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Diaquabis(nicotinamide)bis(o-sulfobenzimidato-N)cadmium(II)","","- C26 H24 Cd N6 O10 S2 -","- C26 H24 Cd N6 O10 S2 -","- C52 H48 Cd2 N12 O20 S4 -","2","0.5","WN6051","C̨akir, Semiha; Naumov, Panče; Bulut, İclal; Bic̨er, Ender; C̨akir, Osman; Jovanovski, Gligor; Ibrahim Abdul Razak; Chantrapromma, Suchada; Fun, Hoong-Kun; Ng, Seik Weng","Diaquabis(nicotinamide)bis(<i>o</i>-sulfobenzimidato-<i>N</i>)cadmium(II)","Acta Crystallographica Section E","2001","57","10","m431","m432","10.1107/S1600536801014453","","","0.71073","MoKα","","0.0455","0.0372","","","","0.0958","","","","","","0.985","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200772","5.8955","0.001","5.8955","0.001","9.599","0.001","90","","90","","120","","288.93","0.08","290","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- F6 H8 N2 Si -","- F6 H8 N2 Si -","- F12 H16 N4 Si2 -","2","0.166667","WN6052","Fábry, Jan; Chval, Jindřich; Petříček, Vaclav","A new modification of diammonium hexafluorosilicate, (NH~4~)~2~SiF~6~","Acta Crystallographica Section E","2001","57","10","i90","i91","10.1107/S160053680101501X","","","0.71069","MoKα","","0.0192","0.0178","","","","0.0221","","","","","","1.7","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2200773","26.519","0.004","5.1011","0.0009","12.143","0.002","90","","110.019","0.004","90","","1543.4","0.4","160","2","160","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaquabis(4-nitrobenzoato)zinc(II)","","- C14 H12 N2 O10 Zn -","- C14 H12 N2 O10 Zn -","- C56 H48 N8 O40 Zn4 -","4","0.5","WN6053","Necefoglu, Hacali; Clegg, William; Scott, Andrew J.","Diaquabis(4-nitrobenzoato)zinc(II): a redetermination","Acta Crystallographica Section E","2001","57","10","m472","m474","10.1107/S1600536801015082","","","0.71073","MoKα","","0.0286","0.0282","","","","0.0738","","","","","","1.091","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200774","12.584","0.003","10.083","0.002","13.956","0.003","90","","102.57","0.03","90","","1728.4","0.7","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C23 H18 O3 -","- C23 H18 O3 -","- C92 H72 O12 -","4","2","WN6054","Cai, Yue-Peng; Tan, Duan-Min; Liao, Miao-Fen; Su, Cheng-Yong; Xu, Zun-Le; Kang, Bei-Sheng","1-Oxo-13c-propoxy-1,13c-dihydrodibenzo[<i>a</i>,<i>kl</i>]xanthene","Acta Crystallographica Section E","2001","57","11","o1014","o1015","10.1107/S1600536801016087","","","0.71073","MoKα","","0.0751","0.0441","","","","0.097","","","","","","1.051","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200775","7.324","0.006","7.342","0.009","15.559","0.01","77.95","0.01","86.43","0.01","78.09","0.01","800.4","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H21 Cl2 N3 O4 -","- C12 H21 Cl2 N3 O4 -","- C24 H42 Cl4 N6 O8 -","2","1","WN6055","John Burgess; John Fawcett; Simon A. Parsons","3-Hydroxy-1-(3-imidazolylpropyl)-2-methyl-4-pyridinone dihydrochloride dihydrate","Acta Crystallographica Section E","2001","57","11","o1016","o1018","10.1107/S1600536801016130","","","0.71073","MoKα","","0.1506","0.0621","","","","0.1514","","","","","","1.002","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200776","10.782","0.0003","19.6026","0.0004","22.5181","0.0007","90","","90","","90","","4759.3","0.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","asco8-m","Diastereomer 8 of desoxazolin-ascidiacyclamide derivatives cyclo(-Ile-D-allo-MsThr-D-Val-Thz-Ile-D-allo-MsThr-D-Val-Thz-) Ms=methoxysufonyl","","- C38 H60 N8 O12 S4 -","- C38 H60 N8 O12 S4 -","- C152 H240 N32 O48 S16 -","4","1","WN6056","Mitsunobu Doi; Akiko Asano; Yoshihide Usami; Yoshio Katsuya; Masamichi Nakai; Masahiro Sasaki; Taizo Taniguchi; Hiroshi Hasegawa","A folded conformation of an ascidiacyclamide derivative: 3-methoxysulfoxide-(2<i>R</i>,3<i>R</i>)-threoninyl desoxazoline-ascidiacyclamide","Acta Crystallographica Section E","2001","57","11","o1019","o1021","10.1107/S1600536801016129","","","0.836","synchrotron","","0.0783","0.075","","","","0.2014","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200777","14.522","0.001","10.439","0.001","10.523","0.001","90","","109.46","0.004","90","","1504.1","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-methyl-N-(4-nitro-2-phenoxyphenyl)methanesulfonamide","","- C14 H14 N2 O5 S -","- C14 H14 N2 O5 S -","- C56 H56 N8 O20 S4 -","4","1","WN6057","Michaux, Catherine; Charlier, Caroline; Julémont, Fabien; Norberg, Bernadette; Dogné Jean-Michel; Durant, François","FJ6, <i>N</i>-methyl-<i>N</i>-(4-nitro-2-phenoxyphenyl)methanesulfonamide","Acta Crystallographica Section E","2001","57","11","o1012","o1013","10.1107/S1600536801015823","","","1.54178","CuKα","","0.044","0.0413","","","","0.1176","","","","","","1.049","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200778","32.0245","0.0014","7.1329","0.0003","14.6141","0.0006","90","","116.864","0.001","90","","2978","0.2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Dichlorobis(3,4,5,6-tetrahydropyrimidinium-2-thiolato-S)cobalt(II)","","- C8 H16 Cl2 Co N4 S2 -","- C8 H16 Cl2 Co N4 S2 -","- C64 H128 Cl16 Co8 N32 S16 -","8","1","WN6058","Ibrahim Abdul Razak; Anwar Usman; Hoong-Kun Fun; Bohari M. Yamin; Goh Wooi Keat","Dichlorobis(3,4,5,6-tetrahydropyrimidinium-2-thiolato-<i>S</i>)cobalt(II)","Acta Crystallographica Section E","2001","57","11","m527","m528","10.1107/S1600536801016828","","","0.71073","MoKα","","0.0687","0.0507","","","","0.1416","","","","","","0.984","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200779","10.113","0.0004","8.9101","0.0002","15.6434","0.0007","90","","96.855","0.0017","90","","1399.52","0.09","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-(2-Thienyl)-9-(2-phenylethyl)-9H-purine","","- C16 H12 N4 S -","- C16 H12 N4 S -","- C64 H48 N16 S4 -","4","1","WN6059","Mazumdar, Pooja Anjali; Das, Amit Kumar; Bakkestuen, Ann Kristin; Gundersen, Lise-Lotte; Bertolasi, Valerio","9-(2-Phenylethyl)-6-(2-thienyl)-9<i>H</i>-purine","Acta Crystallographica Section E","2001","57","11","o1052","o1054","10.1107/S1600536801016907","","","0.7107","MoKα","","0.062","0.047","","","","0.1303","","","","","","1.089","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200780","30.1055","0.0018","7.5383","0.0011","13.8612","0.0014","90","","90.338","0.004","90","","3145.7","0.6","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-[3-(4-Chlorophenyl)pyrazol-5-yl]-1-(2-hydroxy-4-methoxyphenyl)ethanone","","- C18 H15 Cl N2 O3 -","- C18 H15 Cl N2 O3 -","- C144 H120 Cl8 N16 O24 -","8","1","WN6060","Errington, William; Kumar, Rajesh; Kumar, Naresh; Parmar, Virinder S.; Roy, Sucharita","2-[3-(4-Chlorophenyl)pyrazol-5-yl]-1-(2-hydroxy-4-methoxyphenyl)ethanone","Acta Crystallographica Section E","2001","57","11","o1084","o1086","10.1107/S1600536801017421","","","0.71073","MoKα","","0.073","0.042","","","","0.1052","","","","","","0.913","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200781","20.626","0.004","10.099","0.002","17.183","0.003","90","","90","","90","","3579.3","1.2","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C32 H56 B9 N -","- C32 H56 B9 N -","- C128 H224 B36 N4 -","4","1","WN6061","Rosair, Georgina M.; Schmidt, Falk H.; Welch, Alan J.","Tetra-<i>n</i>-butylammonium 7-phenylethynyl-8-phenyl-7,8-<i>nido</i>-dicarbadecahydroundecaborate(1{-})","Acta Crystallographica Section E","2001","57","12","o1171","o1172","10.1107/S1600536801018888","","","0.71073","MoKα","","0.2212","0.1015","","","","0.3023","","","","","","1.015","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200782","5.904","0.003","13.519","0.006","7.883","0.006","90","","90.26","0.06","90","","629.2","0.6","150","2","150","2","","","","","","","Synthetic","4","P 1 21/n 1","-P 2yn","14","zinc(II) sulfate tetrahydrate","zinc(II) sulfate tetrahydrate","Boyleite","- H16 O16 S2 Zn2 -","- H16 O16 S2 Zn2 -","- H32 O32 S4 Zn4 -","2","0.5","WN6062","Blake, Alexander J.; Cooke, Paul A.; Hubberstey, Peter; Sampson, Claire L.","Zinc(II) sulfate tetrahydrate","Acta Crystallographica Section E","2001","57","12","i109","i111","10.1107/S1600536801017998","","","0.71073","MoKα","","0.094","0.059","","","","0.157","","","","","","1.077","","","","has coordinates,has Fobs","282068","2023-03-26","10:12:33",""
"2200783","10.8877","0.0002","24.1232","0.0004","16.7066","0.0002","90","","95.772","0.001","90","","4365.68","0.12","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48.5 H45 Cu P2 S2 -","- C48.5 H45 Cu P2 S2 -","- C194 H180 Cu4 P8 S8 -","4","1","WN6063","Theivanayagam C Deivaraj; Jagadese J. Vittal","Bis(dithioacetato-κ^2^<i>S</i>)bis(triphenylphosphine-κ<i>P</i>)copper(I) 1.5-toluene solvate","Acta Crystallographica Section E","2001","57","12","m566","m567","10.1107/S1600536801018281","","","0.71073","MoKα","","0.091","0.0642","","","","0.1605","","","","","","1.102","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2200784","7.024","0.003","7.556","0.004","14.102","0.004","90","","97.52","0.04","90","","742","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","β-alaninium perchlorate","β-alaninium perchlorate","","- C3 H8 Cl N O6 -","- C3 H8 Cl N O6 -","- C12 H32 Cl4 N4 O24 -","4","1","WN6064","S. Pandiarajan; B. Sridhar; R. K. Rajaram","β-Alaninium perchlorate","Acta Crystallographica Section E","2001","57","11","o1130","o1132","10.1107/S1600536801018128","","","0.71073","MoKα","","0.07","0.0619","","","","0.2164","","","","","","1.12","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2200785","5.451","0.001","8.807","0.002","22.649","0.005","90","","90","","90","","1087.3","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","D-phenylglycinium perchlorate","D-phenylglycinium perchlorate","","- C8 H10 Cl N O6 -","- C8 H10 Cl N O6 -","- C32 H40 Cl4 N4 O24 -","4","1","WN6065","S.Ramaswamy; B.Sridhar; V.Ramakrishnan; R.K.Rajaram","<small>D</small>-Phenylglycinium perchlorate","Acta Crystallographica Section E","2001","57","12","o1149","o1151","10.1107/S160053680101858X","","","0.71073","MoKα","","0.058","0.0556","","","","0.1612","","","","","","1.073","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200786","8.6314","0.0007","10.3062","0.0008","11.972","0.0009","75.4198","0.001","83.3078","0.001","84.9883","0.001","1021.81","0.14","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H62 Cl2 Ni P2 S2 -","- C36 H62 Cl2 Ni P2 S2 -","- C36 H62 Cl2 Ni P2 S2 -","1","0.5","WN6066","Ilia A. Guzei; Makwena J. Moloto; James Darkwa","Bis(<i>p</i>-chlorothiophenolato)bis(tri-<i>n</i>-butylphosphine)nickel(II)","Acta Crystallographica Section E","2001","57","12","m568","m569","10.1107/S1600536801018554","","","0.71073","MoKα","","0.0533","0.0425","","","","0.1258","","","","","","1.071","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200787","15.5665","0.0011","15.5665","0.0011","6.7777","0.0006","90","","90","","120","","1422.31","0.19","297","2","297","2","","","","","","","","5","P -3","-P 3","147","[CdBr4] [CdBr3] + 3 DEAH","","","- C12 H36 Br7 Cd2 N3 -","- C12 H36 Br7 Cd2 N3 -","- C24 H72 Br14 Cd4 N6 -","2","0.333333","WN6067","Willett, Roger D.; Twamley, Brendan","Diethylammonium heptabromidedicadmium(II)","Acta Crystallographica Section E","2001","57","12","m573","m575","10.1107/S1600536801018852","","","0.71073","MoKα","","0.0699","0.0389","","","","0.082","","","","","","1.016","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200788","6.7155","0.0008","14.6106","0.0011","10.3011","0.0008","90","","95.333","0.01","90","","1006.34","0.16","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","copper(II)diene dichloride","","","- C8 H28 Cl4 Cu2 N6 O -","- C8 H28 Cl4 Cu2 N6 O -","- C16 H56 Cl8 Cu4 N12 O2 -","2","0.5","WN6069","Willett, Roger D.","Aqua-di-μ~2~-chloro-bis(diethylenetriamine)dicopper(II) dichloride","Acta Crystallographica Section E","2001","57","12","m605","m606","10.1107/S1600536801019808","","","0.71073","MoKα","","0.0472","0.0407","","","","0.1159","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200789","15.575","0.003","10.434","0.008","12.217","0.003","90","","94.65","0.01","90","","1978.8","1.6","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(4R,5R)-2-(N-Methyl-benzylamino)-3-nitro-4-(1',2',3',4',5'-penta-O-acetyl-D- manno-pentitol-1-yl)-5-phenyl-5-phenylcarbamoyl-4,5-dihydrothiophene","","- C40 H43 N3 O13 S -","- C40 H43 N3 O13 S -","- C80 H86 N6 O26 S2 -","2","1","WN6070","Diánez, María Jesús; Estrada, María Dolores; López-Castro, Amparo; Pérez-Garrido, Simeón","(4<i>R</i>,5<i>R</i>)-2-(<i>N</i>-Methyl-benzylamino)-3-nitro-4-(1',2',3',4',5'-penta-<i>O</i>-acetyl-<small>D</small>-<i>manno</i>-pentitol-1-yl)-5-phenyl-5-phenylcarbamoyl-4,5-dihydrothiophene at 150K","Acta Crystallographica Section E","2001","57","12","o1255","o1257","10.1107/S1600536801019559","","","0.71069","MoKα","","0.0544","0.0413","","","","0.1076","","","1.02","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200790","11.8845","0.001","14.8554","0.0018","21.652","0.003","90","","97.372","0.009","90","","3791","0.8","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Palladium, tetrakis[μ-(cyano-C:N)]tetrakis(pentafluorophenyl) tetrakis(triethylphosphine)tetra-, cyclo (9CI), ditoluene","","- C66 H76 F20 N4 P4 Pd4 -","- C66 H76 F20 N4 P4 Pd4 -","- C132 H152 F40 N8 P8 Pd8 -","2","0.5","YA6040","Jonathan P. H. Charmant; Pablo Espinet; Katerina Soulantica","Square [Pd~4~(μ-CN)~4~(C~6~F~5~)~4~(PEt~3~)~4~]·2C~6~H~5~CH~3~","Acta Crystallographica Section E","2001","57","10","m451","m453","10.1107/S1600536801014994","","","0.71073","MoKα","","0.039","0.025","","","","0.061","","","","","","0.97","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200791","12.536","0.016","5.378","0.004","14.962","0.009","90","","107.83","0.08","90","","960.3","1.6","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","L-Phenylalanine‒nitric acid (2/1)","L-Phenylalanine‒nitric acid (2/1)","","- C18 H23 N3 O7 -","- C18 H16 N3 O7 -","- C36 H32 N6 O14 -","2","1","YA6047","Srinivasan, N.; Sridhar, B.; Rajaram, R. K.","<small>L</small>-Phenylalanine‒nitric acid (2/1)","Acta Crystallographica Section E","2001","57","10","o916","o918","10.1107/S1600536801014350","","","0.71073","MoKα","","0.093","0.069","","","","0.22","","","","","","1.09","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200792","8.5196","0.0009","9.144","0.001","11.386","0.004","69.41","0.02","89.44","0.01","84.22","0.01","825.8","0.3","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","Acridine‒isophthalic acid","","- C21 H15 N O4 -","- C21 H15 N O4 -","- C42 H30 N2 O8 -","2","1","YA6049","Shaameri, Zurina; Shan, Ning; Jones, William","Acridinium isophthalate","Acta Crystallographica Section E","2001","57","10","o945","o946","10.1107/S1600536801013927","","","0.71073","MoKα","","0.074","0.045","","","","0.12","","","","","","1.11","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200793","8.659","0.004","10.036","0.0017","13.292","0.003","91.731","0.016","91.17","0.03","109.09","0.02","1090.5","0.6","293","1","293","1","","","","","","","","5","P -1","-P 1","2","","","","- C14 H18 Co2 O6 Sn2 -","- C14 H18 Co2 O6 Sn2 -","- C28 H36 Co4 O12 Sn4 -","2","1","YA6054","Zachwieja, Uwe; Preut, Hans; Mitchell, Terence; Zavgorodnii, Vladislav S.; Golosovskii, Andrei V.; Klyuchinskii, Sergei A.","{[μ,η^2^-Bis(trimethylstannyl)]acetylene}hexacarbonyldicobalt","Acta Crystallographica Section E","2001","57","11","m531","m532","10.1107/S1600536801016154","","","0.56083","AgKα","","0.047","0.034","","","","0.091","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200794","10.713","0.0003","9.0471","0.0003","20.6565","0.0007","90","","90.1565","0.0013","90","","2002.05","0.11","291","1","291","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H24 N2 O3 -","- C22 H24 N2 O3 -","- C88 H96 N8 O12 -","4","1","YA6055","Kolev, Tsonko; Glavcheva, Zornitza; Schürmann, Markus; Kleb, Dirk-Christian; Preut, Hans; Bleckmann, Paul","Monoclinic form of 2-{5,5-dimethyl-3-[2-(2,4,6-trimethoxyphenyl)vinyl]cyclohex-2-enylidene}malononitrile","Acta Crystallographica Section E","2001","57","10","o964","o965","10.1107/S1600536801015203","","","0.71073","MoKα","","0.167","0.054","","","","0.136","","","","","","0.95","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200795","7.5983","0.0003","11.4757","0.0004","11.5774","0.0004","84.8457","0.0015","82.2149","0.0016","79.0257","0.0017","979.77","0.06","291","1","291","1","","","","","","","","4","P -1","-P 1","2","","","","- C22 H24 N2 O3 -","- C22 H24 N2 O3 -","- C44 H48 N4 O6 -","2","1","YA6056","Kolev, Tsonko; Glavcheva, Zornitza; Yancheva, Denitsa; Schürmann, Markus; Kleb, Dirk-Christian; Preut, Hans; Bleckmann, Paul","Triclinic form of 2-{5,5-dimethyl-3-[2-(2,4,6-trimethoxyphenyl)vinyl]cyclohex-2-enylidene}malononitrile","Acta Crystallographica Section E","2001","57","10","o966","o967","10.1107/S1600536801015197","","","0.71073","MoKα","","0.203","0.053","","","","0.118","","","","","","0.9","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200796","7.2637","0.0003","14.4294","0.0005","15.1081","0.0005","70.368","0.003","78.55","0.002","89.08","0.0014","1459.56","0.1","120","1","120","1","","","","","","","","5","P -1","-P 1","2","","11-Chloro-5H-6,7-dihydrobenzothiazolo[2,3-b]benzo[h]quinazoline","","- C18 H13 Cl N2 S -","- C18 H13 Cl N2 S -","- C72 H52 Cl4 N8 S4 -","4","2","YA6057","Low, John Nicolson; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo; Quiroga, Jairo; Hernández, Pedro","11-Chloro-5,7-dihydro-6<i>H</i>-benzothiazolo[2,3-<i>b</i>]benzo[<i>h</i>]quinazoline","Acta Crystallographica Section E","2001","57","10","o937","o938","10.1107/S1600536801014787","","","0.71073","MoKα","","0.073","0.042","","","","0.102","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200797","16.012","0.003","13.761","0.002","18.126","0.004","90","","98.49","0.02","90","","3950.1","1.3","291","1","291","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H40 Co2 O4 P2 Sn2 -","- C37 H40 Co2 O4 P2 Sn2 -","- C148 H160 Co8 O16 P8 Sn8 -","4","1","YA6058","Zachwieja, Uwe; Preut, Hans; Mitchell, Terence; Zavgorodnii, Vladislav S.; Golosovskii, Andrei V.; Karpov, Maxim G.","[Bis(diphenylphosphino)methane][μ,η^2^-bis(trimethylstannyl)acetylene]tetracarbonyldicobalt","Acta Crystallographica Section E","2001","57","11","m533","m534","10.1107/S1600536801016166","","","0.56083","AgKα","","0.094","0.036","","","","0.105","","","","","","0.99","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200798","7.128","0.005","9.995","0.005","25.55","0.02","90","","94.26","0.06","90","","1815","2","123","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H21 Cl2 P Ru -","- C18 H21 Cl2 P Ru -","- C72 H84 Cl8 P4 Ru4 -","4","1","YA6059","Jensen, Svend B.; Spicer, Mark D.","(η^6^-Benzene)dichloro(diallylphenylphosphine)ruthenium(II), the first structurally characterized complex with the diallylphosphine ligand","Acta Crystallographica Section E","2001","57","10","o978","o979","10.1107/S1600536801015215","","","0.71073","MoKα","","0.051","0.03","","","","0.079","","","","","","1.03","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200799","4.1204","0.0006","10.7106","0.0017","13.842","0.002","97.45","0.004","94.291","0.004","97.184","0.004","598.38","0.16","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","4-(1-Chloroethyl)coumarin-7-yl acetate","","- C13 H11 Cl O4 -","- C13 H11 Cl O4 -","- C26 H22 Cl2 O8 -","2","1","YA6060","Errington, William; Parmar, Virinder S.; Singh, Amarjit; Singh, Ishwar","7-Acetoxy-4-(1-chloroethyl)coumarin","Acta Crystallographica Section E","2001","57","10","o939","o940","10.1107/S1600536801014799","","","0.71073","MoKα","","0.0574","0.0422","","","","0.1179","","","","","","1","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200800","9.171","0.002","11.353","0.002","20.314","0.004","101.98","0.01","94.56","0.02","107.28","0.02","1952.9","0.7","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","1,4:2,3-bis(μ-2,4,6-trimethylphenyl-C:C)-1,2:3,4-bis[μ- bis(trimethylsilyl)amido-N:N]tetracopper(I)","","- C30 H58 Cu4 N2 Si4 -","- C30 H58 Cu4 N2 Si4 -","- C60 H116 Cu8 N4 Si8 -","2","1","YA6061","Niemeyer, Mark","A heteroleptic tetranuclear copper amide/aryl complex: 1,4:2,3-bis(μ-2,4,6-trimethylphenyl-<i>C</i>,<i>C</i>)-1,2:3,4-bis[μ-bis(trimethylsilyl)amido-<i>N</i>,<i>N</i>]tetracopper(I)","Acta Crystallographica Section E","2001","57","10","m491","m493","10.1107/S1600536801015550","","","0.71073","MoKα","","0.047","0.037","","","","0.101","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200801","19.706","0.006","4.614","0.002","12.308","0.004","90","","104.7","0.03","90","","1082.5","0.7","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-chloro-2-(phenyldiazenyl)phenol","","- C12 H9 Cl N2 O -","- C12 H9 Cl N2 O -","- C48 H36 Cl4 N8 O4 -","4","1","YA6063","Yatsenko, A. V.; Paseshnichenko, K. A.; Schenk, H.","4-Chloro-2-(phenyldiazenyl)phenol from powder data: a form stable at room temperature","Acta Crystallographica Section E","2001","57","12","o1154","o1155","10.1107/S1600536801018426","","","1.5418","CuKα","","","","","","","","","","1.09","","","","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200802","12.384","0.004","19.767","0.006","4.554","0.002","90","","93.27","0.03","90","","1113","0.7","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-chloro-2-(phenyldiazenyl)phenol","","- C12 H9 Cl N2 O -","- C12 H9 Cl N2 O -","- C48 H36 Cl4 N8 O4 -","4","1","YA6064","Yatsenko, A. V.; Paseshnichenko, K. A.; Schenk, H.","4-Chloro-2-(phenyldiazenyl)phenol from powder data: a form metastable at room temperature","Acta Crystallographica Section E","2001","57","12","o1156","o1157","10.1107/S1600536801018438","","","1.5418","CuKα","","","","","","","","","","1.71","","","","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200803","15.036","0.005","12.722","0.004","7.042","0.003","90","","90","","90","","1347.1","0.8","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Pigment Orange 2","1-[(2-nitrophenyl)hydrazono]-1H-naphthalen-2-one","","- C16 H11 N3 O3 -","- C16 H11 N3 O3 -","- C64 H44 N12 O12 -","4","1","YA6065","Yatsenko, Alexandr V.; Paseshnichenko, Ksenia A.; Chernyshev, Vladimir V.; Schenk, Henk","1-[(2-Nitrophenyl)hydrazono]-1<i>H</i>-naphthalen-2-one (Pigment Orange 2) from powder data","Acta Crystallographica Section E","2001","57","12","o1152","o1153","10.1107/S1600536801018268","","","1.5418","CuKα","","","","","","","","","","3.86","","","","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200804","11.3398","0.0006","11.3398","0.0006","17.3584","0.0011","90","","90","","120","","1933.09","0.19","173","2","173","2","","","","","","","","6","R -3 :H","-R 3","148","(MeCN)6Fe (SbF6)2","hexakis(acetonitrile) iron(II) hexafluoroantimonate","","- C12 H18 F12 Fe N6 Sb2 -","- C12 H18 F12 Fe N6 Sb2 -","- C36 H54 F36 Fe3 N18 Sb6 -","3","0.166667","YA6066","Brennessel, William W.; Brooks, Neil R.; Mehn, Mark P.; Que Jr, Lawrence; Young Jr, Victor G.","Hexakis(acetonitrile)iron(II) hexafluoroantimonate","Acta Crystallographica Section E","2001","57","11","m545","m546","10.1107/S1600536801017585","","","0.71073","MoKα","","0.025","0.024","","","","0.069","","","","","","1.12","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200805","14.3726","0.0007","14.6998","0.0011","15.9304","0.0009","90","","115.156","0.004","90","","3046.5","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H32 N4 O6 Pd2 -","- C31 H32 N4 O6 Pd2 -","- C124 H128 N16 O24 Pd8 -","4","1","YA6067","Olga Juanes; Juan-Carlos Rodriguez-Ubis; César J. Pastor","Double cyclometallation of bis[3-(3-methoxyphenyl)pyrazol-1-yl]methane in a bis[(acetylacetonato)palladium(II)] complex","Acta Crystallographica Section E","2001","57","12","m576","m577","10.1107/S1600536801018712","","","1.54178","CuKα","","0.035","0.033","","","","0.088","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200806","12.1298","0.0017","9.5303","0.0013","17.144","0.002","90","","90","","90","","1981.9","0.5","203","2","203","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","Bis-Tris","","","- C8 H19 N O5 -","- C8 H19 N O5 -","- C64 H152 N8 O40 -","8","1","YA6068","Nicholson, Kirsten N.; Twamley, Brendan; Wood, Scott","[Bis(2-hydroxyethyl)amino]tris(hydroxymethyl)methane (Bis‒Tris), an important complexing agent","Acta Crystallographica Section E","2001","57","11","o1133","o1135","10.1107/S1600536801017974","","","0.71073","MoKα","","0.043","0.034","","","","0.084","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200807","7.0317","0.0001","11.0201","0.0002","5.3323","0.0001","90","","90","","90","","413.2","0.012","130","2","130","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","maleic anhydride","2,5-furandione","","- C4 H2 O3 -","- C4 H2 O3 -","- C16 H8 O12 -","4","1","YA6070","Lutz, Martin","Maleic anhydride, redetermination at 130K","Acta Crystallographica Section E","2001","57","11","o1136","o1138","10.1107/S1600536801017962","","","0.71073","MoKα","","0.031","0.027","","","","0.07","","","","","","0.93","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200808","35.262","0.003","8.3791","0.0005","24.9461","0.0017","90","","120.536","0.006","90","","6348.4","0.9","297","2","297","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H27.5 Br2 N4.5 O4 Pd2 -","- C30 H27.5 Br2 N4.5 O4 Pd2 -","- C240 H220 Br16 N36 O32 Pd16 -","8","1","YA6071","Olga Juanes; Juan-Carlos Rodriguez-Ubis; César J. Pastor","Double cyclometallation of bis[3-(3-bromophenyl)pyrazol-1-yl]methane in the bis[acetylacetonatopalladium(II)] complex","Acta Crystallographica Section E","2001","57","12","m595","m596","10.1107/S1600536801019419","","","1.54178","CuKα","","0.06","0.055","","","","0.143","","","","","","1.12","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200809","9.754","0.003","11.9028","0.0018","17.093","0.003","75.923","0.014","74.367","0.018","66.56","0.016","1732.5","0.7","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","bis(1,1':3',1''-terphenyl-κC^2'^)bis(tetrahydrofuran-κO)ytterbium(II)","","- C44 H42 O2 Yb -","- C44 H42 O2 Yb -","- C88 H84 O4 Yb2 -","2","1","YA6073","Niemeyer, Mark","A solvated ytterbium diaryl: bis(1,1':3',1''-terphenyl-<i>C</i>^2'^)bis(tetrahydrofuran-<i>O</i>)ytterbium(II)","Acta Crystallographica Section E","2001","57","12","m578","m580","10.1107/S1600536801018797","","","0.71073","MoKα","","0.04","0.032","","","","0.078","","","","","","1.19","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200810","13.1374","0.0003","13.2089","0.0003","19.7506","0.0004","90","","90","","90","","3427.33","0.13","291","1","291","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C20 H20 N2 O -","- C20 H20 N2 O -","- C160 H160 N16 O8 -","8","1","YA6074","Kolev, Tsonko; Glavcheva, Zornitza; Schürmann, Markus; Kleb, Dirk-Christian; Preut, Hans; Bleckmann, Paul","2-{5,5-Dimethyl-3-[2-(2-methoxyphenyl)vinyl]cyclohex-2-enylidene}malononitrile","Acta Crystallographica Section E","2001","57","12","o1166","o1167","10.1107/S1600536801018700","","","0.71073","MoKα","","0.137","0.049","","","","0.125","","","","","","0.98","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200811","34.1913","0.0012","10.7042","0.0004","19.1129","0.0009","90","","118.186","0.002","90","","6165.6","0.4","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Methyl 5-methyl-3,4-diphenyl-1H-pyrrole-2-carboxylate","","- C19 H17 N O2 -","- C19 H17 N O2 -","- C304 H272 N16 O32 -","16","2","YA6076","Light, Mark E.; Camiolo, Salvatore; Gale, Philip A.; Hursthouse, Michael B.","Methyl 5-methyl-3,4-diphenyl-1<i>H</i>-pyrrole-2-carboxylate","Acta Crystallographica Section E","2001","57","12","o1245","o1246","10.1107/S1600536801019225","","","0.71073","MoKα","","0.128","0.06","","","","0.171","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200812","8.0274","0.0012","8.389","0.002","20.562","0.003","90","","90.606","0.019","90","","1384.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,4-Dibromophenyl 2,6-dibromophenyl ether","","- C12 H6 Br4 O -","- C12 H6 Br4 O -","- C48 H24 Br16 O4 -","4","1","AC6000","Eriksson, Johan; Eriksson, Lars; Hu, Jiwei","2,4-Dibromophenyl 2,6-dibromophenyl ether","Acta Crystallographica Section E","2002","58","3","o347","o349","10.1107/S1600536802002738","","","0.71073","MoKα","","0.059","0.0294","","","0.0539","0.0563","","","","","","0.981","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200813","3.4165","0.0001","3.4165","0.0001","25.122","0.001","90","","90","","120","","253.95","0.015","299","2","299","2","","","","","","","","4","R -3 m :H","-R 3 2""","166","Ytterbium Cobalt Gallium Oxide","","","- Co Ga O4 Yb -","- Co Ga O4 Yb -","- Co3 Ga3 O12 Yb3 -","3","0.0833333","BR6029","Dabkowska, Hanna A.; Gaulin, Bruce D.; Dabkowski, Antoni; Luke, Graeme M.; Britten, James F.","Ytterbium cobalt gallium oxide, YbCoGaO~4~, as grown by the floating zone technique","Acta Crystallographica Section E","2002","58","1","i1","i2","10.1107/S1600536801020062","","","0.71073","MoKα","","0.0288","0.0269","","","0.0616","0.0618","","","","","","1.158","","","","has coordinates,has Fobs","282068","2023-03-26","10:12:33",""
"2200814","5.3046","0.0008","8.3053","0.0013","12.7","0.002","90","","90.502","0.003","90","","559.48","0.15","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Mg O7 P2 Sr -","- Mg O7 P2 Sr -","- Mg4 O28 P8 Sr4 -","4","1","","Alaoui Tahiri, Aziz; El Bali, Brahim; Lachkar, Mohammed; Ouarsal, Rachid; Zavalij, Peter Y.","SrMgP~2~O~7~","Acta Crystallographica, Section E","2002","58","","i9","i11","10.1107/S1600536801020633","","","","","","","","","","","","","","","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200815","11.994","0.003","11.131","0.002","11.384","0.009","90","","109.31","0.08","90","","1434.3","1.4","298","2","298","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- H30 Mo6 N4 Ni O28 -","- Mo6 N4 Ni O28 -","- Mo12 N8 Ni2 O56 -","2","0.5","BR6038","Lee, Uk; Joo, Hea-Chung; Kwon, Jae-Sam","Tetraammonium hexahydrogen hexamolybdonickelate(II) tetrahydrate, (NH~4~)~4~[H~6~NiMo~6~O~24~]·4H~2~O","Acta Crystallographica Section E","2002","58","1","i6","i8","10.1107/S1600536801021109","","","0.71069","MoKα","","0.0813","0.0526","","","0.117","0.1371","","","","","","1.128","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200816","9.3857","0.0009","9.3857","0.0009","56.261","0.009","90","","90","","120","","4292.1","0.9","293","2","293","2","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- K2 Mo15 S19 -","- K2 Mo15 S19 -","- K12 Mo90 S114 -","6","0.166667","BR6039","Picard, S.; Gougeon, P.; Potel, M.","K~2~Mo~15~S~19~: a novel ternary reduced molybdenum sulfide containing Mo~6~ and Mo~9~ clusters","Acta Crystallographica Section E","2002","58","2","i12","i14","10.1107/S1600536801021651","","","0.71073","MoKα","","0.0285","0.0189","","","0.0361","0.0377","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200817","10.224","0.001","7.37","0.001","24.866","0.002","90","","98.41","0.01","90","","1853.5","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- H12 Mg O10 Se -","- H12 Mg O10 Se -","- H96 Mg8 O80 Se8 -","8","1","","Kolitsch, Uwe","Magnesium selenate hexahydrate, MgSeO~4~.6H~2~O","Acta Crystallographica, Section E","2002","58","","i3","i5","10.1107/S1600536801020864","","","","","","","","","","","","","","","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200818","4.7461","0.0006","4.7461","0.0006","9.3075","0.0011","90","","90","","120","","181.57","0.04","293","2","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Au Ba Sb -","- Au Ba Sb -","- Au2 Ba2 Sb2 -","2","0.0833333","BR6041","Lee, Eun Kwang; Miller, Gordon J.; Kang, Sung Kwon","The intermetallic compound BaAuSb","Acta Crystallographica Section E","2002","58","2","i17","i18","10.1107/S1600536802000569","","","0.71073","MoKα","","","0.0326","","","","0.0818","","","","","","1.137","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200819","10.671","0.002","7.767","0.002","12.876","0.003","90","","90","","90","","1067.2","0.4","293","2","293","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Lithium potassium tungstate monohydrate","","- H2 K Li O5 W -","- H2 K Li O5 W -","- H16 K8 Li8 O40 W8 -","8","1","BR6043","Radosavljevic Evans, I.; Howard, Judith A. K.","Lithium potassium tungstate monohydrate, LiKWO~4~·H~2~O","Acta Crystallographica Section E","2002","58","3","i26","i28","10.1107/S1600536802002817","","","0.71073","MoKα","","","0.0197","","","","0.0201","","","","","","1.0055","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200820","7.977","0.002","34.551","0.008","13.691","0.003","90","0.03","101.98","0.02","90","0.02","3691.2","1.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","[NP(NCS)2]3","2, 2, 4, 4, 6, 6-hexaisothiocyanatocyclotriphosphazene","","- C6 N9 P3 S6 -","- C6 N9 P3 S6 -","- C48 N72 P24 S48 -","8","2","BT6083","Kessenich, Elmar; Schulz, Axel; Polborn, Kurt","A new polymorph of 2,2,4,4,6,6-hexaisothiocyanatocyclotriphosphazene","Acta Crystallographica Section E","2002","58","2","i15","i16","10.1107/S1600536801021158","","","0.71073","MoKα","","0.0807","0.0547","","0.1466","","0.131","","","1.059","","","1.127","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200821","7.461","0.001","11.663","0.002","24.621","0.005","94.31","0.03","90.88","0.03","94.01","0.03","2130.7","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4^'^-{[benzoyl(4-nitrophenylhydrazono)methyl]sulfonyl}acetanilide","","- C22 H18 N4 O6 S -","- C22 H18 N4 O6 S -","- C88 H72 N16 O24 S4 -","4","2","BT6090","Wojciech M. Wolf","4'-{[Benzoyl(4-nitrophenylhydrazono)methyl]sulfonyl}acetanilide","Acta Crystallographica Section E","2002","58","1","o1","o4","10.1107/S1600536801020347","","","1.54178","CuKα","","0.1331","0.0561","","","0.1328","0.18","","","","","","1.065","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200822","13.1203","0.001","13.0461","0.0007","20.7233","0.0016","90","","99.718","0.009","90","","3496.3","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Hexa-μ~2~-chloro-tetrakis(2-ethylpyrazine-N)-μ~4~-oxo-tetracopper(II)","","- C24 H32 Cl6 Cu4 N8 O -","- C24 H32 Cl6 Cu4 N8 O -","- C96 H128 Cl24 Cu16 N32 O4 -","4","1","BT6092","Näther, Christian; Jeß, Inke","Hexa-μ~2~-chloro-tetrakis(2-ethylpyrazine-<i>N</i>)-μ~4~-oxo-tetracopper(II)","Acta Crystallographica Section E","2002","58","1","m4","m6","10.1107/S1600536801020438","","","0.71073","MoKα","","0.0452","0.0356","","","0.0937","0.0997","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200823","12.805","0.002","12.805","0.003","54.013","0.011","90","","90","","90","","8856","3","293","2","293","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","ccs","[cis,cis]-Ceratospongamide cyclo(-Ile-Oxz-Phe-Pro-Thz-Phe-Pro-) Oxz=oxazoline, Thz=thiazole","","- C41 H49 N7 O6 S -","- C41 H49 N7 O6 S -","- C328 H392 N56 O48 S8 -","8","1","BT6093","Mitsunobu Doi; Aiko Yumiba; Akiko Asano","The <i>cis,cis</i>-proline isomer of ceratospongamide","Acta Crystallographica Section E","2002","58","1","o62","o64","10.1107/S1600536801021079","","","1.5418","CuKα","","0.2172","0.0981","","","0.1264","0.1554","","","","","","1.688","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200824","20.2837","0.0008","42.098","0.002","6.1644","0.0002","90","","90","","90","","5263.8","0.4","293","1","293","1","","","","","","","","2","F d d 2","F 2 -2d","43","","","","- C18 H16 -","- C18 H16 -","- C288 H256 -","16","1","BT6094","Jovanovic, Jovan; Schürmann, Markus; Preut, Hans; Spiteller, Michael","2-(2',3'-Dihydro-1'<i>H</i>-inden1'-yl)-1<i>H</i>-indene","Acta Crystallographica Section E","2002","58","1","o33","o34","10.1107/S1600536801021080","","","0.71073","MoKα","","0.1275","0.0358","","","0.0658","0.0764","","","","","","0.815","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200825","14.7176","0.0002","14.768","0.0002","23.586","0.0003","90","","90","","90","","5126.41","0.12","291","1","291","1","","","","","","","","2","P b c a","-P 2ac 2ab","61","","","","- C18 H16 -","- C18 H16 -","- C288 H256 -","16","2","BT6095","Jovanovic, Jovan; Elling, Wilhelm; Schürmann, Markus; Preut, Hans; Spiteller, Michael","(<i>Z</i>)-2,3,2',3'-Tetrahydro-[1,1']biindenylidene","Acta Crystallographica Section E","2002","58","1","o35","o36","10.1107/S1600536801021092","","","0.71073","MoKα","","0.0909","0.0416","","","0.0996","0.1106","","","","","","0.913","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200826","9.001","0.001","20.421","0.003","9.935","0.001","90","","109.545","0.006","90","","1720.9","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","8-Chloro-6-(3-dimethylaminopropylamino)-11H-pyrido[2,3-b][1,4]benzodiazepine","","- C17 H20 Cl N5 -","- C17 H20 Cl N5 -","- C68 H80 Cl4 N20 -","4","1","BT6097","Dupont, Léon; Eyrolles, Laurence; Evrard, Guy; Delarge, Jacques; Liégeois, Jean-François","8-Chloro-6-(3-dimethylaminopropylamino)-11<i>H</i>-pyrido[2,3-<i>b</i>][1,4]benzodiazepine","Acta Crystallographica Section E","2002","58","1","o69","o71","10.1107/S1600536801021286","","","0.71069","MoKα","","0.0511","0.0436","","","0.1137","0.1216","","","","","","1.11","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200827","6.91","0.002","8.085","0.002","9.234","0.002","107.85","0.01","111.93","0.01","99.42","0.01","432.3","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Di-aqua-bis(thiocyanato-N)(bis(2-methylpyrazine-N)cobalt(II)","","- C12 H16 Co N6 O2 S2 -","- C12 H16 Co N6 O2 S2 -","- C12 H16 Co N6 O2 S2 -","1","0.5","BT6098","Näther, Christian; Greve, Jan; Beck, Andreas","Diaquabis(2-methylpyrazine-<i>N</i>)bis(thiocyanato-<i>N</i>)cobalt(II)","Acta Crystallographica Section E","2002","58","1","m30","m32","10.1107/S1600536801021444","","","0.71073","MoKα","","0.052","0.0295","","","0.073","0.0788","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200828","8.0925","0.0008","11.8347","0.0007","11.3012","0.0011","90","","93.063","0.012","90","","1080.8","0.16","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Dichlorotetrakis(4-methylimidazole)copper(II)]","","","- C16 H24 Cl2 Cu N8 -","- C16 H24 Cl2 Cu N8 -","- C32 H48 Cl4 Cu2 N16 -","2","0.5","BT6099","Näther, Christian; Wriedt, Mario; Jeß, Inke","Dichlorotetrakis(4-methylimidazole)copper(II)","Acta Crystallographica Section E","2002","58","2","m39","m40","10.1107/S1600536802000314","","","0.71073","MoKα","","0.0484","0.0341","","","0.0943","0.1011","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200829","11.571","0.003","7.18","0.003","15.53","0.005","90","","95.94","0.04","90","","1283.3","0.8","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3-amino-5,6-dicyano-1-phenylimino-1H-isoindole","","- C16 H9 N5 -","- C16 H9 N5 -","- C64 H36 N20 -","4","1","BT6100","Dahl, Tor","3-Amino-5,6-dicyano-1-phenylimino-1<i>H</i>-isoindole","Acta Crystallographica Section E","2002","58","2","o139","o141","10.1107/S1600536802000442","","","0.7107","MoKα","","0.1275","0.0528","","","0.1165","0.1382","","","","","","0.928","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200830","8.576","0.003","8.804","0.004","15.921","0.006","90","","94.69","0.03","90","","1198.1","0.8","293","2","293","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2-methoxyphenyl)phenylphosphine oxide","","- C13 H13 O2 P -","- C13 H13 O2 P -","- C52 H52 O8 P4 -","4","1","BT6101","Wieczorek, Wanda; Kruszynski, Rafal; Skoweranda, J. Jolanta; Pietrusiewicz, K. Michał","(2-Methoxyphenyl)phenylphosphine oxide","Acta Crystallographica Section E","2002","58","3","o229","o231","10.1107/S1600536802002143","","","1.54178","CuKα","","0.0441","0.0389","","","0.1175","0.1219","","","","","","1.094","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200831","8.097","0.0006","12.355","0.001","14.701","0.001","84.116","0.002","82.041","0.003","75.302","0.003","1405.35","0.18","168","2","168","2","","","","","","","","5","P -1","-P 1","2","","Diaquadichlorodiphenyltin(IV)^.^18-crown-6","","- C24 H38 Cl2 O8 Sn -","- C24 H38 Cl2 O8 Sn -","- C48 H76 Cl4 O16 Sn2 -","2","1","BT6102","Amini, Mostafa M.; Azadmeher, Amirreza; Yousefi, Mohammad; Foladi, Shahrbano; Ng, Seik Weng","Diaquadichlorodiphenyltin(IV) 18-crown-6","Acta Crystallographica Section E","2002","58","2","m58","m60","10.1107/S1600536802001125","","","0.71073","MoKα","","0.0437","0.0276","","","0.0654","0.0689","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200832","6.581","0.0004","15.377","0.001","8.3671","0.0005","90","","93.49","0.01","90","","845.15","0.09","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Tosyl cyanide","p-toluenesulfonyl cyanide","","- C8 H7 N O2 S -","- C8 H7 N O2 S -","- C32 H28 N4 O8 S4 -","4","1","BT6103","Jay, David A.; Whiting, Andrew; Yufit, Dmitrii. S.; Howard, Judith A. K.; Hermitage, Stephen","<i>p</i>-Tolylsulfonyl cyanide","Acta Crystallographica Section E","2002","58","2","o191","o193","10.1107/S1600536802001113","","","0.71073","MoKα","","0.0692","0.045","","","0.1184","0.1304","","","","","","0.97","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200833","11.831","0.006","11.831","0.006","11.76","0.008","90","","90","","90","","1646.1","1.6","298","2","298","2","","","","","","","","7","I -4 2 m","I -4 2","121","","Tetrakis(trimethylammonioacetato-O)copper(II) bis(hexafluorophosphate)","","- C20 H44 Cu F12 N4 O8 P2 -","- C20 H44 Cu F12 N4 O8 P2 -","- C40 H88 Cu2 F24 N8 O16 P4 -","2","0.125","BT6104","Yang, Yang-Yi; Chen, Xiao-Ming; Ng, Seik Weng","Tetrakis(trimethylammonioacetato-<i>O</i>)copper(II) bis(hexafluorophosphate)","Acta Crystallographica Section E","2002","58","2","m61","m62","10.1107/S1600536802001459","","","0.71073","MoKα","","0.0297","0.027","","","0.0689","0.0706","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200834","8.2657","0.0009","12.053","0.001","11.338","0.001","90","","94.06","0.01","90","","1126.73","0.18","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Dibromo-tetrakis(4-methylimidazole)copper(II)]","","","- C16 H24 Br2 Cu N8 -","- C16 H24 Br2 Cu N8 -","- C32 H48 Br4 Cu2 N16 -","2","0.5","BT6105","Näther, Christian; Wriedt, Mario; Jeß, Inke","Dibromotetrakis(4-methylimidazole)copper(II)","Acta Crystallographica Section E","2002","58","2","m63","m64","10.1107/S1600536802001629","","","0.71073","MoKα","","0.0839","0.0382","","","0.0916","0.1039","","","","","","1.004","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200835","13.1739","0.0012","9.6928","0.0009","21.137","0.002","90","","104.51","0.002","90","","2612.9","0.4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","L4chlorideCuCl2","","","- C10 H7 Cl3 Cu N2 S -","- C10 H7 Cl3 Cu N2 S -","- C80 H56 Cl24 Cu8 N16 S8 -","8","1","BT6107","Blake, Alexander J.; George, Michael W.; Hubberstey, Peter; Lopez Garcia, Roberto; Wilson, Claire","Dichloro[2-chloro-6-(mercaptopyridin-2-yl)pyridine]copper(II)","Acta Crystallographica Section E","2002","58","3","m96","m98","10.1107/S1600536802002118","","","0.71073","MoKα","","0.0331","0.0287","","","0.0692","0.0714","","","","","","1.037","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2200836","11.935","0.003","4.9785","0.001","22.151","0.009","90","","99.43","0.04","90","","1298.4","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-Bromophenyl 2,6-dibromophenyl ether","","- C12 H7 Br3 O -","- C12 H7 Br3 O -","- C48 H28 Br12 O4 -","4","1","BT6108","Eriksson, Johan; Eriksson, Lars; Hu, Jiwei","4-Bromophenyl 2,6-dibromophenyl ether","Acta Crystallographica Section E","2002","58","3","o263","o265","10.1107/S1600536802002301","","","0.71073","MoKα","","0.105","0.0392","","","0.0542","0.0598","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200837","10.057","0.004","12.888","0.005","15.236","0.007","100.64","0.03","94.41","0.03","106.84","0.03","1839.7","1.4","143","2","143","2","","","","","","","","7","P -1","-P 1","2","","Tris(pentafluorophenyl)-(2-diphenylphosphinethiophenyl)- gold(III) Dichloromethane Solvate","","- C37 H17 Au Cl2 F15 P S -","- C37 H17 Au Cl2 F15 P S -","- C74 H34 Au2 Cl4 F30 P2 S2 -","2","1","BT6109","Jones, Peter G.; Terroba, Raquel; Fernández, Eduardo; Laguna, Mariano","Tris(pentafluorophenyl)[2-(diphenylphosphino)thiophenol-κ<i>P</i>]gold(III) dichloromethane solvate","Acta Crystallographica Section E","2002","58","3","m90","m92","10.1107/S1600536802002404","","","0.71073","MoKα","","0.0371","0.0316","","","0.0692","0.0722","","","","","","1.049","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200838","12.4268","0.0012","18.8782","0.0016","19.5576","0.0016","82.98","0.01","77.686","0.01","82.656","0.01","4424.4","0.7","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C160 H170 Fe10 O40 -","- C160 H170 Fe10 O40 -","- C160 H170 Fe10 O40 -","1","0.5","BT6110","Kooijman, Huub; Spek, Anthony L.; Bouwman, Elisabeth; Miccichè, Fabrizio; Warzeska, Sabine T.; Reedijk, Jan","<i>cyclo</i>-Decakis(μ-2,2-diphenylacetato-<i>O,O</i>')dodecakis(μ-methoxo)decairon(III)) mixed solvate","Acta Crystallographica Section E","2002","58","3","m93","m95","10.1107/S1600536802002465","","","0.71073","MoKα","","0.1546","0.078","","","0.1559","0.1731","","","","","","1.112","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200839","4.644","0.002","16.278","0.006","6.037","0.002","90","","96.12","0.03","90","","453.8","0.3","178","2","178","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- C10 H14 -","- C10 H14 -","- C20 H28 -","2","0.5","BT6111","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Stamm, Reiner","2,7-Dimethylocta-2,3,5,6-tetraene","Acta Crystallographica Section E","2002","58","3","o277","o278","10.1107/S1600536802002696","","","0.71073","MoKα","","0.0534","0.0413","","","0.1085","0.1206","","","","","","1.062","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200840","9.891","0.002","10.613","0.002","13.063","0.003","94.854","0.013","100.87","0.02","116.933","0.013","1177.7","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Dibromo-tetrakis(4-methylimidazole)copper(II) dihydrate","","","- C16 H28 Br2 Cu N8 O2 -","- C16 H27.6 Br2 Cu N8 O2 -","- C32 H55.2 Br4 Cu2 N16 O4 -","2","1","BT6112","Näther, Christian; Wriedt, Mario; Jeß, Inke","Dibromotetrakis(4-methylimidazole)copper(II) dihydrate","Acta Crystallographica Section E","2002","58","3","m107","m109","10.1107/S1600536802002799","","","0.71073","MoKα","","0.0926","0.0425","","","0.098","0.1111","","","","","","1.014","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200841","15.827","0.006","9.442","0.002","11.423","0.004","90","","119.34","0.02","90","","1488.1","0.9","178","2","178","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C20 H20 O2 -","- C20 H20 O2 -","- C80 H80 O8 -","4","0.5","BT6113","Jones, Peter G.; Hopf, Henning; Hillmer, Jörg","4,13-Diacetyl-[2.2]paracyclophane","Acta Crystallographica Section E","2002","58","3","o300","o302","10.1107/S1600536802002933","","","0.71073","MoKα","","0.0553","0.0448","","","0.1213","0.1336","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200842","11.727","0.005","11.25","0.005","12.104","0.005","90","0.005","112.957","0.005","90","0.005","1470.4","1.1","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","5,7,7,8,10-Pentabromo-7,8-dihydro-benzocyclooctene","","- C12 H7 Br5 -","- C12 H7 Br5 -","- C48 H28 Br20 -","4","1","BT6114","İsmail Çelik; Ahmet Tutar; Mehmet Akkurt; Yusuf Özcan; Osman Çakmak","5,7,7,8,10-Pentabromo-7,8-dihydrobenzocyclooctene","Acta Crystallographica Section E","2002","58","3","o314","o316","10.1107/S1600536802003112","","","0.71073","MoKα","","0.1515","0.0431","","","0.0836","0.107","","","","","","0.972","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200843","9.26","0.002","12.145","0.002","8.261","0.001","98.02","0.01","101.89","0.01","103.68","0.01","865.8","0.3","296.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H14 Mo2 N2 O11 -","- C12 H14 Mo2 N2 O11 -","- C24 H28 Mo4 N4 O22 -","2","1","CF6131","Okabe, Nobuo; Noriko Isomoto; Mamiko Odoko","A dinuclear oxomolybdenum(V) compound with picolinate ligands","Acta Crystallographica Section E","2002","58","1","m1","m3","10.1107/S160053680102058X","","","0.7107","MoKα","","","0.0249","","","","0.1081","","","","","","0.921","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2200844","9.7236","0.0009","6.2851","0.0008","10.517","0.002","90","","95.691","0.005","90","","639.57","0.16","150","2","150","2","","","","","","","","3","I 1 2/a 1","-I 2ya","15","3,5-lutidine","3,5-dimethylpyridine","","- C7 H9 N -","- C7 H9 N -","- C28 H36 N4 -","4","0.5","CF6133","Bond, Andrew D.; Davies, John E.","3,5-Lutidine","Acta Crystallographica Section E","2002","58","1","o5","o7","10.1107/S1600536801020426","","","0.7107","MoKα","","0.0963","0.0688","","","0.1914","0.2139","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200845","9.608","0.002","12.423","0.003","14.549","0.004","90","","107.47","0.01","90","","1656.5","0.7","168","2","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C27 H50 Cd Cl N4 O11.5 -","- C27 H50 Cd Cl N4 O11.5 -","- C54 H100 Cd2 Cl2 N8 O23 -","2","1","CF6134","Smith, Christopher. B.; Lincoln, Stephen. F.; Taylor, Max. R.; Wainwright, Kevin. P.","{Δ-1,4,7,10-Tetrakis[(<i>S</i>)-2-hydroxypropyl-κ<i>O</i>]-1,4,7,10-tetraazacyclododecane-κ^4^<i>N</i>}cadmium(II) salicylate perchlorate hemihydrate","Acta Crystallographica Section E","2002","58","1","m33","m35","10.1107/S1600536801021316","","","0.71073","MoKα","","","0.037","","","","0.061","","","","","","1.418","","","","has coordinates,has Fobs","194538","2020-10-21","18:00:00",""
"2200846","7.0256","0.0001","12.5288","0.0002","14.8003","0.0004","90","","94.3527","0.0009","90","","1299","0.04","291","1","291","1","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 -","- C18 H16 -","- C72 H64 -","4","1","CF6135","Jovanovic, Jovan; Elling, Wilhelm; Schürmann, Markus; Preut, Hans; Spiteller, Michael","Spiro[1,1a,6,6a-Tetrahydrocyclopropa[<i>a</i>]indene-1,1'-2',3'-dihydro-1'<i>H</i>-indene]","Acta Crystallographica Section E","2002","58","1","o67","o68","10.1107/S160053680102116X","","","0.71073","MoKα","","0.0749","0.0456","","","0.1317","0.1403","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200847","8.5321","0.0003","12.0941","0.0004","16.6243","0.0006","70.7225","0.0014","85.0894","0.0014","71.5179","0.0014","1535.38","0.09","291","1","291","1","","","","","","","","5","P 1","P 1","1","","","","- C29 H35 Cl O9 S2 -","- C29 H35 Cl O9 S2 -","- C58 H70 Cl2 O18 S4 -","2","2","CF6136","Linker, Manuela; Schürmann, Markus; Preut, Hans; Kreiser, Wolfgang","3-(7,7-Dimethyl-2-oxobicyclo[2.2.1.]hept-1-ylmethanesulfonyloxy)-2-methyl-2-(toluene-4-sulfonyloxymethyl)propyl 4-chlorobenzoate","Acta Crystallographica Section E","2002","58","1","o72","o73","10.1107/S1600536801021420","","","0.71073","MoKα","","0.1026","0.0379","","","0.0682","0.0782","","","","","","0.841","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200848","7.8522","0.0016","9.4124","0.0009","10.9151","0.0017","106.85","0.011","94.395","0.015","99.697","0.013","754.3","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","di(chloro)(hexahapto-para-cymene)(dimethylsulphoxide)ruthenium (II)","","- C12 H20 Cl2 O Ru S -","- C12 H20 Cl2 O Ru S -","- C24 H40 Cl4 O2 Ru2 S2 -","2","1","CF6137","Chandra, Manish; Pandey, D.Shankar; Puerta, M. Carmen; Valerga, Pedro","A <i>p</i>-cymene-ruthenium(II)‒DMSO complex, [(η^6^-<i>C</i>~10~H~14~)RuCl~2~(DMSO)]","Acta Crystallographica Section E","2002","58","1","m28","m29","10.1107/S1600536801021237","","","0.71073","MoKα","","0.0381","0.0329","","","0.0886","0.0901","","","","","","1.072","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200849","11.823","0.002","8.191","0.002","13.894","0.003","90","","106.05","0.01","90","","1293.1","0.5","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H13 Br O3 -","- C15 H13 Br O3 -","- C60 H52 Br4 O12 -","4","1","CF6138","De Simone, C. A.; Malta, V. R. S.; Pereira, M.A.; Bispo, J.R.S.; Pinto, A.V.; Pinto, M.C.F.R","3-Bromo-β-lapachone","Acta Crystallographica Section E","2002","58","3","o296","o297","10.1107/S1600536802001265","","","0.7107","MoKα","","0.0452","0.0385","","","0.102","0.1141","","","","","","1.089","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200850","6.1632","0.0002","9.1891","0.0003","15.9231","0.0005","98.913","0.001","90.664","0.001","97.328","0.001","883.17","0.05","183","2","183","2","","","","","","","","3","P -1","-P 1","2","","threo-2-(2,6-dimethoxyphenoxy)-1-(3,4-dimethoxyphenyl)-1,3-propanediol","","- C19 H24 O7 -","- C19 H24 O7 -","- C38 H48 O14 -","2","1","CF6139","Langer, Vratislav; Lundquist, Knut; Stomberg, Rolf; von Unge, Sverker","<i>threo</i>-2-(2,6-Dimethoxyphenoxy)-1-(3,4-dimethoxyphenyl)-1,3-propanediol","Acta Crystallographica Section E","2002","58","2","o90","o92","10.1107/S1600536801021869","","","0.71073","MoKα","","0.093","0.0506","","","0.1033","0.1226","","","","","","1.012","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200851","9.305","0.009","10.101","0.002","17.454","0.002","90","","90","","90","","1640.5","1.6","298","2","298","2","","","","","","","","5","P n a m","-P 2c 2n","62","","N,N-Dimethyl-N',N''-bis(4-methylphenyl)phosphoramidate","","- C16 H22 N3 O P -","- C16 H22 N3 O P -","- C64 H88 N12 O4 P4 -","4","0.5","CF6140","Gholivand, Khodayar; Tadjarodi, Azadeh; Ng, Seik Weng","<i>N,N</i>-Dimethyl-<i>N</i>',<i>N</i>''-bis(4-methylphenyl)phosphoramidate","Acta Crystallographica Section E","2002","58","2","o200","o201","10.1107/S1600536802001587","","","0.71073","MoKα","","0.1043","0.0509","","","0.1297","0.1562","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200852","9.8136","0.0016","12.485","0.002","11.9359","0.0019","90","","103.61","0.014","90","","1421.4","0.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H17 N O3 S2 -","- C13 H17 N O3 S2 -","- C52 H68 N4 O12 S8 -","4","1","CF6141","Hansen, Lars Kr.; Bayer, Annette; Gautun, Odd R.","(1<i>R</i>*,3<i>R</i>*,6<i>S</i>*)-3,6-Dihydro-3,6-dimethyl-2-(toluene-4-sulfonyl)-1λ^4^,2-thiazine 1-oxide","Acta Crystallographica Section E","2002","58","2","o198","o199","10.1107/S1600536802001320","","","0.71069","MoKα","","0.0431","0.0384","","","0.1127","0.1171","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200853","4.1741","0.0004","4.7239","0.0006","13.5066","0.0015","85.974","0.001","81.463","0.007","74.652","0.006","253.85","0.05","150","2","150","2","","","","","","","","2","P -1","-P 1","2","n-decane","n-decane","","- C10 H22 -","- C10 H22 -","- C10 H22 -","1","0.5","CF6142","Bond, Andrew D.; Davies, John E.","<i>n</i>-Decane","Acta Crystallographica Section E","2002","58","2","o196","o197","10.1107/S1600536802001332","","","0.71073","MoKα","","0.0682","0.0541","","","0.1676","0.1807","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200854","12.4152","0.0011","5.3266","0.0002","13.8046","0.0012","90","","114.533","0.003","90","","830.49","0.11","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","pyromellitic diimide / dimethylsulfoxide (1/2)","","","- C14 H16 N2 O6 S2 -","- C14 H16 N2 O6 S2 -","- C28 H32 N4 O12 S4 -","2","0.5","CF6143","Bond, Andrew D.","A 1:2 complex of pyromellitic diimide and dimethyl sulfoxide","Acta Crystallographica Section E","2002","58","2","o194","o195","10.1107/S1600536802001162","","","0.7107","MoKα","","0.0752","0.0454","","","0.0981","0.1075","","","","","","1.119","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200855","18.344","0.003","19.129","0.006","22.252","0.005","90","","100.5","0.03","90","","7678","3","150","2","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C43 H39 B O3 Sn2 -","- C43 H31 B O3 Sn2 -","- C344 H248 B8 O24 Sn16 -","8","1","CF6144","Coles, Simon J.; Hibbs, David E.; Hursthouse, Michael B.; Beckett, Michael A.; Owen, Paul; Varma, K. Sukumar","Bis(triphenylstannyl)borate toluene solvate","Acta Crystallographica Section E","2002","58","2","m65","m67","10.1107/S1600536802001642","","","0.71069","MoKα","","","0.0326","","","0.0717","0.078","","","","","","0.877","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200856","16.4925","0.0004","7.2697","0.0002","19.2129","0.0006","90","","109.412","0.0018","90","","2172.59","0.11","150","2","150","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","(μ-1,7,11,17-tetraoxa-2,6,12,16-tetraazacycloeicosane- κ^4^N^1^,N^17^:N^7^,N^11^)bis[dichlorozinc(II)]","","- C12 H28 Cl4 N4 O4 Zn2 -","- C12 H28 Cl4 N4 O4 Zn2 -","- C48 H112 Cl16 N16 O16 Zn8 -","4","0.5","CF6145","Kuksa, Vladimir A.; Wardell, Solange M. S. V; Lin, Paul Kong Thoo; Howie, R. Alan","Rerefinement of (μ-1,7,11,17-tetraoxa-2,6,12,16-tetraazacycloeicosane-κ^4^<i>N</i>^1^,<i>N</i>^17^:<i>N</i>^7^,<i>N</i>^11^)bis[dichlorozinc(II)]","Acta Crystallographica Section E","2002","58","2","m68","m69","10.1107/S1600536802001654","","","0.71073","MoKα","","0.0403","0.031","","","0.0785","0.0841","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200857","6.979","0.004","13.153","0.007","9.283","0.004","90","","104.73","0.04","90","","824.1","0.8","143","2","143","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Tetramethylguanidinium chloride","","- C5 H14 Cl N3 -","- C5 H14 Cl N3 -","- C20 H56 Cl4 N12 -","4","1","CF6146","Fischer, Axel K.; Jones, Peter G.","Tetramethylguanidinium chloride","Acta Crystallographica Section E","2002","58","3","o218","o219","10.1107/S1600536802001800","","","0.71073","MoKα","","0.028","0.0249","","","0.0624","0.0645","","","","","","1.084","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200858","7.4288","0.0003","13.1426","0.0005","10.2527","0.0003","90","","102.248","0.0018","90","","978.23","0.06","150","2","150","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","2,6,12,16-Tetraaza-1,7,11,17-tetraoxacycloicosane-diaquanickel(II) dichloride","","- C12 H32 Cl2 N4 Ni O6 -","- C12 H32 Cl2 N4 Ni O6 -","- C24 H64 Cl4 N8 Ni2 O12 -","2","0.5","CF6147","Kuksa, Vladimir A.; Wardell, Solange M. S. V; Lin, Paul Kong Thoo; Howie, R. Alan","Further refinement of diaqua(1,7,11,17-tetraoxa-2,6,12,16-tetraazacycloeicosane-<i>N,N</i>',<i>N</i>'',<i>N</i>''')nickel(II) dichloride","Acta Crystallographica Section E","2002","58","3","m74","m76","10.1107/S1600536802001915","","","0.71073","MoKα","","0.0282","0.0246","","","0.0613","0.0631","","","","","","1.052","","","","has coordinates,has disorder,has Fobs","211332","2020-10-21","18:00:00",""
"2200859","8.425","0.002","10.504","0.001","17.674","0.004","73.04","0.01","78.82","0.01","88.59","0.01","1466.8","0.5","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","Bis(μ-diethylphosphido)heptacarbonyl- α-ethoxybenzylidene-di-rhenium","","- C24 H30 O8 P2 Re2 -","- C24 H30 O8 P2 Re2 -","- C48 H60 O16 P4 Re4 -","2","1","CF6148","Flörke, Ulrich; Petters, Dina","Heptacarbonyl(α-ethoxybenzylidene)di-μ-diethylphosphidodirhenium","Acta Crystallographica Section E","2002","58","3","m88","m89","10.1107/S1600536802002258","","","0.71073","MoKα","","0.0556","0.0377","","","0.0868","0.0958","","","","","","0.983","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200860","15.096","0.008","13.585","0.008","8.58","0.004","90","","94.13","0.05","90","","1755","1.6","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","(2-aminopyrimidine)copper(II) acetate","catena-Poly[[tetrakis(μ-acetato-κO:κO')dicopper(II)]-μ-2-aminopyrimidine- κ^2^N:N']","","- C12 H17 Cu2 N3 O8 -","- C12 H17 Cu2 N3 O8 -","- C48 H68 Cu8 N12 O32 -","4","0.5","CF6150","Blake, Alexander J.; Hubberstey, Peter; Sampson, Claire L.","<i>catena</i>-Poly[[tetrakis(μ-acetato-κ<i>O</i>:κ<i>O</i>')dicopper(II)]-μ-2-aminopyrimidine-κ^2^<i>N</i>:<i>N</i>'] at 150K","Acta Crystallographica Section E","2002","58","3","m99","m101","10.1107/S1600536802002544","","","0.71073","MoKα","","0.0262","0.0237","","","0.061","0.0639","","","","","","1.152","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200861","9.218","0.002","11.891","0.002","14.624","0.002","96.4","0.01","99.89","0.02","102.06","0.02","1526.1","0.5","203","2","203","2","","","","","","","","7","P -1","-P 1","2","","Octacarbonyl-μ-N,N-diethyldithiocarbamato-μ-dicyclohexylphosphido- dirhenium","","- C25 H32 N O8 P Re2 S2 -","- C25 H32 N O8 P Re2 S2 -","- C50 H64 N2 O16 P2 Re4 S4 -","2","1","CF6151","Egold, Hans; Flörke, Ulrich; Klose, Stefanie","Octacarbonyl-μ-dicyclohexylphosphido-μ-<i>N,N</i>-diethyldithiocarbamato-dirhenium","Acta Crystallographica Section E","2002","58","3","m116","m117","10.1107/S1600536802003094","","","0.71073","MoKα","","0.0784","0.0512","","","0.1346","0.1491","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200862","20.9006","0.0008","20.6112","0.0009","12.9921","0.0003","90","","115.135","0.002","90","","5066.9","0.3","150","2","150","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","3,4-lutidine","3,4-dimethylpyridine","","- C7 H9 N -","- C7 H9 N -","- C224 H288 N32 -","32","4","CF6152","Bond, Andrew D.; Davies, John E.","3,4-Lutidine","Acta Crystallographica Section E","2002","58","3","o328","o330","10.1107/S1600536802003379","","","0.7107","MoKα","","0.0831","0.0534","","","0.1187","0.1348","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200863","7.0991","0.0004","7.7279","0.0005","12.39","0.0009","108.139","0.004","92.399","0.004","96.743","0.005","639.26","0.07","150","2","150","2","","","","","","","","3","P -1","-P 1","2","2,5-lutidine","2,5-dimethylpyridine","","- C7 H9 N -","- C7 H9 N -","- C28 H36 N4 -","4","2","CF6153","Bond, Andrew D.; Davies, John E.","2,5-Lutidine","Acta Crystallographica Section E","2002","58","3","o326","o327","10.1107/S1600536802003380","","","0.7107","MoKα","","0.1055","0.0543","","","0.124","0.1448","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200864","5.795","0.001","7.829","0.001","15.82","0.001","90","","93.23","0.01","90","","716.6","0.16","180","2","180","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","α-methylstyrene","isopropenylbenzene","","- C9 H10 -","- C9 H10 -","- C36 H40 -","4","1","CF6154","Bond, Andrew D.; Davies, John E.","α-Methylstyrene","Acta Crystallographica Section E","2002","58","3","o331","o333","10.1107/S1600536802003392","","","0.7107","MoKα","","0.1054","0.0846","","","0.2271","0.2499","","","","","","1.148","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200865","7.848","0.006","7.3951","0.0014","12.834","0.005","90","","90.95","0.04","90","","744.7","0.7","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","Bis(L-proline) H + perchlorate","Bis(L-proline) H + perchlorate","","- C10 H19 Cl N2 O8 -","- C10 H19 Cl N2 O8 -","- C20 H38 Cl2 N4 O16 -","2","1","CI6056","S. Pandiarajan; B. Sridhar; R. K. Rajaram","Bis(<small>L</small>-proline) hydrogen(1+) perchlorate","Acta Crystallographica Section E","2002","58","1","o74","o76","10.1107/S1600536801021304","","","0.71073","MoKα","","0.066","0.051","","","0.131","0.145","","","","","","1.12","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200866","14.4368","0.0019","16.426","0.002","8.3834","0.0012","90","","90","","90","","1988","0.5","294","2","294","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","1,6-bis(1-benzimidazolyl)hexane trihydrate","","- C20 H28 N4 O3 -","- C20 H28 N4 O3 -","- C80 H112 N16 O12 -","4","0.5","CI6066","Cai, Yuepeng; Zhou, Zhongyuan; Qiu, Liqin; Kang, Beisheng; Chan, Albert S. C.","1,6-Bis(1-benzimidazolyl)hexane trihydrate","Acta Crystallographica Section E","2002","58","2","o167","o169","10.1107/S1600536802000752","","","0.71073","MoKα","","0.174","0.05","","","0.117","0.155","","","","","","0.81","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200867","11.252","0.002","16.003","0.003","16.801","0.002","90","","90","","90","","3025.3","0.9","295","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Pentaacetoxy taxadiene","","","- C30 H42.58 O10.29 -","- C30 H42.58 O10.29 -","- C120 H170.32 O41.16 -","4","1","","Chattopadhyay, Sunil K.; Sharon, Ashoke; Yadav, Umesh; Srivastava, Sachin; Mehta, Vijay K.; Maulik, Prakas R.","A taxane diterpenoid from the heartwood of Taxus wallichiana","Acta Crystallographica Section E","2002","58","2","o154","o155","10.1107/S1600536802000910","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","194389","2020-10-21","18:00:00",""
"2200868","10.124","0.002","7.801","0.003","22.896","0.003","90","","100.39","0.01","90","","1778.6","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 4-oxo-2,6-diphenylpiperidine-3-carboxylate","","- C20 H21 N O3 -","- C20 H21 N O3 -","- C80 H84 N4 O12 -","4","1","CI6074","Vijayalakshmi, L.; Radhakrishnan, T. R","Ethyl 4-oxo-2,6-diphenylpiperidine-3-carboxylate","Acta Crystallographica Section E","2002","58","3","o220","o221","10.1107/S160053680200065X","","","0.71073","MoKα","","0.083","0.069","","","0.185","0.206","","","","","","1.1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200869","7.3711","0.0005","11.0756","0.0007","20.5014","0.0012","90","","90","","90","","1673.72","0.18","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(2S,3S)-2-benzyl-3-(nosylamino)butano-4-lactone","","- C17 H16 N2 O6 S -","- C17 H16 N2 O6 S -","- C68 H64 N8 O24 S4 -","4","1","CI6076","Guzei, Ilia A.; Langenhan, Joseph M.; Chung, Yong Jun","(2<i>S</i>,3<i>S</i>)-2-Benzyl-3-(nosylamino)butano-4-lactone","Acta Crystallographica Section E","2002","58","1","o65","o66","10.1107/S1600536801019791","","","0.71073","MoKα","","0.032","0.029","","","0.071","0.073","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200870","9.5695","0.001","11.2104","0.0016","17.537","0.003","108.52","0.03","104.14","0.02","90.25","0.02","1723","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","DL-valinium nitrate","DL-valinium nitrate","","- C5 H12 N2 O5 -","- C5 H12 N2 O5 -","- C40 H96 N16 O40 -","8","4","CI6077","Srinivasan, N.; Sridhar, B.; Rajaram, R. K.","<small>DL</small>-Valinium nitrate","Acta Crystallographica Section E","2002","58","2","o95","o97","10.1107/S1600536802000028","","","1.5418","CuKα","","0.071","0.055","","","0.147","0.18","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200871","9.672","0.002","10.219","0.001","9.651","0.002","91.19","0.01","107.18","0.01","72.44","0.02","866.4","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","trimethoprim perchlorate","","","- C14 H19 Cl N4 O7 -","- C14 H19 Cl N4 O7 -","- C28 H38 Cl2 N8 O14 -","2","1","CI6080","Thomas Muthiah, Packianathan; Umadevi, Balakrishnan; Stanley, Nithianantham; Bocelli, Gabriele; Cantoni, Andrea","Hydrogen-bonding patterns in trimethoprim perchlorate [trimethoprim = 2,4-diamino-5-(3,4,5-trimethoxybenzyl)pyrimidine]","Acta Crystallographica Section E","2002","58","1","o59","o61","10.1107/S1600536801020293","","","0.71069","MoKα","","0.073","0.048","","","0.159","0.168","","","","","","1.13","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200872","14.138","0.001","11.228","0.004","12.97","0.001","90","0.02","96.99","0.01","90","0.02","2043.6","0.8","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tris(dimethyldithiophosphato)osmium(III)","","- C6 H18 O6 Os P3 S6 -","- C6 H18 O6 Os P3 S6 -","- C24 H72 O24 Os4 P12 S24 -","4","0.5","CI6081","Ng, Seik Weng","The space group of tris(dimethyldithiophosphato)osmium(III)","Acta Crystallographica Section E","2002","58","1","m20","m21","10.1107/S160053680102092X","","","0.71073","MoKα","","0.02","0.017","","","0.042","0.043","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200873","14.1212","0.0006","11.1919","0.0008","12.9788","0.0007","90","","97.121","0.004","90","","2035.4","0.2","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tris(dimethyldithiophosphato)ruthenium(III)","","- C6 H18 O6 P3 Ru S6 -","- C6 H18 O6 P3 Ru S6 -","- C24 H72 O24 P12 Ru4 S24 -","4","0.5","CI6082","Ng, Seik Weng","The space group of tris(dimethyldithiophosphato)ruthenium(III)","Acta Crystallographica Section E","2002","58","1","m18","m19","10.1107/S1600536801020931","","","0.71073","MoKα","","0.025","0.023","","","0.063","0.065","","","","","","1.17","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200874","12.5758","0.0003","12.2526","0.0002","11.6563","0.0003","90","","101.14","0.001","90","","1762.23","0.07","95","2","95","2","","","","","","","","6","C 1 2 1","C 2y","5","","Aquabis(2,4'-bipyridine)di(o-sulfobenzimidato)copper(II)","","- C34 H26 Cu N6 O7 S2 -","- C34 H26 Cu N6 O7 S2 -","- C68 H52 Cu2 N12 O14 S4 -","2","0.5","CI6083","Naumov, Panče; Jovanovski, Gligor; Ng, Seik Weng","Aquabis(2,4'-bipyridine)di(<i>o</i>-sulfobenzimidato)copper(II) at 95K","Acta Crystallographica Section E","2002","58","1","m16","m17","10.1107/S1600536801020657","","","0.71073","MoKα","","0.078","0.048","","","0.094","0.104","","","","","","0.95","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200875","8.4663","0.001","22.384","0.002","12.216","0.003","90","","90","","90","","2315","0.7","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","1-(4-Hydroxyphenyl)-3-phenyl-2-propenal","","- C15 H12 O2 -","- C15 H12 O2 -","- C120 H96 O16 -","8","1","CI6085","Parthasarathi, V.; Praveen, V. N.; Thamotharan, S.; Vijayalakshmi, L.; Bhaskar, A.","1-(4-Hydroxyphenyl)-3-phenylprop-2-en-1-one","Acta Crystallographica Section E","2002","58","1","o86","o87","10.1107/S1600536801021328","","","1.5418","CuKα","","0.07","0.044","","","0.109","0.129","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200876","9.3254","0.0011","11.9482","0.0015","8.5578","0.0009","90","","90","","90","","953.53","0.19","293","2","293","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","Ammonium 2,7-dimethyl-5-bora-1,4,6,9-tetroxaspiro[4.4]nonane-3,8-dionate","","- C6 H12 B N O6 -","- C6 H12 B N O6 -","- C24 H48 B4 N4 O24 -","4","0.5","CI6086","Angeli Mary, P. A; Dhanuskodi, S; Thamotharan, S; Parthasarathi, V","Ammonium 2,7-dimethyl-5-bora-1,4,6,9-tetroxaspiro[4.4]nonane-3,8-dionate (ammonium borodilactate)","Acta Crystallographica Section E","2002","58","1","o45","o47","10.1107/S160053680102102X","","","1.5418","CuKα","","0.027","0.026","","","0.103","0.103","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200877","7.8675","0.0001","9.0796","0.0002","12.4097","0.0002","109.541","0.001","97.227","0.001","104.427","0.001","787.54","0.03","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-Acetyl-1,2-dihydro-2-oxo-3-hydroxy-3-(2-chloro-2,3- dihydrobenzofuran-3-yl)-(3H)indole","","- C18 H14 Cl N O4 -","- C18 H14 Cl N O4 -","- C36 H28 Cl2 N2 O8 -","2","1","CI6088","Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Yan Zhang; Jian-Hua Xu","1-Acetyl-3-(2-chloro-2,3-dihydrobenzofuran-3-yl)-1,2-dihydro-3-hydroxy-2-oxo-3<i>H</i>-indole","Acta Crystallographica Section E","2002","58","1","o37","o39","10.1107/S1600536801020943","","","0.71073","MoKα","","0.095","0.072","","","0.174","0.194","","","","","","0.92","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200878","12.908","0.002","10.763","0.001","15.784","0.002","90","","110.648","0.011","90","","2052","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-(3-(2-isopropyl-5-methylphenoxy)-2-hydroxypropyl-N-(tert-butyl)ammonium oxalate","","- C19 H31 N O6 -","- C19 H31 N O6 -","- C76 H124 N4 O24 -","4","1","CI6089","Vasuki, G.; Thamotharan, S.; Parthasarathi, V.; Ramamurthi, K.; Mohane Coumar, S.; Jindal, D. P.","<i>N</i>-(<i>tert</i>-Butyl)-<i>N</i>-[2-hydroxy-3-(2-isopropyl-5-methylphenoxy)propyl]ammonium hydrogen oxalate","Acta Crystallographica Section E","2002","58","2","o93","o94","10.1107/S1600536802000089","","","1.5418","CuKα","","0.059","0.05","","","0.149","0.157","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200879","6.031","0.001","10.2147","0.001","19.0691","0.001","74.759","0.01","89.109","0.01","76.871","0.01","1102.6","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","Diisopropyl 2-(2-benzoyl-1-phenylethyl)malonate","","- C24 H28 O5 -","- C24 H28 O5 -","- C48 H56 O10 -","2","1","CI6092","Jeyabharathi, A.; Ponnuswamy, M. N.; Narasimhan, S.; Velmathi, S.","Diisopropyl 2-(2-benzoyl-1-phenylethyl)malonate","Acta Crystallographica Section E","2002","58","3","o334","o335","10.1107/S1600536802000739","","","1.54178","CuKα","","0.106","0.047","","","0.117","0.142","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200880","22.2686","0.0003","9.2463","0.0002","9.1349","0.0002","90","","90","","90","","1880.9","0.06","183","2","183","2","","","","","","","","3","P n a 21","P 2c -2n","33","","1-(3,4,6-tricyanophenyl)-4-phenyl-1,2,3,4-tetrahydronaphthalene","","- C25 H17 N3 -","- C25 H17 N3 -","- C100 H68 N12 -","4","1","CI6094","Yan Zhang; Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Jian-Hua Xu","4-Phenyl-1-(2,4,5-tricyanophenyl)-1,2,3,4-tetrahydronaphthalene","Acta Crystallographica Section E","2002","58","2","o132","o133","10.1107/S1600536802000399","","","0.71073","MoKα","","0.059","0.047","","","0.1","0.104","","","","","","0.95","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200881","15.3572","0.0002","8.0212","0.0002","26.7363","0.0002","90","","91.648","0.001","90","","3292.1","0.1","183","2","183","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","3-[(diphenylmethylene)amino]phthalonitrile","","- C21 H13 N3 -","- C21 H13 N3 -","- C168 H104 N24 -","8","1","CI6095","J. Z. Tian; Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Yan Zhang; Jian-Hua Xu","3-[(Diphenylmethylene)amino]phthalonitrile","Acta Crystallographica Section E","2002","58","2","o151","o153","10.1107/S1600536802000831","","","0.71073","MoKα","","0.098","0.058","","","0.121","0.133","","","","","","0.86","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200882","9.2925","0.0004","10.8655","0.0003","16.7229","0.0005","90","","90.367","0.002","90","","1688.44","0.1","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3-Amino-4'-(N,N-diethylamino)-5-methylbiphenyl-2,4-dicarbonitrile","","- C19 H20 N4 -","- C19 H20 N4 -","- C76 H80 N16 -","4","1","CI6096","A. Subbiah Pandi; D. Velmurugan; S. Shanmuga Sundara Raj; Hoong-Kun Fun; V. Raghukumar","A monoclinic polymorph of 3-amino-4'-(<i>N,N</i>-diethylamino)-5-methylbiphenyl-2,4-dicarbonitrile","Acta Crystallographica Section E","2002","58","3","o222","o223","10.1107/S1600536802001745","","","0.71073","MoKα","","0.212","0.068","","","0.135","0.185","","","","","","0.92","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200883","5.7407","0.0006","13.0939","0.0014","22.846","0.002","90","","90","","90","","1717.3","0.3","294","2","294","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(1R,2S)-3-Methyl-2-(p-methylphenylsulfonylamino)-1-phenylbutan-1-ol","","- C18 H23 N O3 S -","- C18 H23 N O3 S -","- C72 H92 N4 O12 S4 -","4","1","CI6097","Li, Xingshu; Jia, Xian; Zhou, Zhongyuan","(1<i>R</i>,2<i>S</i>)-3-Methyl-2-(<i>p</i>-methylphenylsulfonylamino)-1-phenylbutan-1-ol","Acta Crystallographica Section E","2002","58","3","o232","o234","10.1107/S1600536802002222","","","0.71073","MoKα","","0.094","0.045","","","0.078","0.089","","","","","","0.89","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200884","7.238","0.0014","8.415","0.0017","10.303","0.002","106.5","0.03","97.5","0.03","95.8","0.03","590.2","0.2","123","2","123","2","","","","","","","","5","P -1","-P 1","2","DL-valinium trichloroacetate","DL-valinium trichloroacetate","","- C7 H12 Cl3 N O4 -","- C7 H12 Cl3 N O4 -","- C14 H24 Cl6 N2 O8 -","2","1","CI6100","Rajagopal, K.; Krishnakumar, R. V.; Subha Nandhini, M.; Mostad, A.; Natarajan, S.","<small>DL</small>-Valinium trichloroacetate at 123K","Acta Crystallographica Section E","2002","58","3","o279","o281","10.1107/S1600536802002751","","","0.71073","MoKα","","0.037","0.033","","","0.08","0.083","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200885","9.3175","0.0009","12.0263","0.0011","12.1632","0.0012","106.156","0.001","101.177","0.001","107.211","0.001","1192.5","0.2","168","2","168","2","","","","","","","","5","P -1","-P 1","2","","Bis(aquadiphenylmethyltrifluoroacetatotin)‒18-crown-6 (1/1)","","- C42 H54 F6 O12 Sn2 -","- C42 H54 F6 O12 Sn2 -","- C42 H54 F6 O12 Sn2 -","1","0.5","CI6102","Amini, Mostafa M.; Yousefi, Mohammad; Ng, Seik Weng","Bis(aquamethyldiphenyltrifluoroacetatotin)‒18-crown-6 (1/1)","Acta Crystallographica Section E","2002","58","3","m118","m120","10.1107/S1600536802003124","","","0.71073","MoKα","","0.086","0.06","","","0.14","0.155","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200886","9.996","0.005","13.622","0.004","8.616","0.003","90","","90.3","0.01","90","","1173.2","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Dichlorobis(DL-alanine)zinc(II)","Dichlorobis(DL-alanine)zinc(II)","","- C6 H14 Cl2 N2 O4 Zn -","- C6 H14 Cl2 N2 O4 Zn -","- C24 H56 Cl8 N8 O16 Zn4 -","4","1","CI6103","M.Subha Nandhini; R.V. Krishnakumar; S.Natarajan","Dichlorobis(<small>DL</small>-alanine)zinc(II)","Acta Crystallographica Section E","2002","58","3","m127","m129","10.1107/S1600536802003148","","","1.5418","CuKα","","0.04","0.04","","","0.114","0.114","","","","","","1.15","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200887","8.9014","0.0007","13.7809","0.0011","18.891","0.0015","90","","90","","90","","2317.3","0.3","295","2","295","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","bis(pyrazine-2-caboxamide)bis(trifluoromethanesulphonato)copper(II) monohydrate","","- C12 H12 Cu F6 N6 O9 S2 -","- C12 H12 Cu F6 N6 O9 S2 -","- C48 H48 Cu4 F24 N24 O36 S8 -","4","0.5","CM6000","Kristiansson, Olof","Bis(pyrazine-2-carboxamide)bis(trifluoromethanesulfonato)copper(II) monohydrate","Acta Crystallographica Section E","2002","58","3","m130","m132","10.1107/S1600536802003252","","","0.71073","MoKα","","0.0517","0.0367","","","0.1003","0.105","","","","","","0.887","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200888","31.838","0.002","5.208","0.001","11.117","0.003","90","0.05","108.06","0.04","90","0.05","1752.5","0.7","298","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","m-carboxy phenyl ammonium nitrate","","- C7 H8 N2 O5 -","- C7 H8 N2 O5 -","- C56 H64 N16 O40 -","8","1","CV6075","Benali-Cherif, Noureddine; Cherouana, Aouatef; Bendjeddou, Lamia; Merazig, Hocine; Bendheif, Leulmi; Bouchouit, Karim","<i>m</i>-Carboxyphenylammonium nitrate","Acta Crystallographica Section E","2002","58","2","o156","o157","10.1107/S1600536802000557","","","0.71073","MoKα","","0.073","0.04","","","0.057","0.057","","","","","","1.134","","","","has coordinates,has Fobs","192027","2020-10-21","18:00:00",""
"2200889","8.517","0.002","8.902","0.004","14.513","0.004","106.49","0.04","90.17","0.05","92.76","0.04","1053.7","0.6","294","","","","","","","","","","","5","P -1","-P 1","2","","p-Carboxyphenyl ammonium dihydrogenmonophosphate hydrate","","- C7 H12 N O7 P -","- C7 H12 N O7 P -","- C28 H48 N4 O28 P4 -","4","2","CV6076","Benali-Cherif, Nourredine; Abouimrane, Ali; Sbai, Kacem; Merazig, Hocine; Cherouana, Aouatef; Bendjeddou, Lamia","<i>p</i>-Carboxyphenylammonium dihydrogenmonophosphate monohydrate","Acta Crystallographica Section E","2002","58","2","o160","o161","10.1107/S1600536802001022","","","0.71073","MoKα","","0.039","0.039","","","0.058","0.058","","","","","","1.142","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200890","7.4939","0.0006","9.6449","0.0008","12.1632","0.0009","84.559","0.002","84.522","0.002","68.944","0.002","814.95","0.11","293","2","294","2","","","","","","","","3","P -1","-P 1","2","","4,6-Dimethylquinoline-2-[N-(2,4-dimethylphenyl)formimidoyl]","","- C20 H20 N2 -","- C20 H20 N2 -","- C40 H40 N4 -","2","1","CV6081","Aygün, Muhittin; Öztürk, Sema; Aydog̃an, Feray","4,6-Dimethyl-2-(2,4-dimethylphenyliminomethyl)quinoline","Acta Crystallographica Section E","2002","58","2","o158","o159","10.1107/S1600536802000788","","","0.71073","MoKα","","0.1121","0.0631","","","0.1536","0.1903","","","","","","1.032","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200891","13.473","0.002","6.134","0.001","13.785","0.003","90","","109.51","0.02","90","","1073.8","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","Bis(L-tyrosinium)sulfate monohydrate","Bis(L-tyrosinium)sulfate monhydrate","","- C18 H26 N2 O11 S -","- C18 H26 N2 O11 S -","- C36 H52 N4 O22 S2 -","2","1","CV6082","Sridhar, B.; Srinivasan, N.; Rajaram, R. K.","Bis(<small>L</small>-tyrosinium) sulfate monohydrate","Acta Crystallographica Section E","2002","58","2","o211","o214","10.1107/S1600536802001174","","","0.71073","MoKα","","0.0325","0.03","","","0.0826","0.0844","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200892","10.8487","0.0001","12.6944","0.0001","32.6567","0.0003","90","","90","","90","","4497.41","0.07","183","2","183","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Dimethyl 1,3-Dichloro-8-phenyl-5-phenylsulfanyl-isoquinoline-6,7-dicarboxylate","","- C25 H17 Cl2 N O4 S -","- C25 H17 Cl2 N O4 S -","- C200 H136 Cl16 N8 O32 S8 -","8","1","CV6083","Hoong-Kun Fun; Anwar Usman; Ibrahim Abdul Razak; Suchada Chantrapromma; Tarun K. Sarkar; Sankar Basak; Naranjan Panda","Dimethyl 1,3-dichloro-8-phenyl-5-phenylsulfanylisoquinoline-6,7-dicarboxylate","Acta Crystallographica Section E","2002","58","3","o215","o217","10.1107/S1600536802000958","","","0.71073","MoKα","","0.0813","0.0522","","","0.1269","0.1381","","","","","","0.973","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200893","9.639","0.003","12.751","0.003","9.044","0.003","95.76","0.02","110.97","0.02","108.63","0.02","954.2","0.5","296.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C21 H19 N2 O4 V -","- C21 H16 N2 O4 V -","- C42 H32 N4 O8 V2 -","2","1","CV6084","Okabe, Nobuo; Muranishi, Yasunori; Odoko, Mamiko","Bis(8-hydroxyquinolinato)oxopropoxovanadium(V)","Acta Crystallographica Section E","2002","58","3","m77","m79","10.1107/S1600536802002295","","","0.7107","MoKα","","","0.0527","","","","0.176","","","","","","1.14","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200894","7.9406","0.0001","9.4695","0.0002","31.1671","0.0005","90","","90","","90","","2343.56","0.07","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","2-Nitrobenzanilide","N-phenyl-2-nitrobenzamide","","- C13 H10 N2 O3 -","- C13 H10 N2 O3 -","- C104 H80 N16 O24 -","8","1","CV6088","Jackson, Roxanne Jean; Parvez, Masood; Nizami, Shaikh S.; Khan, Reem Y.","<i>N</i>-Phenyl-2-nitrobenzamide, an acridone alkaloid precursor","Acta Crystallographica Section E","2002","58","3","o282","o284","10.1107/S1600536802002489","","","0.71073","MoKα","","0.063","0.042","","","0.115","0.128","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200895","8.3669","0.0002","13.5769","0.0004","25.2554","0.0009","90","","90","","90","","2868.93","0.15","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","Cirsimaritin","(5,4'-Dihydroxy-6,7-dimethoxyflavone)","","- C17 H14 O6 -","- C17 H14 O6 -","- C136 H112 O48 -","8","1","CV6089","Chou, Nancy Hieu-Hong; Parvez, Masood; Ali, Muhammad Shaiq; Ahmed, Shakeel; Ahmed, Waqar","Cirsimaritin","Acta Crystallographica Section E","2002","58","3","o285","o287","10.1107/S1600536802002660","","","0.71073","MoKα","","0.086","0.048","","","0.134","0.157","","","","","","0.98","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200896","9.6687","0.0002","11.2722","0.0003","11.5579","0.0003","78.85","0.002","73.486","0.002","75.86","0.002","1160.66","0.05","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H25 N O2 S -","- C30 H25 N O2 S -","- C60 H50 N2 O4 S2 -","2","1","CV6090","Bennani, Brahim; Filalibaba, Bouchra; El-Fazazi, Ahmed; Al Houari, Ghali; Bilit, Najib; Kerbal, Abdelali; El-Bali, Brahim; Bolte, Michael","2',3'-Diphenyl-4'-<i>p</i>-tolylspiro[isothiachroman-3,5'-isoxazolidin]-4(2<i>H</i>)-one","Acta Crystallographica Section E","2002","58","3","o312","o313","10.1107/S1600536802002994","","","0.71073","MoKα","","0.0508","0.0389","","","0.0925","0.0992","","","","","","1.046","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200897","10.2083","0.0002","7.5434","0.0002","11.0118","0.0003","90","","109.677","0.001","90","","798.45","0.03","173","2","173","2","","","","","","","","3","P 1 21 1","P 2yb","4","Matricarin","","","- C17 H20 O5 -","- C17 H20 O5 -","- C34 H40 O10 -","2","1","CV6091","Parvez, Masood; Ahmad, Viqar Uddin; Farooq, Umar; Jassbi, Amir Reza; Raziullah, Hussaini S.","Matricarin","Acta Crystallographica Section E","2002","58","3","o324","o325","10.1107/S1600536802002982","","","0.71069","MoKα","","0.0385","0.0342","","","0.0894","0.0928","","","","","","1.071","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200899","11.937","0.003","14.74","0.004","12.085","0.003","90","","92.436","0.005","90","","2124.5","0.9","203","2","203","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H26 N4 O3 -","- C23 H26 N4 O3 -","- C92 H104 N16 O12 -","4","1","CV6093","Merz, Klaus","4,4'-Methylenediantipyrine monohydrate","Acta Crystallographica Section E","2002","58","3","o338","o340","10.1107/S1600536802003331","","","0.71073","MoKα","","0.0574","0.047","","","0.1217","0.1297","","","","","","1.031","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200900","10.552","0.005","12.833","0.005","15.432","0.011","95.53","0.02","106.57","0.02","97.02","0.02","1968.9","1.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-Amino-5-(4-chlorophenyl)-1-methylimidazole","","- C10 H10 Cl N3 -","- C10 H10 Cl N3 -","- C80 H80 Cl8 N24 -","8","4","DN6007","Rybakov, Victor B.; Babaev, Eugene V.; Belykh, Eugene N.","2-Amino-5-(4-chlorophenyl)-1-methylimidazole","Acta Crystallographica Section E","2002","58","2","o126","o128","10.1107/S1600536802000284","","","0.71073","MoKα","","","0.0513","","","","0.1333","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200901","8.111","0.002","5.732","0.001","24.235","0.005","90","","93.51","0.03","90","","1124.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,6-Dimethyl-3-nitro-8H-furo[2,3-g][1]-benzopyran-8-one","","- C13 H9 N O5 -","- C13 H9 N O5 -","- C52 H36 N4 O20 -","4","1","DN6010","Wolska, Irena; Kossakowski, Jerzy","2,6-Dimethyl-3-nitro-8<i>H</i>-furo[2,3-<i>g</i>][1]benzopyran-8-one","Acta Crystallographica Section E","2002","58","1","o40","o41","10.1107/S1600536801019699","","","0.71073","MoKα","","0.0793","0.0692","","","0.1613","0.1679","","","","","","1.129","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200902","12.1894","0.0007","8.9921","0.0003","13.0425","0.0008","90","","107.97","0.01","90","","1359.83","0.15","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C27 H35 N O7 S -","- C27 H35 N O7 S -","- C54 H70 N2 O14 S2 -","2","1","DN6011","Garzino, Frédéric; Méou, Alain; Brun, Pierre; Pèpe, Gérard","(2<i>R</i>,3<i>R</i>)-2-(4-Methoxyphenyl)-3-{1-[(3a<i>S</i>)-(3aα,6α,7aα)-hexahydro-8,8-dimethyl-3<i>H</i>-3a,6-methano-2,2-dioxo-2,1-benzoisothiazolyl]carbonyl}-4-isopropoxycarbonyl-5-methyl-2,2-dihydrofuran","Acta Crystallographica Section E","2002","58","3","o310","o311","10.1107/S1600536802000971","","","0.71069","MoKα","","0.0775","0.0571","","","0.119","0.1275","","","","","","1.024","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200903","10.147","0.002","10.938","0.002","17.681","0.003","90","0.003","92.65","0.03","90","0.03","1960.3","0.6","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C20 H25 N O4 S -","- C20 H25 N O4 S -","- C80 H100 N4 O16 S4 -","4","1","DN6012","Garzino, Frédéric; Méou, Alain; Brun, Pierre; Pèpe, Gérard","(1<i>S</i>,2<i>R</i>)-<i>N</i>-[(<i>E</i>)-4-Methoxycinnamoyl]-10,2-camphorsultam","Acta Crystallographica Section E","2002","58","3","o308","o309","10.1107/S160053680200096X","","","0.71069","MoKα","","0.046","0.0403","","","0.0992","0.1027","","","","","","1.049","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200904","12.9064","0.0005","15.6222","0.0006","9.914","0.0004","90","","109.837","0.001","90","","1880.31","0.13","183","2","183","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","erythro-2-(2,6-Dimethoxyphenoxy)-1-(4-hydroxy-3,5-dimethoxyphenyl)-1,3- propanediol","","- C19 H24 O8 -","- C19 H24 O8 -","- C76 H96 O32 -","4","1","DN6014","Langer, Vratislav; Li, Shiming; Lundquist, Knut","<i>erythro</i>-2-(2,6-Dimethoxyphenoxy)-1-(4-hydroxy-3,5-dimethoxyphenyl)-1,3-propanediol","Acta Crystallographica Section E","2002","58","1","o42","o44","10.1107/S1600536801021146","","","0.71073","MoKα","","0.0912","0.0565","","","0.1163","0.1333","","","","","","1.036","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200906","10.065","0.004","10.512","0.016","30.696","0.01","90","","90","","90","","3248","5","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2'R,3'R)-methyl 2-azido-2,6-dideoxy-3,4-O-(2',3'-dimethoxybutane- 2',3'-diyl)-α-L-glucopyranoside.","","- C13 H23 N3 O6 -","- C13 H23 N3 O6 -","- C104 H184 N24 O48 -","8","2","DN6016","Barnes, John C.; Brimacombe, John S.; Connolly, Lisa M. C.; Dix, Alexander P.","Methyl (2'<i>R</i>,3'<i>R</i>)-2-azido-2,6-dideoxy-3,4-<i>O</i>-(2',3'-dimethoxybutane-2',3'-diyl)-α-<small>L</small>-glucopyranoside","Acta Crystallographica Section E","2002","58","3","o227","o228","10.1107/S1600536802001940","","","0.71073","MoKα","","0.0657","0.0323","","","0.054","0.0583","","","","","","0.723","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200907","8.7709","0.0003","14.0181","0.001","18.1744","0.0013","90","","90","","90","","2234.6","0.2","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2'R,3'R)-methyl 6-deoxy-3,4-O-(2',3'-dimethoxybutane- 2',3'-diyl)-2-O-toluene-p-sulfonyl-α-L-mannopyranoside","","- C20 H30 O9 S -","- C20 H30 O9 S -","- C80 H120 O36 S4 -","4","1","DN6017","Barnes, John C.; Brimacombe, John S.; Connolly, Lisa M. C.; Dix, Alexander P.","Methyl (2'<i>R</i>,3'<i>R</i>)-6-deoxy-3,4-<i>O</i>-(2',3'-dimethoxybutane-2',3'-diyl)-2-<i>O</i>-toluene-<i>p</i>-sulfonyl-α-<small>L</small>-mannopyranoside","Acta Crystallographica Section E","2002","58","3","o224","o226","10.1107/S1600536802001952","","","0.71073","MoKα","","0.1222","0.0689","","","0.1042","0.1217","","","","","","1.091","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200908","5.7328","0.0001","8.8866","0.0002","22.6889","0.0006","82.7481","0.0008","84.5281","0.0008","88.4739","0.0011","1141.29","0.04","300","","300","","","","","","","","","3","P -1","-P 1","2","","","","- C30 H26 N4 -","- C30 H26 N4 -","- C60 H52 N8 -","2","1","DN6019","Evain, Michel; Quillard, Sophie; Corraze, Benoit; Wang, Wei; MacDiarmid, Alan G.","A phenyl-end-capped tetramer of aniline","Acta Crystallographica Section E","2002","58","3","o343","o344","10.1107/S1600536802002532","","","0.71069","MoKα","","0.0809","0.0486","","","0.1051","0.1133","","","","1.8","1.8","1.54","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200909","6.8433","0.0019","15.585","0.009","16.646","0.0012","90","","90","","90","","1775.3","1.1","293","2","293","2","","","","","","","","5","C m c a","-C 2ac 2","64","","o-Methylselenobenzoyl cyanide","","- C9 H7 N O Se -","- C9 H7 N O Se -","- C72 H56 N8 O8 Se8 -","8","","DN6021","Dupont, Léon; Messali, Mouslim; Christiaens, Léon","<i>o</i>-Methylselenobenzoyl cyanide","Acta Crystallographica Section E","2002","58","3","o341","o342","10.1107/S1600536802003422","","","1.5418","CuKα","","0.0537","0.0415","","","0.1051","0.1106","","","","","","1.008","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2200910","6.0696","0.0005","18.0716","0.0009","10.878","0.0008","90","","99.579","0.01","90","","1176.54","0.15","300","","300","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-N-Phenylacetamido-6H-1,3-thiazin-6-one","","- C12 H10 N2 O2 S -","- C12 H10 N2 O2 S -","- C48 H40 N8 O8 S4 -","4","1","DN6022","Evain, Michel; Landreau, Cyrille; Deniaud, David; Reliquet, Alain; Meslin, Jean Claude","2-(<i>N</i>-Phenylacetamido)-6<i>H</i>-1,3-thiazin-6-one","Acta Crystallographica Section E","2002","58","3","o288","o289","10.1107/S1600536802002726","","","0.71069","MoKα","","0.0741","0.0451","","","0.1116","0.1191","","","","","","1.65","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200911","5.797","0.001","7.206","0.001","8.068","0.001","97.87","0.01","104.51","0.01","106.55","0.01","304.78","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- H4 O6 P2 Sr -","- O6 P2 Sr -","- O12 P4 Sr2 -","2","1","MG6000","Ouarsal, Rachid; Alaoui Tahiri, Aziz; El Bali, Brahim; Lachkar, Mohammed; Bolte, Michael","Strontium dihydrogenphosphite","Acta Crystallographica Section E","2002","58","2","i19","i20","10.1107/S1600536802000806","","","0.71073","MoKα","","0.0701","0.0681","","","0.1718","0.1815","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200912","4.9423","0.0007","4.9423","0.0007","9.1251","0.0018","90","","90","","120","","193.03","0.05","293","2","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Ag Ba Bi -","- Ag Ba Bi -","- Ag2 Ba2 Bi2 -","2","0.0833333","MG6001","Kang, Sung Kwon; Miller, Gordon J.","The intermetallic compound BaAgBi","Acta Crystallographica Section E","2002","58","3","i21","i22","10.1107/S1600536802001721","","","0.71073","MoKα","","","0.0375","","","","0.1022","","","","","","1.155","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200913","9.0609","0.0004","14.7671","0.0006","14.8106","0.0006","90","","90","","90","","1981.71","0.14","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- H8 Na O10 P3 Zn -","- H8 Na O10 P3 Zn -","- H64 Na8 O80 P24 Zn8 -","8","1","MG6002","Ouarsal, Rachid; Alaoui Tahiri, Aziz; El Bali, Brahim; Lachkar, Mohammed; Harrison, William T. A.","Sodium zinc tris(dihydrogenphosphite) hydrate, NaZn(H~2~PO~3~)~3~·H~2~O","Acta Crystallographica Section E","2002","58","3","i23","i25","10.1107/S1600536802002209","","","0.71073","MoKα","","0.04","0.0249","","","0.0545","0.0574","","","","","","0.943","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200914","16.29","0.003","11.837","0.002","19.426","0.004","90","","104.11","0.03","90","","3632.8","1.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","9,10-Bis(3-hydroxy-3,3-diphenylprop-1-ynyl)anthracene N,N'dimethylformamide solvate","","- C47 H37 N O3 -","- C47 H37 N O3 -","- C188 H148 N4 O12 -","4","1","NA6077","Sugadev, R.; Balasundaresan, D.; Chacko, K. K.; Ponnuswamy, M. N.; Sureskumar, S.","9,10-Bis(3-hydroxy-3,3-diphenylprop-1-ynyl)anthracene <i>N</i>,<i>N</i>'-dimethylformamide solvate","Acta Crystallographica Section E","2002","58","2","o88","o89","10.1107/S1600536801019845","","","1.54178","CuKα","","0.0653","0.0578","","","0.1691","0.1764","","","","","","1.081","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200915","7.3615","0.0016","21.815","0.005","7.6346","0.0016","90","","91.541","0.005","90","","1225.6","0.5","110","2","110","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1-propenyl-2-methyl-1,2-dicarba-closo-dodecaborane(12)","","- C6 H18 B10 -","- C6 H18 B10 -","- C24 H72 B40 -","4","1","NA6109","Grintselev-Knyazev, Gennadii V.; Antipin, Mikhail Yu.; Knyazev, Sergey P.; Kirin, Valerii N.; Chernyshev, Eugenii A.","2-Methyl-1-propenyl-1,2-dicarba-<i>closo</i>-dodecaborane(12)","Acta Crystallographica Section E","2002","58","1","o16","o17","10.1107/S1600536801020165","","","0.71073","MoKα","","0.0849","0.0569","","","0.1193","0.1279","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200916","10.697","0.003","18.228","0.004","11.202","0.002","90","","115.02","0.02","90","","1979.3","0.9","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,5-Dicarboethoxy-3,4-diphenylcyclopentadienone","","- C23 H20 O5 -","- C23 H20 O5 -","- C92 H80 O20 -","4","1","NA6111","Grossie, David A.; Feld, William A.; Reinhardt, Bruce A.; Bernal, David; Dyar, Heather; Khan, Ilyas; Koussa, Jack; Krall, Holly; Kuhr, Ida; Sawyer, Jim","Diethyl 2-oxo-4,5-diphenylcyclopentane-1,3-dicarboxylate","Acta Crystallographica Section E","2002","58","1","o8","o9","10.1107/S1600536801020323","","","0.71069","MoKα","","0.13","0.064","","","0.198","0.219","","","","","","0.983","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200917","10.631","0.003","13.283","0.003","5.214","0.003","90","","90","","90","","736.3","0.5","296.2","","","","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C12 H14 N4 Ni O6 -","- C12 H14 N4 Ni O6 -","- C24 H28 N8 Ni2 O12 -","2","0.5","NA6112","Odoko, Mamiko; Adachi, Yukari; Okabe, Nobuo","Bis[2-hydroxy-3-(1<i>H</i>-imidazol-4-yl)propionato]nickel(II)","Acta Crystallographica Section E","2002","58","1","m7","m9","10.1107/S1600536801020335","","","0.7107","MoKα","","","0.0194","","","","0.0573","","","","","","1.095","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200918","13.0859","0.0014","11.4837","0.0013","22.422","0.002","90","","90","","90","","3369.5","0.6","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C19 H17 N3 O3 -","- C19 H17 N3 O3 -","- C152 H136 N24 O24 -","8","1","NA6113","Yu Zhang; Yizhi Li; Hanbin Tao; Longgen Zhu","4-(Antipyrin-4-yliminomethyl)benzoic acid","Acta Crystallographica Section E","2002","58","1","o24","o26","10.1107/S1600536801020207","","","0.71073","MoKα","","0.0889","0.0453","","","0.0714","0.0764","","","","","","1.032","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200919","13.465","0.003","15.135","0.003","9.1558","0.0018","90","","108.86","0.03","90","","1765.7","0.7","100","1","100","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","5-Amino-4-(benzotriazol-1-ylmethyl)-1-phenyl-3-tert-butylpyrazole","","- C20 H22 N6 -","- C20 H22 N6 -","- C80 H88 N24 -","4","1","NA6114","Low, John Nicolson; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo; Rengifo, Emerson; Abonia, Rodrigo","5-Amino-4-(benzotriazol-1-ylmethyl)-1-phenyl-3-<i>tert</i>-butylpyrazole","Acta Crystallographica Section E","2002","58","1","o53","o54","10.1107/S1600536801020670","","","0.71073","MoKα","","0.1414","0.0614","","","0.1229","0.1502","","","","","","0.948","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200920","7.566","0.0003","17.7842","0.0008","10.2284","0.0004","90","","104.689","0.003","90","","1331.3","0.1","120","1","120","1","","","","","","","","3","P 1 21 1","P 2yb","4","","1-(2-Methyl-2,3-dihydro-indol-1-ylmethyl)-1H-benzotriazole","","- C16 H16 N4 -","- C16 H16 N4 -","- C64 H64 N16 -","4","2","NA6115","Low, John Nicolson; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo; Abonia, Rodrigo; Albornoz, Andrea","1-(2-Methyl-2,3-dihydroindol-1-ylmethyl)-1<i>H</i>-benzotriazole","Acta Crystallographica Section E","2002","58","1","o55","o56","10.1107/S1600536801020682","","","0.71073","MoKα","","0.1015","0.0598","","","0.1279","0.1455","","","","","","0.979","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200921","5.3389","0.0004","28.583","0.002","9.8618","0.0008","90","","109.178","0.004","90","","1421.41","0.19","120","1","120","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","5-[(6-Chloro-[1,3]benzothiazol-2-ylamino)-methylene]-2,2-dimethyl- [1,3]dioxane-4,6-dione","","- C14 H11 Cl N2 O4 S -","- C14 H11 Cl N2 O4 S -","- C56 H44 Cl4 N8 O16 S4 -","4","1","NA6116","Low, John Nicolson; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo; Hernández, Pedro; Quiroga, Jairo","5-[(6-Chloro-[1,3]benzothiazol-2-ylamino)methylene]-2,2-dimethyl-[1,3]dioxane-4,6-dione","Acta Crystallographica Section E","2002","58","1","o57","o58","10.1107/S1600536801020694","","","0.71073","MoKα","","0.1393","0.0544","","","0.0943","0.116","","","","","","0.935","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200922","21.4218","0.0004","7.8864","0.0002","19.7794","0.0004","90","","109.328","0.001","90","","3153.22","0.12","120","2","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C11 H28 Cl N O7 -","- C11 H28 Cl N O7 -","- C88 H224 Cl8 N8 O56 -","8","1","NA6117","Coles, Simon J.; Hursthouse, Michael B.; Kılıç, Adem; Yenilmez Çiftçi, Gönül","2-Aminomethyl-15-crown[5] hydrochloride dihydrate","Acta Crystallographica Section E","2002","58","1","o83","o85","10.1107/S1600536801021432","","","0.71073","MoKα","","","0.0344","","","","0.0869","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200923","8.652","0.002","17.558","0.004","19.668","0.004","90","","95.42","0.03","90","","2974.4","1.1","295","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Triiodide phthalocyaninato(2-) arsenic(III)","","","- C32 H16 As I3 N8 -","- C32 H16 As I3 N8 -","- C128 H64 As4 I12 N32 -","4","1","NA6120","Jan Janczak; Ynara Marina Idemori","[Phthalocyaninato(2‒)]arsenic(III) triiodide","Acta Crystallographica Section E","2002","58","1","m36","m38","10.1107/S1600536801021365","","","0.71073","MoKα","","0.1239","0.0483","","","0.034","0.0415","","","","","","0.992","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200924","16.603","0.004","8.339","0.003","7.903","0.004","90","","103.76","0.06","90","","1062.8","0.8","290","1","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H11 Cl N O4 P -","- C7 H11 Cl N O4 P -","- C28 H44 Cl4 N4 O16 P4 -","4","1","NA6121","Fábry, Jan; Krupková, Radmila; Studnička, Václav","4-Chloro-2-methylanilinium dihydrogenphosphate","Acta Crystallographica Section E","2002","58","2","o105","o107","10.1107/S1600536801021808","","","0.710688","MoKα","","0.1769","0.045","","","0.1117","0.1697","","","","","","0.816","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200925","15.527","0.003","10.648","0.005","13.081","0.005","90","","125.98","0.02","90","","1750.1","1.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis phenylguanidinium carbonate monohydrate","","- C15 H22 N6 O4 -","- C15 H22 N6 O4 -","- C60 H88 N24 O16 -","4","1","NA6122","Kolev, Tsonko; Todorov, Todor; Petrova, Rosica","Bis(phenylguanidinium) carbonate monohydrate","Acta Crystallographica Section E","2002","58","2","o111","o113","10.1107/S160053680102178X","","","0.71073","MoKα","","0.0781","0.0414","","","0.1097","0.1261","","","","","","1.018","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200926","8.289","0.001","12.117","0.002","19.225","0.003","90","","99.88","0.01","90","","1902.3","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-(2-Acetyl-2-(4-ethoxyphenyl)amino-1-oxoethyl)-1,2,3,4- tetrahydro-2-quinoxalinone","","- C20 H21 N3 O4 -","- C20 H21 N3 O4 -","- C80 H84 N12 O16 -","4","1","NA6123","Kruszynski, Rafal; Bartczak, Tadeusz J.; Mikiciuk-Olasik, Elżbieta","4-[(4-Ethoxyphenyl)aminoacetyl]-1,2,3,4-tetrahydroquinoxalin-2-one","Acta Crystallographica Section E","2002","58","2","o98","o101","10.1107/S1600536801021742","","","1.54052","CuKα","","0.1625","0.0742","","","0.2184","0.2477","","","","","","0.962","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200927","14.915","0.002","7.6811","0.001","18.688","0.002","90","","97.36","0.002","90","","2123.3","0.5","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Carbonyl(hydrotris(3,5-dimethylpyrazol-1-yl)borato)copper(I) acetonitrile solvate","Carbonyl(hydrotris(3,5-dimethylpyrazol-1-yl)borato)copper(I) acetonitrile solvate (1/1)","","- C18 H25 B Cu N7 O -","- C18 H25 B Cu N7 O -","- C72 H100 B4 Cu4 N28 O4 -","4","1","NA6124","Blake, Alexander J.; Carling, David A.; George, Michael W.; Hubberstey, Peter; Lopez Garcia, Roberto; Wilson, Claire","Carbonyl[hydrotris(3,5-dimethylpyrazol-1-yl)borato]copper(I) acetonitrile solvate","Acta Crystallographica Section E","2002","58","2","m41","m42","10.1107/S1600536801021730","","","0.71073","MoKα","","0.0843","0.0418","","","0.0968","0.125","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200928","23.6934","0.0004","6.4529","0.0002","19.183","0.0005","90","","114.247","0.001","90","","2674.18","0.12","203","2","203","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,4-Diazabicyclo[2.2.2]octanium 2,4-dinitrophenolate","","- C12 H16 N4 O5 -","- C12 H16 N4 O5 -","- C96 H128 N32 O40 -","8","1","NA6125","Suchada Chantrapromma; Anwar Usman; Hoong-Kun Fun; Bo-Long Poh; Chatchanok Karalai","1,4-Diazabicyclo[2.2.2]octanium 2,4-dinitrophenolate","Acta Crystallographica Section E","2002","58","2","o102","o104","10.1107/S1600536801021791","","","0.71073","MoKα","","0.0819","0.0535","","","0.1222","0.1309","","","","","","0.83","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200929","12.3777","0.0003","7.3596","0.0002","22.0064","0.0001","90","","97.886","0.002","90","","1985.71","0.07","183","2","183","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H20 N6 O10 -","- C16 H20 N6 O10 -","- C64 H80 N24 O40 -","4","1","NA6126","Suchada Chantrapromma; Anwar Usman; Hoong-Kun Fun; Bo-Long Poh; Chatchanok Karalai","The 1:2 adduct <i>N,N</i>-dimethylethylenediamine-1,4-diium bis(2,4-dinitrophenolate)","Acta Crystallographica Section E","2002","58","2","o108","o110","10.1107/S1600536801021845","","","0.71073","MoKα","","0.119","0.0584","","","0.118","0.1376","","","","","","0.868","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200930","14.7661","0.0003","10.5226","0.0002","16.8753","0.0005","90","","98.8586","0.0007","90","","2590.77","0.11","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","Octanoic acid derivative of a macrocyclic salicylate","2-[(7R,9S,10R,12E)-4,9-Dihydroxy-10-methyl-5-oxo-7,8,9,10,11,14-hexahydro-5H- 6-oxa-benzocyclododecen-7-yl]ethyl octanoate","","- C26 H38 O6 -","- C26 H38 O6 -","- C104 H152 O24 -","4","2","NA6127","Esser, Lothar; De Brabander, Jef K.","2-[(7<i>R</i>,9<i>S</i>,10<i>R</i>,12<i>E</i>)-4,9-Dihydroxy-10-methyl-5-oxo-7,8,9,10,11,14-hexahydro-5<i>H</i>-6-oxa-benzocyclododecen-7-yl]ethyl octanoate","Acta Crystallographica Section E","2002","58","2","o142","o144","10.1107/S1600536802000466","","","0.71069","MoKα","","0.0745","0.0565","","","0.1515","0.1663","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200931","7.2788","0.0001","12.2856","0.0001","27.1499","0.0003","90","","94.313","0.001","90","","2420.99","0.05","183","2","183","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,2,7-Triphenyl-1H-naphth[2,1-c]azepine-1,5-dione","","- C33 H25 N O2 -","- C33 H25 N O2 -","- C132 H100 N4 O8 -","4","1","NA6128","Bao Guo Zhao; Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Jian-Hua Xu","2-Methyl-3,3,10-triphenyl-3,4-dihydronaphth[2,1-<i>c</i>]azepine-1,5-dione","Acta Crystallographica Section E","2002","58","2","o162","o164","10.1107/S1600536802000740","","","0.71073","MoKα","","0.0757","0.0598","","","0.1445","0.151","","","","","","0.934","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200932","12.5439","0.0004","8.3686","0.0002","18.9898","0.0006","90","","106.881","0.001","90","","1907.55","0.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,2-Bis(1'-Phenylsulfonyl-3-phenylthioindole-2-yl)ethane","","- C42 H32 N2 O4 S4 -","- C42 H32 N2 O4 S4 -","- C84 H64 N4 O8 S8 -","2","0.5","NA6129","Sethu Sankar, K.; Suresh Babu, N.; Velmurugan, D.; Shanmuga Sundara Raj, S.; Fun, H.-K.","1,2-Bis(1-phenylsulfonyl-3-phenylthioindol-2-yl)ethane","Acta Crystallographica Section E","2002","58","2","o134","o136","10.1107/S1600536802000405","","","0.71073","MoKα","","0.1455","0.0563","","","0.118","0.1442","","","","","","0.928","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200933","9.2852","0.0002","9.5994","0.0004","10.6206","0.0005","67.323","0.001","73.287","0.001","84.761","0.001","836.35","0.06","183","2","183","2","","","","","","","","4","P -1","-P 1","2","","1-Acetyl-2-oxo-4'-methyl-2'a-phenylspiro[3H-indole-3,2'(2'aH,5'aH)oxeto [3,2-d]oxazole]","","- C20 H16 N2 O4 -","- C20 H16 N2 O4 -","- C40 H32 N4 O8 -","2","1","NA6130","Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Yan Zhang; Jian-Hua Xu","1-Acetyl-2-oxo-4'-methyl-2a'-phenylspiro[3<i>H</i>-indole-3,2'(2a'<i>H</i>,5a'<i>H</i>)-oxeto[3,2-<i>d</i>]oxazole]","Acta Crystallographica Section E","2002","58","2","o145","o147","10.1107/S1600536802000478","","","0.71073","MoKα","","0.082","0.0726","","","0.1847","0.1917","","","","","","0.992","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200934","6.1961","0.0014","13.613","0.004","15.842","0.002","90","","90","","90","","1336.2","0.5","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H15 N O3 S -","- C13 H15 N O3 S -","- C52 H60 N4 O12 S4 -","4","1","NA6131","Hansen, Lars Kr.; Bayer, Annette; Gautun, Odd R.","Benzyl (1<i>R</i>*,3<i>S</i>*)-3,6-dihydro-3-methyl-1λ^4^,2-thiazine-2-carboxylate 1-oxide","Acta Crystallographica Section E","2002","58","2","o165","o166","10.1107/S1600536802000880","","","0.71069","MoKα","","0.0535","0.0352","","","0.0985","0.1068","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200935","8.539","0.0007","15.9795","0.0015","9.2826","0.0006","90","","102.007","0.005","90","","1238.89","0.18","293","2","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C3 H14 Ga N2 O11 P3 -","- C3 H14 Ga N2 O11 P3 -","- C12 H56 Ga4 N8 O44 P12 -","4","0.5","NA6132","Kissick, Judith L.; Chippindale, Ann M.","[NH~3~(CH~2~)~3~NH~3~][Ga(P~2~O~7~)(H~2~PO~4~)]: a new organically templated gallium phosphate-diphosphate","Acta Crystallographica Section E","2002","58","3","m80","m82","10.1107/S1600536802001344","","","1.5418","CuKα","","0.0372","0.0279","","","0.07","0.0743","","","","","","1.112","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200936","8.172","0.0003","9.3069","0.0004","11.845","0.0005","110.015","0.004","93.301","0.004","102.208","0.003","819.01","0.06","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Tetracarbonyl{bis[(pentafluoroethyl)diphenylphosphine]}chromium(0)","","- C32 H20 Cr F10 O4 P2 -","- C32 H20 Cr F10 O4 P2 -","- C32 H20 Cr F10 O4 P2 -","1","0.5","NA6133","Peters, R. Gregory; Golynskiy, Misha V.; Baughman, Russell G.","Tetracarbonylbis[(pentafluoroethyl)diphenylphosphine]chromium(0)","Acta Crystallographica Section E","2002","58","2","m70","m71","10.1107/S1600536802001356","","","0.71073","MoKα","","0.046","0.0348","","0.0941","","0.0869","","","1.049","","","1.079","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200937","14.349","0.002","9.831","0.002","11.685","0.002","90","","90","","90","","1648.3","0.5","173","2","173","2","","","","","","","","5","C m c 21","C 2c -2","36","","","","- C15 H15 Cl Cu N3 -","- C15 H15 Cl Cu N3 -","- C60 H60 Cl4 Cu4 N12 -","4","0.5","NA6134","Scholz, Stefan; Lerner, Hans-Wolfram; Bolte, Michael","Chlorotripyridinecopper(I)","Acta Crystallographica Section E","2002","58","2","m72","m73","10.1107/S1600536802001630","","","0.71073","MoKα","","0.0697","0.0484","","","0.0693","0.0748","","","","","","0.944","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200938","19.568","0.0019","10.6989","0.001","21.617","0.002","90","","90","","90","","4525.7","0.7","160","2","160","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C48 H48 N4 O10 Zn2 -","- C48 H48 N4 O10 Zn2 -","- C192 H192 N16 O40 Zn8 -","4","0.5","NA6135","Necefoglu, Hacali; Clegg, William; Scott, Andrew J.","Tetrakis(μ-benzoato)bis[(<i>N,N</i>-diethylnicotinamide)zinc(II)]","Acta Crystallographica Section E","2002","58","3","m121","m122","10.1107/S1600536802002088","","","0.71073","MoKα","","0.0303","0.0275","","","0.0701","0.0725","","","","","","1.071","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200939","16.347","0.002","10.7691","0.0013","17.647","0.002","90","","107.207","0.003","90","","2967.6","0.6","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C62 H58 Ca N4 O14 Zn2 -","- C62 H58 Ca N4 O14 Zn2 -","- C124 H116 Ca2 N8 O28 Zn4 -","2","0.5","NA6136","Necefoglu, Hacali; Clegg, William; Scott, Andrew J.","A linear trinuclear CaZn~2~ complex with bridging benzoate ligands","Acta Crystallographica Section E","2002","58","3","m123","m124","10.1107/S160053680200209X","","","0.71073","MoKα","","0.0519","0.0398","","","0.0894","0.0966","","","","","","1.121","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200940","7.0554","0.0007","14.0106","0.0013","8.5228","0.0015","90","","103.444","0.012","90","","819.4","0.19","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-pyridylmethylphosphonic acid monohydrate","","- C6 H10 N O4 P -","- C6 H10 N O4 P -","- C24 H40 N4 O16 P4 -","4","1","NA6137","Chęcińska, Lilianna; Małecka, Magdalena; Aranowska, Katarzyna; Ochocki, Justyn","3-Pyridylmethylphosphonic acid monohydrate","Acta Crystallographica Section E","2002","58","3","o235","o237","10.1107/S1600536802002155","","","1.54178","CuKα","","0.0558","0.0522","","","0.143","0.1464","","","","","","1.107","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200941","9.665","0.002","15.394","0.003","19.2","0.004","90","","93.92","0.02","90","","2850","1","143","2","143","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H41 O5 P -","- C32 H41 O5 P -","- C128 H164 O20 P4 -","4","1","NA6138","Jones, Peter G.; Kirby, Anthony J.; Pilkington, Melanie","2,2,2-Tris(cyclohexyloxy)-4,5-(2',2''-biphenylo)-1,3,2-dioxaphospholene","Acta Crystallographica Section E","2002","58","3","o268","o269","10.1107/S1600536802002398","","","0.71073","MoKα","","0.0745","0.0483","","","0.1027","0.1193","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200942","7.6548","0.0002","15.7782","0.0004","10.9114","0.0004","90","","95.299","0.001","90","","1312.24","0.07","150","","150","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","2,3,5-Trichloro-6-(2-diethylaminovinyl)-1,4-benzoquinone","","- C12 H12 Cl3 N O2 -","- C12 H12 Cl3 N O2 -","- C48 H48 Cl12 N4 O8 -","4","1","NA6139","Krivokapic, Alexander; Anderson, Harry L.","2,3,5-Trichloro-6-(2-diethylaminovinyl)-1,4-benzoquinone","Acta Crystallographica Section E","2002","58","3","o259","o260","10.1107/S1600536802002283","","","0.71073","MoKα","","","0.0256","","","","0.0286","","","","","","1.0234","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200943","12.138","0.004","15.279","0.004","8.763","0.003","90","","107.24","0.03","90","","1552.1","0.9","178","2","178","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H10 N2 -","- C20 H10 N2 -","- C80 H40 N8 -","4","1","NA6140","Jones, Peter G.; Hopf, Henning; Kreutzer, Martin","3-(Dicyanomethylene)-1,5-diphenylpenta-1,4-diyne","Acta Crystallographica Section E","2002","58","3","o266","o267","10.1107/S1600536802002490","","","0.71073","MoKα","","0.0967","0.0475","","","0.113","0.1378","","","","","","0.899","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200944","9.5892","0.0008","10.8264","0.001","11.3959","0.0009","111.904","0.006","96.814","0.007","100.727","0.007","1055.29","0.17","230","","230","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H8 B F15 S -","- C22 H8 B F15 S -","- C44 H16 B2 F30 S2 -","2","1","OB6091","Schaper, Frank; Brintzinger, Hans-Herbert","Tetrahydrothiophene tris(pentafluorophenyl)borane","Acta Crystallographica Section E","2002","58","1","o77","o78","10.1107/S160053680102027X","","","0.71073","MoKα","","0.0349","0.0311","","","0.0801","0.0829","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200945","10.4199","0.0015","11.7594","0.0017","17.288","0.003","71.449","0.002","86.811","0.003","86.953","0.003","2003.7","0.5","93","2","93","2","","","","","","","","4","P -1","-P 1","2","2,4,6,8,10,12-hexaaza-2,4,6,8,10,12-hexabenzyl-5-(nitromethylene)- tricyclo[7.3.0.0^3,7^]dodecane","2,4,6,8,10,12-hexaaza-2,4,6,8,10,12-hexabenzyl-5-(nitromethylene)- tricyclo[7.3.0.0^3,7^]dodecane","","- C49 H49 N7 O2 -","- C49 H49 N7 O2 -","- C98 H98 N14 O4 -","2","1","OB6097","Gilardi, Richard D.; Butcher, Ray J.","2,4,6,8,10,12-Hexabenzyl-5-(nitromethylene)-2,4,6,8,10,12-hexaazatricyclo[7.3.0.0^3,7^]dodecane","Acta Crystallographica Section E","2002","58","2","o120","o122","10.1107/S160053680200003X","","","0.71073","MoKα","","0.0859","0.0587","","","0.1087","0.1164","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200946","9.222","0.003","14.768","0.003","12.239","0.003","90","","97.7","0.02","90","","1651.8","0.8","296.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H28 Cd2 N4 O22 -","- C28 H28 Cd2 N4 O22 -","- C56 H56 Cd4 N8 O44 -","2","0.5","OB6098","Odoko, Mamiko; Kusano, Ai; Okabe, Nobuo","Hexaaquabis(μ-pyridine-2,6-dicarboxylato-<i>O,N,O</i>':<i>O</i>)dicadmium(II)-pyridine-2,6-dicarboxylic acid (1/2)","Acta Crystallographica Section E","2002","58","1","m25","m27","10.1107/S1600536801020888","","","0.7107","MoKα","","","0.0371","","","","0.1239","","","","","","1.081","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200947","7.9289","0.001","8.4017","0.001","13.285","0.001","79.759","0.005","82.136","0.006","72.503","0.005","827.32","0.16","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C14 H8 Br6 -","- C14 H8 Br6 -","- C28 H16 Br12 -","2","1","OB6099","Hökelek, Tuncer; Tutar, Ahmet; Çakmak, Osman","<i>trans,cis,trans</i>-1,2,3,4,9,10-Hexabromo-1,2,3,4-tetrahydroanthracene","Acta Crystallographica Section E","2002","58","1","o10","o12","10.1107/S160053680102061X","","","0.71073","MoKα","","0.0867","0.0331","","","0.0694","0.0804","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200948","6.4787","0.0003","9.2555","0.0006","13.9995","0.0006","91.014","0.004","101.315","0.003","106.592","0.004","786.44","0.07","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Hexaaquamagnesium bis[trans[nitrilotriacetato(2-)-O^1^,N,O^2^]-μ-oxo-cis-dioxomolybdate(VI)] hexahydrate","","- C12 H38 Mg Mo2 N2 O29 -","- C12 H38 Mg Mo2 N2 O29 -","- C12 H38 Mg Mo2 N2 O29 -","1","0.5","OB6100","Yan, Wen Bin; Deng, Yuan Fu; Zhang, Feng Zhang; Zhou, Zhao Hui; Wan, Hui Lin; Ng, Seik Weng","Hexaaquamagnesium bis{<i>trans</i>-[nitrilotriacetato(2‒)-κ^3^<i>O</i>^1^,<i>N,O</i>^2^]-μ-oxo-<i>cis</i>-dioxomolybdate(VI)} hexahydrate","Acta Crystallographica Section E","2002","58","1","m22","m24","10.1107/S1600536801020748","","","0.71073","MoKα","","0.0311","0.0283","","","0.0739","0.0757","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200949","4.8685","0.001","17.199","0.007","17.172","0.004","90","","91.678","0.019","90","","1437.3","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H20 N2 O12 -","- C8 H20 N2 O12 -","- C32 H80 N8 O48 -","4","1","OB6101","M.Alagar; M. Subha Nandhini; R. V. Krishnakumar; S.Natarajan","Bis(<small>DL</small>-serinium) oxalate dihydrate","Acta Crystallographica Section E","2002","58","2","o114","o116","10.1107/S1600536801021225","","","1.5418","CuKα","","0.0382","0.0373","","","0.0977","0.0986","","","","","","1.125","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200950","22.373","0.003","5.6925","0.0007","14.917","0.003","90","","115.31","0.01","90","","1717.4","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","β-alaninum oxalate hemihydrate","β-alaninum oxalate hemihydrate","","- C5 H10 N O6.5 -","- C5 H10 N O6.5 -","- C40 H80 N8 O52 -","8","1","OB6102","R. V. Krishnakumar; M. Subha Nandhini; S. Natarajan","β-Alaninium oxalate hemihydrate","Acta Crystallographica Section E","2002","58","2","o117","o119","10.1107/S1600536801021213","","","0.71073","MoKα","","0.0426","0.0328","","","0.0804","0.0902","","","","","","1.102","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200951","5.4507","0.0002","18.5945","0.0009","11.4256","0.0006","90","","100.941","0.003","90","","1136.97","0.09","295","2","295","2","","","","","","","","4","C 1 c 1","C -2yc","9","Dibromothymoquinone","2,5-Dibromo-3-methyl-6-isopropyl-1,4-benzoquinone","","- C10 H10 Br2 O2 -","- C10 H10 Br2 O2 -","- C40 H40 Br8 O8 -","4","1","OB6105","Lothar Esser; Zbyszek Otwinowski; Hoeon Kim","2,5-Dibromo-6-isopropyl-3-methyl-<i>p</i>-benzoquinone","Acta Crystallographica Section E","2002","58","2","o170","o171","10.1107/S1600536801021353","","","0.71073","MoKα","","0.0261","0.0244","","","0.0633","0.0643","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200952","13.1983","0.0018","19.015","0.003","8.8486","0.0012","90","","90","","90","","2220.7","0.6","294","2","294","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","2,2'-Bis[bis(3,5-dimethylphenyl)phosphinoyl]-5,5',6,6',7,7',8,8'-Octahydro -1,1'-Binaphthyl","","- C52 H56 O2 P2 -","- C52 H56 O2 P2 -","- C104 H112 O4 P4 -","2","0.5","OB6106","Guo, Rongwei; Wu, Jing; Kowk, Waihim; Chen, Jian; Choi, Michael C. K.; Zhou, Zhongyuan","(<i>S</i>)-2,2'-Bis[bis(3,5-dimethylphenyl)phosphinoyl]-5,5',6,6',7,7',8,8'-octahydro-1,1'-binaphthyl","Acta Crystallographica Section E","2002","58","3","o270","o271","10.1107/S1600536802001010","","","0.71073","MoKα","","0.0904","0.0487","","","0.1126","0.1278","","","","","","0.925","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200953","9.066","0.0006","18.5382","0.0013","15.9779","0.0011","90","","97.785","0.002","90","","2660.6","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,3,5-Tris(phenylthiomethyl)-2,4,6-Trimethylbenzene","","- C30 H30 S3 -","- C30 H30 S3 -","- C120 H120 S12 -","4","1","OB6107","Jian-Rong Li; Yan, Zheng; Miao Du; Ya-Bo Xie; Ruo-Hua Zhang; Xian-He Bu","1,3,5-Tris(phenylthiomethyl)-2,4,6-trimethylbenzene","Acta Crystallographica Section E","2002","58","3","o243","o244","10.1107/S1600536802001824","","","0.71073","MoKα","","","0.0543","","","0.1254","0.1596","","","","","","1.024","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200954","24.767","0.003","6.2051","0.001","14.1446","0.0015","90","","119.55","0.05","90","","1891","1","150","","150","","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C20 H36 O3 -","- C20 H36 O3 -","- C80 H144 O12 -","4","1","OB6108","Kooijman, Huub; Spek, Anthony L.","(1<i>S</i>,3<i>R</i>,4<i>R</i>,4a<i>S</i>,8a<i>S</i>)-4-[(3<i>S</i>)-3-Hydroxy-3-methyl-4-pentenyl]-3,4a,8,8-tetramethyldecahydro-1,3-naphthalenediol","Acta Crystallographica Section E","2002","58","2","o172","o174","10.1107/S1600536802000727","","","0.71073","MoKα","","0.0564","0.0546","","","0.1066","0.1074","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200955","11.4829","0.0003","14.5419","0.0003","15.7595","0.0004","90","","90","","90","","2631.57","0.11","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","[(2R,5S)-2,5-Bis(4-nitrophenyl)perhydrofuro[2,3-b]furan-3-yl]triisopropylsilane","","- C27 H36 N2 O6 Si -","- C27 H36 N2 O6 Si -","- C108 H144 N8 O24 Si4 -","4","1","OB6109","Light, Mark E.; Hursthouse, Michael B.","[(2<i>R</i>,5<i>S</i>)-2,5-Bis(4-nitrophenyl)perhydrofuro[2,3-<i>b</i>]furan-3-yl]triisopropylsilane","Acta Crystallographica Section E","2002","58","3","o252","o253","10.1107/S1600536802001137","","","0.71073","MoKα","","0.0421","0.0342","","","0.0781","0.0812","","","","","","1.077","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200956","14.6339","0.0003","7.7463","0.0001","35.8752","0.0007","90","","91.066","0.003","90","","4066.06","0.13","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Triisopropyl[5-(4-nitrophenyl)tetrahydrofuran-3-ylidenemethyl]silane","","- C20 H31 N O3 Si -","- C20 H31 N O3 Si -","- C160 H248 N8 O24 Si8 -","8","1","OB6110","Light, Mark E.; Hursthouse, Michael B.","Triisopropyl[5-(4-nitrophenyl)tetrahydrofuran-3-ylidenemethyl]silane","Acta Crystallographica Section E","2002","58","2","o202","o203","10.1107/S1600536802001228","","","0.71073","MoKα","","0.2006","0.0824","","","0.1955","0.254","","","","","","0.969","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200957","12.98","0.007","8.482","0.005","14.189","0.008","90","","110.165","0.009","90","","1466.4","1.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,2‒diethyl‒3‒hydroxy‒6‒phenylthio‒4(1H)‒pyridinone","","- C15 H17 N O2 S -","- C15 H17 N O2 S -","- C60 H68 N4 O8 S4 -","4","1","OB6111","Xie, Wen-Lin; Chen, Cai-Hong; Ma, Lin; Gu, Lian-Quan","1,2-Diethyl-3-hydroxy-6-phenylthiopyridin-4(1<i>H</i>)-one","Acta Crystallographica Section E","2002","58","2","o175","o177","10.1107/S1600536802000983","","","0.71073","MoKα","","0.0685","0.0465","","","0.1133","0.127","","","","","","1.057","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200958","10.1959","0.0009","14.443","0.003","15.8359","0.0015","90","","90","","90","","2332","0.6","293","","293","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C20 H23 Cl2 N3 O3 Zn2 -","- C20 H23 Cl2 N3 O3 Zn2 -","- C80 H92 Cl8 N12 O12 Zn8 -","4","1","OB6112","Leyla Tatar; Atakol, Orhan; Ülkü, Dinçer","{[μ-<i>N,N</i>'-Bis(salicylidene)-1,3-propanediaminato-<i>N,N</i>'-dimethylformamide]zinc(II)}dichlorozinc(II)","Acta Crystallographica Section E","2002","58","3","m83","m85","10.1107/S1600536802001678","","","0.71073","MoKα","","0.0339","0.0294","","","0.0874","0.0897","","","","","","1.109","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2200959","12.2735","0.0017","34.237","0.007","6.2739","0.0008","90.224","0.014","93.705","0.01","91.576","0.014","2629.8","0.7","293","2","293","2","","","","","","","","3","P 1","P 1","1","Cholesterol hemimethanolate","","","- C27.5 H48 O1.5 -","- C27.5 H48 O1.5 -","- C110 H192 O6 -","4","4","OM6071","Shieh, Huey-Sheng; Nordman, Christer E.","Cholesterol hemimethanol solvate","Acta Crystallographica Section E","2002","58","1","o79","o80","10.1107/S1600536801020487","","","1.5418","CuKα","","0.0671","0.0535","","","0.0991","0.1019","","","","","","2.085","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2200960","38.354","0.001","11","0.001","22.689","0.001","90","","123.15","0.01","90","","8014.4","1.2","153","2","153","2","","","","","","","","5","C 1 2 1","C 2y","5","","boc-Metkephamid-OMe","","- C35 H51 N5 O10.125 S -","- C35 H51 N5 O10.125 S -","- C280 H408 N40 O81 S8 -","8","2","OM6072","Deschamps, Jeffrey R.; Flippen-Anderson, Judith L.; Brine, George A.; Hayes, James P.; George, Clifford","Boc-tyrosyl-<small>D</small>-alanyl-glycyl-<i>N</i>-methyl-phenylalanyl-<i>O</i>-methyl-methionine hydrate: a protected analog of metkephamid","Acta Crystallographica Section E","2002","58","1","o13","o15","10.1107/S1600536801020475","","","1.54178","CuKα","","0.0538","0.0431","","","0.1041","0.1117","","","","","","1.008","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200961","6.4111","0.0009","23.169","0.003","6.8348","0.0009","90","","106.377","0.002","90","","974","0.2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H9 Cu N O7 -","- C7 H9 Cu N O7 -","- C28 H36 Cu4 N4 O28 -","4","1","OM6073","Blake, Alexander J.; Felloni, Marina; Hubberstey, Peter; Schröder, Martin; Wilson, Claire","Triaqua(2,6-pyridinedicarboxylato)copper(II) at 150K","Acta Crystallographica Section E","2002","58","2","m43","m46","10.1107/S160053680102164X","","","0.71073","MoKα","","0.023","0.021","","","0.06","0.061","","","","","","1.151","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2200962","13.3725","0.0004","9.7045","0.0003","8.92","0.0002","90","","90","","90","","1157.58","0.06","150","1","150","1","","","","","","","","5","P c a 21","P 2c -2ac","29","","(E)-2-Styryl-[1,3,6,2]dioxazaborolane","","- C12 H16 B N O2 -","- C12 H16 B N O2 -","- C48 H64 B4 N4 O8 -","4","1","OM6074","Thadani, Avinash N.; Batey, Robert A.; Lough, Alan J.; Smil, David V.","(<i>E</i>)-2-Styryl-[1,3,6,2]dioxazaborolane","Acta Crystallographica Section E","2002","58","3","o238","o239","10.1107/S1600536802001691","","","0.71073","MoKα","","0.034","0.0302","","","0.0777","0.0798","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200963","9.3198","0.0017","23.416","0.002","15.838","0.003","90","","91.333","0.009","90","","3455.4","1","233","","233","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","(9,10-triptyceno)benzo-28-crown-8","","","- C40 H44 O8 -","- C40 H44 O8 -","- C160 H176 O32 -","4","1","OM6075","Jeffrey C. Bryan; Andrei A. Gakh; Richard A. Sachleben","(9,10-Triptyceno)benzo-28-crown-8","Acta Crystallographica Section E","2002","58","2","o129","o131","10.1107/S1600536802000302","","","0.71073","MoKα","","0.129","0.048","","","0.111","0.134","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200964","10.283","0.003","8.124","0.002","11.757","0.004","90","","113.673","0.011","90","","899.5","0.5","120","","120","","","","","","","","","4","P 1 21 1","P 2yb","4","","1-Benzoyl-2(S)-tert-butyl-4-methoxy-6(S)-carbomethoxy-1,2,5,6-tetrahydro- 1,3-pyrimidine","","- C18 H24 N2 O4 -","- C18 H24 N2 O4 -","- C36 H48 N4 O8 -","2","1","OM6076","Giraldés, José; McLaughlin, Mark L.; Fronczek, Frank R.","1-Benzoyl-2(<i>S</i>)-<i>tert</i>-butyl-4-methoxy-6(<i>S</i>)-carbomethoxy-1,2,5,6-tetrahydro-1,3-pyrimidine: a useful precursor of α-alkylated aspartic acids","Acta Crystallographica Section E","2002","58","3","o261","o262","10.1107/S1600536802002210","","","0.71073","MoKα","","0.052","0.039","","","0.082","0.088","","","","","","1.032","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200965","10.4567","0.0004","15.6672","0.0007","17.0037","0.0007","90","","105.576","0.001","90","","2683.37","0.19","223","2","223","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C26 H31 Au N O3 P S2 -","- C26 H31 Au N O3 P S2 -","- C104 H124 Au4 N4 O12 P4 S8 -","4","1","OM6078","Ho, Soo Yei; Tiekink, Edward R. T.","(<i>N,N</i>-Diethyldithiocarbamato)[tris(<i>p</i>-methoxyphenyl)phosphine]gold(I)","Acta Crystallographica Section E","2002","58","3","m86","m87","10.1107/S1600536802002064","","","0.71069","MoKα","","0.045","0.033","","","0.073","0.078","","","","","","1.02","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2200966","12.6115","0.0013","20","0.003","19.995","0.003","90","","107.087","0.009","90","","4820.7","1.2","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","tetra-t-butylcalix[4]arene-1,2-crown-4 N,N-dimethylformamide","","","- C53 H73 N O7 -","- C53 H73 N O7 -","- C212 H292 N4 O28 -","4","1","OM6080","Jeffrey C. Bryan; Tatiana G. Levitskaia","A tetra-<i>tert</i>-butylcalix[4]arene-12-crown-4 <i>N,N</i>-dimethylformamide inclusion complex","Acta Crystallographica Section E","2002","58","3","o240","o242","10.1107/S1600536802002076","","","0.71073","MoKα","","0.119","0.058","","","0.146","0.171","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200967","12.2381","0.0009","21.8866","0.0015","10.3089","0.0007","90","","113.69","0.001","90","","2528.6","0.3","170","2","170","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C32 H36 O2 -","- C32 H35.886 O2.114 -","- C128 H143.544 O8.456 -","4","1","TK6043","Robert B. Bates; S. V. Bhatwadekar; Zackary D. Crane; Christopher W. Dicus; S. K. Paknikar; Hugh D. Selby; Bilal A. Sufi","6,7-<i>cis</i>-7,8-<i>trans</i>-3,3-Dimethyl-7-(5,5-dimethyl-3-oxo-1-cyclohexenyl)-6,8-diphenyl-1,2,3,4,5,6,7,8-octahydronaphthalen-1-one","Acta Crystallographica Section E","2002","58","1","o18","o19","10.1107/S1600536801020281","","","0.71073","MoKα","","0.141","0.047","","","0.104","0.139","","","","","","0.94","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2200968","16.0939","0.0014","10.3961","0.0012","13.6382","0.0013","90","","100.196","0.009","90","","2245.8","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis(diisopropylammonium) hexachloroiridate(IV)","","- C12 H32 Cl6 Ir N2 -","- C12 H32 Cl6 Ir N2 -","- C48 H128 Cl24 Ir4 N8 -","4","1","TK6045","Guido J. Reiß","The pseudosymmetric structure of bis(diisopropylammonium) hexachloroiridate(IV) and its relationship to potassium hexachloroiridate(III)","Acta Crystallographica Section E","2002","58","2","m47","m50","10.1107/S1600536802000417","","","0.71073","MoKα","","0.046","0.034","","","0.083","0.094","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200969","13.441","0.001","4.876","0.0004","15.47","0.002","90","","97.12","0.01","90","","1006.06","0.17","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","L-phenylalanine L-phenylalanium dihydrogen phosphate","L-phenylalanine L-phenylalanium dihydrogen phosphate","","- C18 H25 N2 O8 P -","- C18 H25 N2 O8 P -","- C36 H50 N4 O16 P2 -","2","1","TK6046","Ravikumar, B.; Sridhar, B.; Rajaram, R.K.","<small>L</small>-Phenylalanine <small>L</small>-phenylalaninium dihydrogenphosphate","Acta Crystallographica Section E","2002","58","2","o123","o125","10.1107/S1600536802000090","","","0.71073","MoKα","","0.172","0.063","","","0.135","0.184","","","","","","0.97","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200970","7.872","0.002","7.56","0.002","19.836","0.002","90","","101.03","0.01","90","","1158.7","0.4","296.2","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C10 H16 O7 -","- C10 H16 O7 -","- C40 H64 O28 -","4","1","TK6047","Okabe, Nobuo; Kyoyama, Hasuyo","Propyl gallate dihydrate","Acta Crystallographica Section E","2002","58","3","o245","o247","10.1107/S1600536802002015","","","0.7107","MoKα","","","0.046","","","","0.175","","","","","","0.92","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200971","11.6756","0.0001","11.6756","0.0001","10.503","0.0001","90","","90","","90","","1431.77","0.02","203","2","203","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","Bis[cyclopentadienyl(dicarbonyl)iron]mercury(II)","","- C14 H10 Fe2 Hg O4 -","- C14 H10 Fe2 Hg O4 -","- C56 H40 Fe8 Hg4 O16 -","4","0.5","TK6048","McIndoe, J. Scott; Nicholson, Brian K.","Bis[dicarbonyl(cyclopentadienyl)ferrio]mercury(II)","Acta Crystallographica Section E","2002","58","2","m53","m54","10.1107/S1600536802000818","","","0.71073","MoKα","","0.038","0.037","","","0.1","0.1","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200972","22.758","0.011","7.16","0.007","5.422","0.002","90","","91.88","0.03","90","","883","1","295","","295","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","[(phenylmethyl)sulphonyl]methanol","","- C8 H10 O3 S -","- C8 H10 O3 S -","- C32 H40 O12 S4 -","4","1","TK6049","Healy, Peter C.; Loughlin, Wendy A.; Sweeney, Bláithín M.; Jenkins, Ian D.","(Benzylsulfonyl)methanol","Acta Crystallographica Section E","2002","58","2","o137","o138","10.1107/S1600536802000429","","","0.71069","MoKα","","0.064","0.036","","","0.09","0.101","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200973","14.766","0.005","11.214","0.004","12.089","0.004","90","","102.51","0.03","90","","1954.2","1.2","295","","295","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","1,1-Dibenzyl-6-methoxy-3,4-dihydro-1H-naphthalen-2-one","","- C25 H24 O2 -","- C25 H24 O2 -","- C100 H96 O8 -","4","1","TK6050","Christopher L. Brown; Sarah J. Head; Peter C. Healy","1,1-Dibenzyl-6-methoxy-3,4-dihydro-1<i>H</i>-naphthalen-2-one","Acta Crystallographica Section E","2002","58","2","o178","o179","10.1107/S1600536802000715","","","0.71069","MoKα","","0.105","0.052","","","0.146","0.174","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200974","30.0282","0.0004","8.9226","0.0001","12.1979","0.0002","90","","104.884","0.001","90","","3158.52","0.08","123","2","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C19 H16 O5 -","- C19 H16 O5 -","- C152 H128 O40 -","8","1","TK6052","Greatrex, Ben W.; Kimber, Marc C.; Taylor, Dennis K.; Fallon, Gary D.","(±)-2-Oxo-4-(2-oxo-2-phenylethyl)-5-phenyltetrahydrofuran-3-carboxylic acid","Acta Crystallographica Section E","2002","58","3","o298","o299","10.1107/S1600536802001617","","","0.71073","MoKα","","","0.045","","","","0.096","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200975","14.2248","0.0011","9.167","0.0005","59.834","0.005","90","","90.38","0.009","90","","7802.1","1","153","2","153","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","decacarbonyl-1κ^4^C,2κ^3^C,3κ^3^C-μ-hydrido-2:3κ^2^H:H-μ-pyrazolyl- 2:3κ^2^N^1^:N^2^-triangulo-triruthenium","","- C14.5 H7 N2 O10 Ru3 -","- C14.5 H7 N2 O10 Ru3 -","- C232 H112 N32 O160 Ru48 -","16","2","TK6053","Lozano Diz, Enrique; Neels, Antonia; Therrien, Bruno; Stoeckli-Evans, Helen; Süss-Fink, Georg","A cluster containing a pyrazole ligand: [Ru~3~(μ-H)(μ-N~2~C~3~H~3~)(CO)~10~]","Acta Crystallographica Section E","2002","58","3","m110","m112","10.1107/S1600536802002957","","","0.71073","MoKα","","0.044","0.041","","","0.106","0.107","","","","","","1.36","","","","has coordinates,has Fobs","194596","2020-10-21","18:00:00",""
"2200976","8.119","0.003","21.373","0.006","10.249","0.003","90","","98.071","0.004","90","","1760.9","1","168","2","168","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[N-(2-aminoethyl)-1,2-ethanediamine]azido(2-hydroxy-1,3-propanediamine)cobalt tetrachlorozinc","","- C7 H23 Cl4 Co N8 O Zn -","- C7 H23 Cl4 Co N8 O Zn -","- C28 H92 Cl16 Co4 N32 O4 Zn4 -","4","1","TK6054","Browne, Rebecca J.; Buckingham, David A.; Blackman, Allan G.; Clark, Charles R.","unsym-<i>fac</i>-(<i>exo</i>-OH)-[Co(dien)(dapo)(N~3~)][ZnCl~4~]","Acta Crystallographica Section E","2002","58","3","m125","m126","10.1107/S1600536802003070","","","0.71073","MoKα","","0.036","0.027","","","0.059","0.061","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200977","10.371","0.005","8.9735","0.0019","16.556","0.006","90","","92.33","0.04","90","","1539.5","1","295","1","295","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2-bromophenyl)diphenylphosphine","","- C18 H14 Br P -","- C18 H14 Br P -","- C72 H56 Br4 P4 -","4","1","TK6055","Michael L. Williams; Cassandra L. Noack; Rodney J. Saverin; Peter C. Healy","(2-Bromophenyl)diphenylphosphine","Acta Crystallographica Section E","2002","58","3","o306","o307","10.1107/S1600536802002945","","","0.7107","MoKα","","0.122","0.043","","","0.113","0.15","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200978","10.439","0.002","17.361","0.003","15.555","0.002","90","","92.74","0.01","90","","2815.8","0.8","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-phenyl-2-phenylsulfinyl-cyclobutan-1-ol","","- C16 H16 O2 S -","- C16 H16 O2 S -","- C128 H128 O16 S8 -","8","2","TK6056","Wendy A. Loughlin; Catherine C. Rowen; Zane D. van den Berg; Peter C. Healy","1-Phenyl-2-phenylsulfinylcyclobutan-1-ol","Acta Crystallographica Section E","2002","58","3","o303","o305","10.1107/S1600536802002878","","","0.7107","MoKα","","0.1296","0.0469","","","0.1102","0.1375","","","","","","0.999","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200979","16.246","0.003","8.145","0.002","16.992","0.004","90","","90","","90","","2248.4","0.9","296","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Cloro(1,5-Cyclooctadiene)Triphenylphosphiterhodium(I)","","- C26 H27 Cl P Rh -","- C26 H27 Cl P Rh -","- C104 H108 Cl4 P4 Rh4 -","4","1","WN6068","Horn, Qingyi L.; Jones, Daniel S.; Evans, Robin N.; Ogle, Craig A.; Masterman, T. Craig","Chloro(1,5-cyclooctadiene)(triphenylphosphine)rhodium(I)","Acta Crystallographica Section E","2002","58","2","m51","m52","10.1107/S1600536802000077","","","0.71073","MoKα","","","0.036","","","","0.046","","","","","","2.18","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200980","7.62","0.0001","9.5052","0.0001","10.3956","0.0002","107.553","0.001","99.684","0.001","113.209","0.001","623.386","0.019","200","2","200","2","","","","","","","","5","P -1","-P 1","2","Methyl 1'-acetamidoferrocene-1-carboxylate","Methyl 1'-acetamidoferrocene-1-carboxylate","","- C14 H15 Fe N O3 -","- C14 H15 Fe N O3 -","- C28 H30 Fe2 N2 O6 -","2","1","WN6071","Pavlović, Gordana; Barišić, Lidija; Rapić, Vladimir; Leban, Ivan","Ferrocene compounds. XXX. Methyl 1'-acetamidoferrocene-1-carboxylate","Acta Crystallographica Section E","2002","58","1","m13","m15","10.1107/S1600536801020451","","","0.71073","MoKα","","0.0237","0.0221","","","0.056","0.057","","","","","","1.037","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2200981","11.5487","0.001","11.857","0.001","15.0238","0.001","97.493","0.01","109.989","0.01","109.776","0.01","1747.5","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H19 Cl2 N8 O12 P3 -","- C28 H19 Cl2 N8 O12 P3 -","- C56 H38 Cl4 N16 O24 P6 -","2","1","WN6072","Öztürk, Levent; Hökelek, Tuncer; Dal, Hakan; Kılıç, Zeynel","2,2-[2,2'-Methylenebis(4-nitrophenoxy)]-4,6-[2,2'-methylenebis(4-nitrophenoxy)]-4,6-dichloro-1,3,5,2λ^5^,4λ^5^,6λ^5^-triazatriphosphorine (spiro-ansa) acetonitrile","Acta Crystallographica Section E","2002","58","1","o20","o23","10.1107/S1600536801020463","","","1.5418","Cukα","","0.0991","0.0667","","","0.1695","0.1939","","","","","","1.043","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200982","8.3574","0.001","9.5422","0.001","19.775","0.002","90","","96.197","0.008","90","","1567.8","0.3","293","2","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C19 H14 O6 -","- C19 H14 O6 -","- C76 H56 O24 -","4","1","WN6074","Hökelek, Tuncer; Saripinar, Emïn; Yıldırım, Ismaïl; Akkurt, Mehmet; Akçamur, Yunus","4-(4-Methoxybenzoyl)-5-(4-methoxyphenyl)-2,3-dihydro-2,3-furandione","Acta Crystallographica Section E","2002","58","1","o30","o32","10.1107/S1600536801020669","","","0.71073","MoKα","","","0.0448","","","","0.1158","","","","","","0.979","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200983","11.9017","0.0009","12.0284","0.001","18.8388","0.0011","90","","92.184","0.005","90","","2695","0.3","150","","150","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C30 H52 O2 -","- C30 H52 O2 -","- C120 H208 O8 -","4","2","WN6075","Kooijman, Huub; Spek, Anthony L.","(5α,7α)-7-Hydroxy-4,4,7-trimethylcholestan-3-one","Acta Crystallographica Section E","2002","58","1","o48","o49","10.1107/S1600536801021134","","","0.71073","MoKa","","0.1148","0.065","","","0.1177","0.1365","","","","","","1.044","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200984","7.2919","0.001","9.0198","0.001","19.583","0.002","90","","92.798","0.009","90","","1286.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H15 N O2 -","- C16 H15 N O2 -","- C64 H60 N4 O8 -","4","1","WN6076","Hökelek, Tuncer; Patır, Süleyman; Ergün, Yavuz; Okay, Gürol","Ethyl 4-methyl-9<i>H</i>-carbazole-3-carboxylate","Acta Crystallographica Section E","2002","58","2","o206","o208","10.1107/S1600536801021833","","","1.5418","CuKα","","0.1115","0.0647","","","0.1624","0.2002","","","","","","0.926","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200985","10.0139","0.0019","10.26","0.0019","11.984","0.009","105.93","0.03","109.17","0.05","92.5","0.02","1106.1","1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","trimethoprim salicylate methanol solvate","","","- C22 H28 N4 O7 -","- C22 H28 N4 O7 -","- C44 H56 N8 O14 -","2","1","WN6077","Panneerselvam, Pathus; Stanley, Nithianantham; Thomas Muthiah, Packianathan","N—H···N hydrogen bonds in trimethoprim salicylate methanol solvate [trimethoprim is 2,4-diamino-5-(3,4,5-trimethoxybenzyl)pyrimidine]","Acta Crystallographica Section E","2002","58","2","o180","o182","10.1107/S1600536802000909","","","0.71073","MoKα","","0.0839","0.0633","","","0.2038","0.2163","","","","","","1.648","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200986","7.9703","0.0016","12.128","0.002","14.121","0.003","79.14","0.03","83.06","0.03","77.29","0.03","1303.2","0.5","120","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C27 H36 N2 O6 Si -","- C27 H36 N2 O6 Si -","- C54 H72 N4 O12 Si2 -","2","1","WN6079","Coles, Simon J.; Hursthouse, Michael B.","[(2<i>R</i>,5<i>R</i>)-2,5-Bis(4-nitrophenyl)perhydrofuro[2,3-<i>b</i>]furan-3-yl]triisopropylsilane","Acta Crystallographica Section E","2002","58","2","o204","o205","10.1107/S1600536802001149","","","0.71073","MoKα","","","0.045","","","","0.1278","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200987","7.6752","0.0003","16.2561","0.0006","16.0299","0.0006","90","","93.365","0.001","90","","1996.58","0.13","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H20 Cl Cu2 N6 O4 -","- C12 H20 Cl Cu2 N6 O4 -","- C48 H80 Cl4 Cu8 N24 O16 -","4","1","WN6080","Guido Kickelbick; Thomas Gallauner","A mixed copper(I)/copper(II) complex coordinated by a multidentate amidato ligand","Acta Crystallographica Section E","2002","58","3","m102","m104","10.1107/S1600536802002519","","","0.71073","MoKα","","0.0513","0.0424","","","0.119","0.1248","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200988","15.926","0.004","8.345","0.004","10.955","0.003","90","","99.5","0.04","90","","1436","0.9","145","2","145","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-methyl-N-(prop-2-ynyl)-N-(1H-pyrrol-2-ylmethyl)-benzenesulfonamide.","","- C15 H16 N2 O2 S -","- C15 H16 N2 O2 S -","- C60 H64 N8 O8 S4 -","4","1","WN6081","Bats, Jan W.; Weyrauch, Jan P.; Hashmi, A. Stephen K.","4-Methyl-<i>N</i>-(prop-2-ynyl)-<i>N</i>-(1<i>H</i>-pyrrol-2-ylmethyl)benzenesulfonamide","Acta Crystallographica Section E","2002","58","3","o290","o292","10.1107/S1600536802002520","","","0.71073","MoKα","","0.1457","0.0665","","","0.1011","0.1173","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200989","30.706","0.001","4.786","0.0001","18.9937","0.0005","90","","108.133","0.001","90","","2652.67","0.13","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","N-(3-chlorophenyl)-2-hydroxy-1-naphthaldimine","1-[(3-chlorophenylimino)methyl]-2-naphthol","","- C17 H12 Cl N O -","- C17 H12 Cl N O -","- C136 H96 Cl8 N8 O8 -","8","1","WN6083","Pavlović, Gordana; Matijević Sosa, Julija; Vikić-Topić, Dražen; Leban, Ivan","<i>N</i>-(3-Chlorophenyl)-2-hydroxy-1-naphthaldimine at 200K","Acta Crystallographica Section E","2002","58","3","o317","o320","10.1107/S1600536802003057","","","0.71073","MoKα","","0.055","0.0411","","","0.0996","0.109","","","","","","1.037","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2200990","9.4019","0.0005","9.4019","0.0005","7.4051","0.0004","90","","90","","90","","654.58","0.06","298","2","298","2","","","","","","","","4","P -4 21 c","P -4 2n","114","Tetrakis(iodomethyl)tin","Tetrakis(iodomethyl)stannane","","- C4 H8 I4 Sn -","- C4 H8 I4 Sn -","- C8 H16 I8 Sn2 -","2","0.25","WN6084","Howie, R. Alan; Skakle, Janet M. S.; Wardell, James L.","Tetrakis(iodomethyl)stannane","Acta Crystallographica Section E","2002","58","3","m105","m106","10.1107/S160053680200274X","","","0.71073","MoKα","","0.0426","0.0379","","","0.1022","0.1046","","","","","","1.079","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200991","8.5449","0.0004","14.3779","0.0007","23.27","0.0012","83.131","0.003","80.554","0.003","89.963","0.003","2799.4","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","GBR12909","","","- C28 H34 Cl2 F2 N2 O -","- C28 H34 Cl2 F2 N2 O -","- C112 H136 Cl8 F8 N8 O4 -","4","2","WW6000","Flippen-Anderson, Judith L.; Deschamps, Jeffrey R; George, Clifford; Folk, John E.; Jacobson, Arthur E.; Rice, Kenner C.","Twinned 1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(3-phenyl)propyl)piperazinium chloride (GBR12909)","Acta Crystallographica Section E","2002","58","1","o81","o82","10.1107/S1600536801021389","","","1.54178","CuKα","","0.0803","0.0654","","","0.1776","0.1898","","","","","","0.965","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200992","10.6183","0.0011","10.6183","0.0011","39.629","0.006","90","","90","","90","","4468.1","0.9","294","2","294","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","(R)-N,N'-bis(3,5-di-tert-butylsalicylidene)-5,5',6,6',7,7',8,8'-octahydro- 1,1'-binaphthyl-2,2'-diamine","","- C50 H64 N2 O2 -","- C50 H64 N2 O2 -","- C200 H256 N8 O8 -","4","0.5","WW6003","Jia, Xian; Li, Xingshu; Zhou, Zhongyuan","A new chiral Schiff base: (<i>R</i>)-<i>N,N</i>'-bis(3,5-di-<i>tert</i>-butylsalicylidene)-5,5',6,6',7,7',8,8'-octahydro-1,1'-binaphthyl-2,2'-diamine","Acta Crystallographica Section E","2002","58","2","o183","o184","10.1107/S160053680200082X","","","0.71073","MoKα","","0.1892","0.053","","","0.1202","0.1488","","","","","","0.998","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2200993","13.113","0.001","20.926","0.002","10.6378","0.0008","90","","90","","90","","2919","0.4","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C26 H28 Cl4 Cu2 N6 -","- C26 H28 Cl4 Cu2 N6 -","- C104 H112 Cl16 Cu8 N24 -","4","0.5","WW6004","Yoon, Doo-Cheon; Oh, Chang-Eon; Lee, Uk","[μ-<i>N,N,N</i>',<i>N</i>'-Tetrakis(2-pyridylmethyl)-1,2-ethanediamine]bis[dichlorocopper(II)]","Acta Crystallographica Section E","2002","58","3","m113","m115","10.1107/S1600536802002866","","","0.71073","MoKα","","0.0992","0.0567","","","0.1117","0.1359","","","","","","1.162","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2200994","11.2035","0.0015","9.2977","0.0013","22.738","0.003","90","","90","","90","","2368.5","0.6","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1-Acetamido-1-(1-naphthyl)ethylene","","- C14 H13 N O -","- C14 H13 N O -","- C112 H104 N8 O8 -","8","1","WW6005","Jia, Xian; Li, Xingshu; Zhou, Zhongyuan; Guo, Rongwei; Chen, Yubin; Yao, Xinsheng","1-Acetamido-1-(1-naphthyl)ethylene","Acta Crystallographica Section E","2002","58","3","o250","o251","10.1107/S1600536802001988","","","0.71073","MoKα","","0.1166","0.0469","","","0.1264","0.1541","","","","","","1.002","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2200995","8.0792","0.0001","10.6879","0.0002","24.5704","0.0005","90","","90","","90","","2121.65","0.06","123","2","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C11 H14 O5 -","- C11 H14 O5 -","- C88 H112 O40 -","8","1","WW6006","Greatrex, Ben W.; Kimber, Marc C.; Taylor, Dennis K.; Fallon, Gary D.","(±)-2,5-Dioxoperhydrocycloocta[<i>b</i>]furan-3-carboxylic acid","Acta Crystallographica Section E","2002","58","3","o248","o249","10.1107/S1600536802001964","","","0.71073","MoKα","","","0.0429","","","","0.0954","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200996","10.195","0.0002","10.6379","0.0002","14.5447","0.0003","69.371","0.001","71.536","0.001","89.67","0.001","1390.3","0.05","123","2","","","","","","","","","","6","P -1","-P 1","2","","","","- C24 H36 F6 N O8 P -","- C24 H36 F6 N O8 P -","- C48 H72 F12 N2 O16 P2 -","2","1","WW6007","Fallon, Gary D.; Lau, Vei-Lin; Langford, Steven J.","Ammonium 2,5,8,11,21,24,27-octaoxatricyclo[26.4.0.0^12,17^]dotriaconta-1(32),12(17),13,15,28,30-hexaene hexafluorophosphate","Acta Crystallographica Section E","2002","58","3","o321","o323","10.1107/S1600536802003100","","","0.71073","MoKα","","","0.0508","","","","0.1325","","","","","","0.974","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2200997","9.278","0.002","14.05","0.004","8.938","0.002","90","","111.21","0.03","90","","1086.2","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-ethyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxylic acid","","- C12 H11 N O4 -","- C12 H11 N O4 -","- C48 H44 N4 O16 -","4","1","YA6069","Shishkina, Svetlana V.; Shishkin, Oleg V.; Ukrainets, Igor V.; Abdel Naser Dakkah; Sidorenko, Lyudmila V.","1-Ethyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxylic acid","Acta Crystallographica Section E","2002","58","3","o254","o256","10.1107/S1600536801021857","","","0.71073","MoKα","","0.08","0.038","","","0.105","0.116","","","","","","0.97","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200998","9.2223","0.0002","6.3266","0.0001","23.4991","0.0004","90","","93.6067","0.0007","90","","1368.36","0.04","123","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H11 N3 O7 -","- C13 H11 N3 O7 -","- C52 H44 N12 O28 -","4","1","YA6072","Moreno-Fuquen, Rodolfo; Zambrano, Martha Lucía; Grajales-Tamayo, Mario; Zukerman-Schpector, Julio; Kennedy, Alan R.","The 1:1 complex of 3,5-dinitrobenzoic acid and 4-methylpyridine <i>N</i>-oxide","Acta Crystallographica Section E","2002","58","1","o50","o52","10.1107/S160053680102089X","","","0.71073","MoKα","","","0.035","","","0.092","0.095","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200999","13.632","0.003","17.956","0.004","16.489","0.003","90","","94.938","0.004","90","","4021.1","1.5","120","","120","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H45.502 Cl4 Fe2 N8 O9.751 -","- C32 H45.502 Cl4 Fe2 N8 O9.751 -","- C128 H182.008 Cl16 Fe8 N32 O39.004 -","4","1","YA6079","Rune Kirk Egdal; Alan Hazell; Christine J. McKenzie","μ-Oxo-bis{chloro[<i>N</i>,<i>N</i>'-dimethyl-<i>N</i>,<i>N</i>'-bis(2-pyridylmethyl)ethane-1,2-diamine]iron(III)} diperchlorate 0.751-hydrate","Acta Crystallographica Section E","2002","58","1","m10","m12","10.1107/S1600536801020542","","","0.71073","MoKα","","","0.032","","","","0.034","","","","","","0.88","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2201000","9.4745","0.0008","11.9101","0.0007","15.8212","0.001","90","","90","","90","","1785.3","0.2","153","2","153","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N,N'-dicyclohexyl-N-(2-pyrazinoyl)urea","","- C18 H26 N4 O2 -","- C18 H26 N4 O2 -","- C72 H104 N16 O8 -","4","1","YA6080","Chérioux, Frédéric; Therrien, Bruno; Stoeckli-Evans, Helen; Süss-Fink, Georg","<i>N,N</i>'-Dicyclohexyl-<i>N</i>-(2-pyrazinoyl)urea","Acta Crystallographica Section E","2002","58","1","o27","o29","10.1107/S1600536801020839","","","0.71073","MoKα","","0.041","0.028","","","0.055","0.058","","","","","","0.9","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201001","7.0173","0.0003","10.2294","0.0004","8.7064","0.0004","90","","92.561","0.002","90","","624.35","0.05","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Aminoethyldithiocarbamic acid","","- C3 H8 N2 S2 -","- C3 H8 N2 S2 -","- C12 H32 N8 S8 -","4","1","YA6081","Yamin, Bohari M.; Kadir, Maisara A.; Zin, Mazni Zuraida M.; Usman, Anwar; Ibrahim, Abdul Razak; Fun, Hoong-Kun","<i>N</i>-(2-Aminoethyl)dithiocarbamic acid","Acta Crystallographica Section E","2002","58","3","o293","o295","10.1107/S1600536802000211","","","0.71073","MoKα","","0.072","0.054","","","0.137","0.159","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201002","5.691","0.001","7.091","0.002","8.983","0.002","81.02","0.03","81.46","0.03","69.51","0.03","333.68","0.15","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H10 Cu N8 O6 -","- C8 H10 Cu N8 O6 -","- C8 H10 Cu N8 O6 -","1","0.5","YA6082","Albada, Gerard A. van; Mutikainen, Ilpo; Turpeinen, Urho; Reedijk, Jan","Redetermination of bis(2-aminopyrimidine)bis(nitrato)copper(II)","Acta Crystallographica Section E","2002","58","2","m55","m57","10.1107/S1600536802000673","","","1.5418","CuKα","","0.034","0.034","","","0.1","0.1","","","","","","0.81","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201003","11.075","0.005","11.075","0.005","24.4","0.04","90","","90","","120","","2592","5","293","2","293","2","","","","","","","","5","P 61","P 61","169","","3-acetoxymethyl-7-chloro-1,3-dihydro-1-methyl-5-phenyl- 2H-1,4-benzodiazepin-2-one","","- C19 H17 Cl N2 O3 -","- C19 H17 Cl N2 O3 -","- C114 H102 Cl6 N12 O18 -","6","1","YA6083","Višnjevac, Aleksandar; Avdagić, Amir; Kojić-Prodić, Biserka","3(<i>S</i>)-Acetoxymethyl-7-chloro-1,3-dihydro-1-methyl-5-phenyl-2<i>H</i>-1,4-benzodiazepin-2-one","Acta Crystallographica Section E","2002","58","2","o148","o150","10.1107/S1600536802000338","","","0.71069","MoKα","","0.221","0.052","","","0.114","0.154","","","","","","0.97","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201004","13.8222","0.0014","5.8033","0.0006","25.24","0.003","90","","99.663","0.004","90","","1995.9","0.4","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Cinnamoylacetone","6-phenylhex-5-ene-2,3-dione","","- C12 H12 O2 -","- C12 H12 O2 -","- C96 H96 O16 -","8","2","YA6084","Arrieta, Antonio F.; Arvid Mostad","Monoclinic form of 6-phenylhex-5-ene-2,4-dione","Acta Crystallographica Section E","2002","58","2","o188","o190","10.1107/S1600536802000995","","","0.71073","MoKα","","0.096","0.07","","","0.203","0.228","","","","","","1.08","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201005","24.244","0.008","6.8638","0.0003","10.415","0.003","90","","110.54","0.01","90","","1622.9","0.7","295","2","295","2","","","","","","","","5","C 1 2 1","C 2y","5","","Pyridinium D(+)-10-camphorsulfonate hemihydrate","","- C15 H22 N O4.5 S -","- C15 H22 N O4.5 S -","- C60 H88 N4 O18 S4 -","4","1","YA6085","Fleischer, Holger; Schollmeyer, Dieter","Pyridinium <small>D</small>(+)-10-camphorsulfonate hemihydrate","Acta Crystallographica Section E","2002","58","2","o209","o210","10.1107/S1600536802001150","","","1.54178","CuKα","","0.059","0.051","","","0.14","0.149","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201006","4.0352","0.001","17.71","0.004","11.007","0.003","90","","92.31","0.01","90","","786","0.3","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,6-dibromo-4-fluorobenzonitrile","","- C7 H2 Br2 F N -","- C7 H2 Br2 F N -","- C28 H8 Br8 F4 N4 -","4","1","YA6086","Britton, Doyle; Noland, Wayland E.; Henke, Tanya K.","2,6-Dibromo-4-fluorobenzonitrile","Acta Crystallographica Section E","2002","58","2","o185","o187","10.1107/S1600536802000879","","","0.71073","MoKα","","0.053","0.036","","","0.084","0.089","","","","","","0.95","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201007","12.536","0.002","12.596","0.002","13.306","0.002","79.09","0.01","62.05","0.01","65.88","0.01","1693.9","0.5","293","2","293","2","","","","","","","","5","P 1","P 1","1","Bis(L-glutamic acid) sulfate hemihydrate","Bis(L-glutamic acid) sulfate hemihydrate","","- C10 H21 N2 O12.5 S -","- C10 H21 N2 O12.5 S -","- C40 H84 N8 O50 S4 -","4","4","YA6087","B. Sridhar; N. Srinivasan; R. K. Rajaram","Bis(<small>L</small>-glutamic acid) sulfate hemihydrate","Acta Crystallographica Section E","2002","58","3","o272","o276","10.1107/S1600536802002234","","","0.71073","MoKα","","0.037","0.033","","","0.085","0.087","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201008","8.481","0.002","18.196","0.005","11.265","0.003","90","","99.361","0.005","90","","1715.3","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-(5-Phenylseleno)pentylphthalimide","","- C19 H19 N O2 Se -","- C19 H19 N O2 Se -","- C76 H76 N4 O8 Se4 -","4","1","YA6089","Wan-Xuan Zhang; Hai-Tao Yu; Dong-Ren Bai; Ji-Ben Meng","<i>N</i>-(5-Phenylseleno)pentylphthalimide","Acta Crystallographica Section E","2002","58","3","o345","o346","10.1107/S1600536802002246","","","0.71073","MoKα","","0.077","0.035","","","0.081","0.098","","","","","","0.94","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201009","5.4814","0.0011","14.79","0.003","9.409","0.002","90","","90.064","0.003","90","","762.8","0.3","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Li(CF3SO3)(CH3CN)","lithium triflate acetonitrile adduct","","- C3 H3 F3 Li N O3 S -","- C3 H3 F3 Li N O3 S -","- C12 H12 F12 Li4 N4 O12 S4 -","4","1","AC6002","Brooks, Neil R.; Henderson, Wesley A.; Smyrl, William H.","Lithium trifluoromethanesulfonate acetonitrile adduct","Acta Crystallographica Section E","2002","58","5","m176","m177","10.1107/S1600536802005895","","","0.71073","MoKα","","0.0224","0.0219","","","0.0604","0.0606","","","","","","1.111","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2201010","8.6451","0.0005","11.8493","0.0007","13.9227","0.0011","73.8","0.005","74.71","0.005","69.236","0.005","1258.88","0.15","293","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H15 N6 Nd O18 -","- C18 H15 N6 Nd O18 -","- C36 H30 N12 Nd2 O36 -","2","1","AC6003","Suh, Hong Ryol; Suh, Hyung Sock; Yun, Sock Sung; Lee, Eun Kwang; Kang, Sung Kwon","Triaquatris(2,6-dinitrophenolato)neodymium(III)","Acta Crystallographica Section E","2002","58","6","m284","m286","10.1107/S1600536802008267","","","0.71073","MoKα","","","0.0338","","","","0.0766","","","","","","1.063","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201011","12.842","0.008","9.831","0.008","18.063","0.006","90","","131.44","0.02","90","","1709.5","1.9","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3-Ethoxy-7-methoxycarbonyl-4-phenyl-tricyclco-[4,2,1,0-(2,5)]non-3-ene","","- C20 H22 O4 -","- C20 H22 O4 -","- C80 H88 O16 -","4","1","AC6004","Schlaf, Marcel; Jordan, Robert; Tam, William","3-Ethoxy-7-methoxycarbonyl-4-phenyltricyclo[4.2.1.0^2,5^]non-3-ene","Acta Crystallographica Section E","2002","58","6","o629","o630","10.1107/S1600536802008279","","","0.71073","MoKα","","0.0842","0.0429","","","0.1095","0.1205","","","","","","0.999","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201012","10.5996","0.0014","17.933","0.002","19.575","0.003","90","","90","","90","","3720.9","0.9","91","2","91","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","Cu(S,S)-bis(isopropyloxazoline)(trifluoromethanesulfonate)~2^.^THF","[(4S,4'S)-4,4',5,5'-Tetrahydro-4,4'-diisopropyl-2,2'- (dibenzylmethylene)dioxazole-κ^2^N,N']bis(trifluoromethanesulfonato- kO)copper(II) tetrahydrofuran solvate","","- C33 H42 Cu F6 N2 O9 S2 -","- C33 H42 Cu F6 N2 O9 S2 -","- C132 H168 Cu4 F24 N8 O36 S8 -","4","1","AC6005","C. Mariuska Reynoso-Paz; Marilyn M. Olmstead; Mark J. Kurth; Neil E. Schore","A solution phase catalyst for an enantioselective Diels‒Alder reaction","Acta Crystallographica Section E","2002","58","6","m310","m312","10.1107/S1600536802009303","","","0.71073","MoKα","","0.0349","0.0275","","","0.0617","0.0641","","","","","","1.016","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201013","7.0022","0.0009","8.3634","0.0011","9.0114","0.0012","90","","113.6","0.009","90","","483.59","0.11","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- Co2 O7 P2 -","- Co2 O7 P2 -","- Co8 O28 P8 -","4","1","","El Bali, Brahim; Bolte, Michael","Rerefinement of cobalt diphosphate against new intensity data","Acta Crystallographica, Section E","2002","58","","i32","i33","10.1107/S1600536802005342","","","","","","","","","","","","","","","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201014","4.2527","0.0005","4.2527","0.0005","5.4443","0.0006","90","","90","","120","","85.271","0.017","295","2","295","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","vanadium nickel antimonide","vanadium nickel antimonide","","- Ni0.26 Sb V -","- Ni0.26 Sb V -","- Ni0.52 Sb2 V2 -","2","0.0833333","BR6047","Lewis, Chad A.; Wang, Meitian; Mar, Arthur","Vanadium nickel antimonide, VNi~0.26(2)~Sb","Acta Crystallographica Section E","2002","58","5","i39","i40","10.1107/S1600536802007547","","","0.71073","MoKα","","0.0578","0.0578","","","0.1145","0.1145","","","","","","1.325","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201015","13.2634","0.0007","13.2634","0.0007","16.4524","0.0011","90","","90","","90","","2894.3","0.3","173","2","173","2","","","","","","","","6","I -4 2 d","I -4 2bw","122","","","","- Ag Br2 H36 N9 O12 S8 -","- Ag Br2 H36 N9 O12 S8 -","- Ag4 Br8 H144 N36 O48 S32 -","4","0.25","BR6048","El Bali, Brahim; Sghyar, Mohamed; Lachkar, Mohammed; Rachid, Ouarsal; Aziz Alaoui, Tahiri; Bolte, Michael","Ennea-ammonium dibromide tetra(thiosulfato)argentate","Acta Crystallographica Section E","2002","58","5","i37","i38","10.1107/S1600536802007614","","","0.71073","MoKα","","0.0578","0.0577","","","0.1788","0.1789","","","","","","1.095","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201016","13.37","0.003","13.19","0.003","8.998","0.002","90","","100.46","0.03","90","","1560.4","0.6","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- Ga H4 N O8 P2 Zn -","- Ga H4 N O8 P2 Zn -","- Ga8 H32 N8 O64 P16 Zn8 -","8","1","","Mrak, Maja; Kolitsch, Uwe; Kaučič, Venčeslav; Tillmanns, Ekkehart","(NH~4~)(Zn,Ga)~2~(PO~4~)~2~, an open-framework structure","Acta Crystallographica, Section E","2002","58","","i44","i48","10.1107/S160053680200870X","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2201017","6.7635","0.0004","12.6454","0.0007","5.3866","0.0003","90","","90","","90","","460.7","0.05","293","2","293","2","","","","","","","","5","P n n m","-P 2 2n","58","","","","- Ba2 Cl2 Co O6 Se2 -","- Ba2 Cl2 Co O6 Se2 -","- Ba4 Cl4 Co2 O12 Se4 -","2","0.25","","Johnston, Magnus G.; Harrison, William T. A.","Barium cobalt chloride selenite, Ba~2~CoCl~2~(SeO~3~)~2~","Acta Crystallographica, Section E","2002","58","","i49","i51","10.1107/S1600536802009005","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2201018","13.964","0.005","4.606","0.002","16.214","0.006","90","","99.87","0.03","90","","1027.4","0.7","178","2","178","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","mesitylselenenyl iodide","","- C9 H11 I Se -","- C9 H11 I Se -","- C36 H44 I4 Se4 -","4","1","BT6116","Jeske, Jörg; Jones, Peter G.; Martens-von Salzen, Andreas; Du Mont, Wolf-Walther","Mesitylselenenyl iodide","Acta Crystallographica Section E","2002","58","4","o350","o352","10.1107/S1600536802003677","","","0.71073","MoKα","","0.0586","0.038","","","0.0906","0.1092","","","","","","1.188","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201019","15.689","0.008","5.298","0.003","10.641","0.006","90","","101.79","0.01","90","","865.8","0.8","150","","150","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","Isopropyl cyclohexane","","- C9 H18 -","- C9 H18 -","- C36 H72 -","4","1","BT6117","David R. Allan; Pamela A. McGregor; Lorna J. McLachlan; Simon Parsons; Colin R. Pulham","Treatment of `twinning' in isopropylcyclohexane","Acta Crystallographica Section E","2002","58","6","o652","o655","10.1107/S1600536802007274","","","0.71073","MoKα","","","0.0608","","","0.1663","0.2366","","","","","","1.0405","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201020","12.817","0.002","5.713","0.001","8.074","0.003","90","","106.15","0.03","90","","567.9","0.3","293","1","293","2","","","","","","","","4","P 1 c 1","P -2yc","7","","benzylphenylphosphine oxide","","- C13 H13 O P -","- C13 H13 O P -","- C26 H26 O2 P2 -","2","1","BT6118","Kruszynski, Rafal; Wieczorek, Wanda; Pietrusiewicz, K. Michał","Racemic benzylphenylphosphine oxide","Acta Crystallographica Section E","2002","58","4","o390","o392","10.1107/S1600536802003963","","","1.54178","CuKα","","0.0631","0.0628","","","0.1625","0.1629","","","","","","1.029","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201021","8.4422","0.0006","14.0159","0.0011","12.7803","0.0008","90","","104.445","0.008","90","","1464.42","0.19","170","2","170","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","cis-[4a]-cisoid-[4a,4b]-cis-[4b]-1,3,4b,5,7,8b-Hexamethylperhydro-1,3,5,7- tetraazabiphenylene-2,4,6,8-tetraone","","","- C14 H20 N4 O4 -","- C14 H20 N4 O4 -","- C56 H80 N16 O16 -","4","1","BT6119","Näther, Christian; Krüger, Oliver; Wille, Uta","<i>cis</i>-[4a]-<i>cisoid</i>-[4a,4b]-<i>cis</i>-[4b]-1,3,4b,5,7,8b-Hexamethylperhydro-1,3,5,7-tetraazabiphenylene-2,4,6,8-tetraone","Acta Crystallographica Section E","2002","58","4","o405","o406","10.1107/S1600536802004452","","","0.71073","MoKα","","0.0484","0.0447","","","0.1194","0.1233","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201022","10.0526","0.0005","13.5979","0.0006","24.7047","0.0016","90","","90","","90","","3377","0.3","170","2","170","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","cis-[4a]-cisoid-[4a,4b]-cis-[4b]-4b,8b-Diethyl-1,3,5,7-tetramethylperhydro- 1,3,5,7-tetraazabiphenylene-2,4,6,8-tetraone","","","- C16 H24 N4 O4 -","- C16 H24 N4 O4 -","- C128 H192 N32 O32 -","8","1","BT6120","Näther, Christian; Krüger, Oliver; Wille, Uta","<i>cis</i>-[4a]-<i>cisoid</i>-[4a,4b]-<i>cis</i>-[4b]-4b,8b-Diethyl-1,3,5,7-tetramethylperhydro-1,3,5,7-tetraazabiphenylene-2,4,6,8-tetraone","Acta Crystallographica Section E","2002","58","4","o407","o408","10.1107/S1600536802004464","","","0.71073","MoKα","","0.0502","0.045","","","0.1233","0.1282","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201023","7.0365","0.0006","8.04","0.0006","13.0172","0.001","81.743","0.01","75.761","0.01","84.015","0.01","704.58","0.1","170","2","170","2","","","","","","","","4","P -1","-P 1","2","cis-[4a]-cisoid-[4a,4b]-cis-[4b]-1,3,6,8,8a,8b-Hexamethylperhydro- 1,3,6,8-tetraazabiphenylene-2,4,5,7-tetraone","","","- C14 H20 N4 O4 -","- C14 H20 N4 O4 -","- C28 H40 N8 O8 -","2","1","BT6121","Näther, Christian; Krüger, Oliver; Wille, Uta","<i>cis</i>-[4a]-<i>cisoid</i>-[4a,4b]-<i>cis</i>-[4b]-1,3,6,8,8a,8b-Hexamethylperhydro-1,3,6,8-tetraazabiphenylene-2,4,5,7-tetraone","Acta Crystallographica Section E","2002","58","4","o409","o410","10.1107/S1600536802004476","","","0.71073","MoKα","","0.0472","0.043","","","0.1194","0.1237","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201024","15.2661","0.0009","14.4367","0.0008","15.72","0.0012","90","","90","","90","","3464.6","0.4","170","2","170","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","cis-[4a]-cisoid-[4a,4b]-cis-[4b]-4b-Ethyl-1,3,5,7,8b-pentamethylperhydro- 1,3,5,7-tetraazabiphenylene-2,4,6,8-tetraone","","","- C16 H24 N4 O4 -","- C16 H24 N4 O4 -","- C128 H192 N32 O32 -","8","1","BT6122","Näther, Christian; Krüger, Oliver; Wille, Uta","<i>cis</i>-[4a]-<i>cisoid</i>-[4a,4b]-<i>cis</i>-[4b]-4b-Ethyl-1,3,5,7,8b-hexamethylperhydro-1,3,5,7-tetraazabiphenylene-2,4,6,8-tetraone","Acta Crystallographica Section E","2002","58","4","o411","o412","10.1107/S1600536802004488","","","0.71073","MoKα","","0.0456","0.0398","","","0.1064","0.1112","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201025","7.6398","0.0006","8.6267","0.0007","12.3084","0.001","71.483","0.009","80.128","0.01","72.521","0.009","731.09","0.11","170","2","170","2","","","","","","","","4","P -1","-P 1","2","cis-[4a]-transoid-[4a,4b]-cis-[4b]-1,3,6,8,8a,8b-Hexamethylperhydro- 1,3,6,8-tetraazabiphenylene-2,4,5,7-tetraone","","","- C14 H20 N4 O4 -","- C14 H20 N4 O4 -","- C28 H40 N8 O8 -","2","1","BT6123","Näther, Christian; Krüger, Oliver; Wille, Uta","<i>cis</i>-[4a]-<i>transoid</i>-[4a,4b]-<i>cis</i>-[4b]-1,3,6,8,8a,8b-Hexamethylperhydro-1,3,6,8-tetraazabiphenylene-2,4,5,7-tetraone","Acta Crystallographica Section E","2002","58","4","o413","o414","10.1107/S160053680200449X","","","0.71073","MoKα","","0.0487","0.0422","","","0.1152","0.1211","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201026","8.5284","0.0006","12.2178","0.0009","16.2102","0.0012","91.481","0.009","101.269","0.008","90.518","0.008","1655.8","0.2","170","2","170","2","","","","","","","","4","P -1","-P 1","2","cis-[4a]-cisoid-[4a,4b]-cis-[4b]-8a,8b-Diethyl-1,3,6,8-tetramethylperhydro- 1,3,6,8-tetraazabiphenylene-2,4,5,7-tetraone","","","- C16 H24 N4 O4 -","- C16 H24 N4 O4 -","- C64 H96 N16 O16 -","4","2","BT6124","Näther, Christian; Krüger, Oliver; Wille, Uta","<i>cis</i>-[4a]-<i>cisoid</i>-[4a,4b]-<i>cis</i>-[4b]-8a,8b-Diethyl-1,3,6,8-tetramethylperhydro-1,3,6,8-tetraazabiphenylene-2,4,5,7-tetraone","Acta Crystallographica Section E","2002","58","4","o415","o416","10.1107/S1600536802004506","","","0.71073","MoKα","","0.0738","0.0488","","","0.1252","0.1398","","","","","","1.02","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201027","11.3936","0.0003","10.8972","0.0003","19.5047","0.0007","90","","104.239","0.0011","90","","2347.27","0.12","120","2","","","","","","","","","","2","P 1 21 1","P 2yb","4","","","","- C27 H48 -","- C27 H48 -","- C108 H192 -","4","2","BT6125","Coles, Simon J.; Frampton, Christopher S.; Hursthouse, Michael B.","5α-Cholestane","Acta Crystallographica Section E","2002","58","4","o445","o446","10.1107/S1600536802004786","","","0.71073","MoKα","","","0.0616","","","","0.1369","","","","","","0.992","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201028","15.523","0.003","14.521","0.003","7.52","0.002","90","","94.45","0.03","90","","1690","0.7","291","1","291","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(2-Benzylamino-1-oxoethyl)-1,2,3,4-tetrahydro-6,7-dimethylquinoxalin-2-one","","- C19 H21 N3 O2 -","- C19 H21 N3 O2 -","- C76 H84 N12 O8 -","4","1","BT6126","Kruszynski, Rafal; Bartczak, Tadeusz J.; Mikiciuk-Olasik, Elżbieta","4-(2-Benzylamino-1-oxoethyl)-1,2,3,4-tetrahydro-6,7-dimethylquinoxalin-2-one","Acta Crystallographica Section E","2002","58","4","o461","o464","10.1107/S1600536802004993","","","0.71073","MoKα","","0.2483","0.0878","","","0.2135","0.2729","","","","","","0.97","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201029","11.0278","0.0002","7.7486","0.0005","15.7861","0.0007","90","","90","","90","","1348.92","0.11","150","1","150","1","","","","","","","","3","P b c a","-P 2ac 2ab","61","","2,3-Dihydro-2-hydroxybenzo[b]furan-3-one","","- C8 H6 O3 -","- C8 H6 O3 -","- C64 H48 O24 -","8","1","BT6129","Kresge, A. J.; Lough, Alan J.; Meng, Q.","2,3-Dihydro-2-hydroxybenzo[<i>b</i>]furan-3-one","Acta Crystallographica Section E","2002","58","5","o495","o497","10.1107/S160053680200572X","","","0.71073","MoKα","","0.045","0.038","","","0.1","0.106","","","","","","1.053","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201030","26.687","0.005","17.867","0.004","17.471","0.003","90","","106.23","0.03","90","","7998","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H32 Cr2 N6 O11 Zn -","- C36 H32 Cr2 N6 O11 Zn -","- C288 H256 Cr16 N48 O88 Zn8 -","8","1","BT6130","Ejsmont, Krzysztof; Wasielewski, Marek; Zaleski, Jacek","Tris(1,10-phenanthroline)zinc(II) dichromate tetrahydrate","Acta Crystallographica Section E","2002","58","5","m200","m202","10.1107/S1600536802006402","","","0.71073","MoKα","","0.0806","0.0465","","","0.1502","0.1769","","","","","","1.052","","","","has coordinates,has Fobs","199471","2020-10-21","18:00:00",""
"2201031","15.41","0.002","9.402","0.0012","11.0939","0.0015","90","","124.235","0.01","90","","1328.8","0.3","293","2","293","","","","","","","","","3","C 1 c 1","C -2yc","9","9,10-Dihydroanthracene-9,10-α,β-succinic acid anhydride","5,6:7,8-dibenzobicyclo[2.2.2]octa-5,7-diene-2,3-dicarboxylic acid anhydride","","- C18 H12 O3 -","- C18 H12 O3 -","- C72 H48 O12 -","4","1","BT6131","Díaz de Delgado, Graciela; Ramírez V., Belkis; Velásquez, William; Rodríguez, Pedro","A new polymorph of 9,10-dihydroanthracene-9,10-α,β-succinic acid anhydride","Acta Crystallographica Section E","2002","58","5","o501","o503","10.1107/S1600536802005767","","","0.71073","MoKα","","0.0434","0.0355","","","0.0808","0.0837","","","","","","1.029","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201032","8.874","0.0005","11.2257","0.0005","15.7326","0.0008","90","","90","","90","","1567.23","0.14","290","2","290","1","","","","","","","","5","P c c n","-P 2ab 2ac","56","","1-Bromo-2,4-dinitrobenzene","","- C6 H3 Br N2 O4 -","- C6 H3 Br N2 O4 -","- C48 H24 Br8 N16 O32 -","8","1","BT6132","Kruszynski, Rafal; Czestkowski, Wojciech","1-Bromo-2,4-dinitrobenzene","Acta Crystallographica Section E","2002","58","5","o481","o483","10.1107/S1600536802005718","","","0.71073","MoKα","","0.0271","0.027","","","0.0618","0.0619","","","","","","1.143","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2201033","9.384","0.005","15.323","0.007","12.667","0.006","90","","108.758","0.008","90","","1724.7","1.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Ni(dien)(DL-his)]I.H2O","(diethylenetriamine-N,N',N'')(DL-histinato-N,N',O)nickel(II) iodide monohydrate","","- C10 H23 I N6 Ni O3 -","- C10 H23 I N6 Ni O3 -","- C40 H92 I4 N24 Ni4 O12 -","4","1","BT6133","Wang, Li; Feng, Xiao-Long; Cai, Jiwen","(Diethylenetriamine-<i>N,N</i>',<i>N</i>'')(<small>DL</small>-histinato-<i>N,N</i>',<i>O</i>)nickel(II) iodide monohydrate","Acta Crystallographica Section E","2002","58","5","m209","m211","10.1107/S1600536802006116","","","0.71073","MoKα","","0.0262","0.0216","","","0.0493","0.051","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201034","7.736","0.004","11.104","0.006","18.183","0.009","90","","96.57","0.011","90","","1551.7","1.4","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1-oxo-13c-methoxy-1,13c-dihydrodibenzo[a,kl]-xanthene","","- C21 H16 O3 -","- C21 H16 O3 -","- C84 H64 O12 -","4","1","BT6134","Pang, Yi-Yan; Cai, Jiwen; Tan, Duan-Ming; Chen, Zhi-Ping; Xu, Zun-Le","13c-Methoxy-1,2,3,13c-tetrahydrodibenzo[<i>a,kl</i>]xanthan-1-one","Acta Crystallographica Section E","2002","58","5","o526","o527","10.1107/S1600536802006414","","","0.71073","MoKα","","0.0964","0.0487","","","0.1411","0.1778","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201035","6.412","0.001","9.032","0.002","11.239","0.002","90","","97.05","0.03","90","","646","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Bis(1,1-dimethylbiguand)nickel(II)","Bis(1,1-dimethylbiguande)nickel(II)","","- C8 H20 N10 Ni -","- C8 H20 N10 Ni -","- C16 H40 N20 Ni2 -","2","0.5","BT6135","Zhu, Miaoli; Lu, Liping; Yang, Pin; Jin, Xianglin","Bis(1,1-dimethylbiguanido)nickel(II)","Acta Crystallographica Section E","2002","58","6","m272","m274","10.1107/S1600536802007869","","","0.71073","MoKα","","0.042","0.03","","","0.069","0.072","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201036","7.484","0.002","13.901","0.003","14.132","0.004","90","","90","","90","","1470.2","0.7","120","2","120","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Crystal-Structure Analysis at low temperature of Bergenin monohydrated, a Constituent of Hurmiria Balsamifera.","","- C14 H18 O10 -","- C14 H18 O10 -","- C56 H72 O40 -","4","1","BT6136","Caldas, C. S.; De Simone, C. A.; Pereira, M. A.; Malta, V. R. S.; Carvalho, R. L. P.; da Silva, T. B. C.; Santana, A. E. G.; Conserva, L. M.","Bergenin monohydrate, a constituent of <i>Hurmiria balsamifera</i>, at 120K","Acta Crystallographica Section E","2002","58","6","o609","o611","10.1107/S1600536802007584","","","0.7107","MoKα","","0.0478","0.0369","","","0.0969","0.1286","","","","","","1.264","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201037","6.9391","0.001","12.945","0.002","7.9714","0.001","90","","90","","90","","716.04","0.18","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","Dichloro(β-alanine)cadmium(II)","Dichloro(β-alanine)cadmium(II)","","- C3 H7 Cd Cl2 N O2 -","- C3 H7 Cd Cl2 N O2 -","- C12 H28 Cd4 Cl8 N4 O8 -","4","1","BT6137","Subha Nandhini, M.; Krishnakumar, R. V.; Sivakumar, K.; Natarajan, S.","<i>catena</i>-Poly[[cadmium(II)]-μ-β-alanine-di-μ-chloro]","Acta Crystallographica Section E","2002","58","6","m307","m309","10.1107/S160053680200805X","","","0.71073","MoKα","","0.033","0.032","","","0.08","0.081","","","","","","1.23","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201038","13.91","0.0002","7.989","0.0006","16.408","0.0007","90","","90","","90","","1823.37","0.16","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C9 H12 N2 O2 -","- C9 H12 N2 O2 -","- C72 H96 N16 O16 -","8","1","BT6138","Robin, Maxime; Galy, Jean-Pierre; Kenz, Ahmed; Pierrot, Marcel","<i>N</i>-(4-Amino-2-methoxyphenyl)acetamide","Acta Crystallographica Section E","2002","58","6","o644","o645","10.1107/S1600536802008061","","","0.71073","MoKα","","0.0893","0.0627","","","0.1905","0.2247","","","","","","1.205","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201039","7.4247","0.0008","10.9401","0.0012","8.2473","0.0009","90","","107.342","0.002","90","","639.45","0.12","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2,4-lutidine","2,4-dimethylpyridine","","- C7 H9 N -","- C7 H9 N -","- C28 H36 N4 -","4","1","BT6139","Bond, Andrew D.; Parsons, Simon","2,4-Lutidine","Acta Crystallographica Section E","2002","58","5","o550","o552","10.1107/S160053680200692X","","","0.7107","MoKα","","0.0655","0.0546","","","0.1398","0.1462","","","","","","0.944","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201040","13.037","0.004","11.003","0.003","14.851","0.003","90","","100.12","0.02","90","","2097.2","1","296.2","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C16 H21 La N2 O13 -","- C16 H21 La N2 O13 -","- C64 H84 La4 N8 O52 -","4","1","BT6140","Okabe, Nobuo; Hasuyo Kyoyama","A polynuclear lanthanum(III) complex of dipicolinic acid","Acta Crystallographica Section E","2002","58","5","m226","m227","10.1107/S1600536802007596","","","0.7107","MoKα","","","0.0309","","","","0.1086","","","","","","0.8","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201041","8.9692","0.0006","12.312","0.001","7.3832","0.0006","104.391","0.006","96.502","0.006","83.654","0.006","781.77","0.11","250","1","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H14 N4 O8 -","- C14 H14 N4 O8 -","- C28 H28 N8 O16 -","2","1","BT6141","Ohba, Shigeru; Ito, Yoshikatsu","2-(4-Hydroxyphenyl)ethylammonium picrate","Acta Crystallographica Section E","2002","58","5","o584","o585","10.1107/S1600536802007286","","","1.5418","CuKα","","","0.049","","","","0.143","","","","","","1.08","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201042","11.392","0.001","11.644","0.001","6.7552","0.0003","103.233","0.006","97.756","0.007","113.585","0.008","773.21","0.12","250","1","","","","","","","","","","4","P -1","-P 1","2","","","","- C15 H15 N3 O8 -","- C15 H15 N3 O8 -","- C30 H30 N6 O16 -","2","1","BT6142","Ohba, Shigeru; Ito, Yoshikatsu","2-(3,4-Dihydroxyphenyl)ethylammonium 3,5-dinitrobenzoate","Acta Crystallographica Section E","2002","58","5","o586","o587","10.1107/S1600536802007298","","","1.5418","CuKα","","","0.037","","","","0.118","","","","","","1.121","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201043","10.0546","0.0009","10.9344","0.0013","9.0112","0.0014","106.451","0.01","101.24","0.009","94.89","0.008","921.5","0.2","250","1","","","","","","","","","","4","P -1","-P 1","2","","","","- C17 H19 N3 O8 -","- C17 H19 N3 O8 -","- C34 H38 N6 O16 -","2","1","BT6143","Ohba, Shigeru; Ito, Yoshikatsu","2-(3,4-Dimethoxyphenyl)ethylammonium 3,5-dinitrobenzoate","Acta Crystallographica Section E","2002","58","5","o588","o589","10.1107/S1600536802007304","","","1.5418","CuKα","","","0.044","","","","0.125","","","","","","1.11","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201044","5.0935","0.0011","6.274","0.002","5.3847","0.0012","90","","113.19","0.02","90","","158.17","0.07","294","1","294","2","","","","","","","","4","P 1 21 1","P 2yb","4","glycine","aminoacetic acid","","- C2 H5 N O2 -","- C2 H5 N O2 -","- C4 H10 N2 O4 -","2","1","BT6144","Tat'yana N. Drebushchak; Elena V. Boldyreva; Elena S. Shutova","β-Glycine","Acta Crystallographica Section E","2002","58","6","o634","o636","10.1107/S160053680200836X","","","0.71069","MoKα","","0.0297","0.0252","","","0.0722","0.0761","","","","","","1.12","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201045","7.7769","0.0004","6.2492","0.0003","9.6263","0.0005","90","","92.749","0.002","90","","467.29","0.04","123","2","123","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C11 H13 N O -","- C11 H13 N O -","- C22 H26 N2 O2 -","2","1","BT6145","Kennedy, Alan R.; Sherwood, John N.; Slavin, Paul A.","5-Methoxy-2,3-dimethylindole","Acta Crystallographica Section E","2002","58","6","o642","o643","10.1107/S1600536802008383","","","0.71073","MoKα","","0.0858","0.0439","","","0.0828","0.0951","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201046","15.48","0.003","5.9692","0.0009","27.962","0.005","90","","90","","90","","2583.8","0.8","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2,4-Bibromophenyl 4-bromophenyl ether","","- C12 H7 Br3 O -","- C12 H7 Br3 O -","- C96 H56 Br24 O8 -","8","1","BT6146","Eriksson, Lars; Hu, Jiwei","4-Bromophenyl 2,4-dibromophenyl ether","Acta Crystallographica Section E","2002","58","6","o696","o698","10.1107/S1600536802008693","","","0.71073","MoKα","","0.0892","0.0349","","","0.0398","0.0442","","","","","","1.017","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201047","10.366","0.003","12.362","0.003","13.504","0.005","116.212","0.013","95.05","0.02","92.914","0.016","1538.7","0.8","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","tetra(4-hydroxypyridinium) bis((μ~2~-iodo)tetraiodobismuthate(III)) 4-pyridone tetrasolvate","","- C40 H44 Bi2 I10 N8 O8 -","- C40 H44 Bi2 I10 N8 O8 -","- C40 H44 Bi2 I10 N8 O8 -","1","0.5","CF6149","Jonathan P. H. Charmant; Nicholas C. Norman; Jonathan Starbuck","A bis[pentaiodobismuthate(III)] salt of 4-hydroxypyridinium","Acta Crystallographica Section E","2002","58","4","m144","m146","10.1107/S1600536802003136","","","0.71073","MoKα","","0.1002","0.0457","","","0.0871","0.1023","","","","","","0.896","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201048","5.5811","0.0002","16.955","0.0006","17.7323","0.0006","90","","90","","90","","1677.96","0.1","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1,2,3,4-tetra-acetyl-alpha-D-glucuronamide","","- C14 H19 N O10 -","- C14 H19 N O10 -","- C56 H76 N4 O40 -","4","1","CF6155","Thomas C. Baddeley; Iain G. Davidson; Janet M. S. Skakle; James L. Wardell","1,2,3,4-Tetra-<i>O</i>-acetyl-α-<small>D</small>-glucopyranuronamide","Acta Crystallographica Section E","2002","58","4","o447","o449","10.1107/S1600536802003562","","","0.71073","MoKα","","0.0448","0.0356","","","0.0881","0.0931","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201049","3.8899","0.0005","8.4355","0.0011","11.4569","0.0015","90","","96.53","0.005","90","","373.5","0.08","293","2","293","2","","","","","","","","4","P 1 c 1","P -2yc","7","1-thiocoumarin","2H-thiochromene-2-one","","- C9 H6 O S -","- C9 H6 O S -","- C18 H12 O2 S2 -","2","1","CF6156","Munshi, Parthapratim; Guru Row, T. N.","2<i>H</i>-Thiochromen-2-one","Acta Crystallographica Section E","2002","58","4","o353","o354","10.1107/S1600536802003628","","","0.71073","MoKα","","0.0305","0.0294","","","0.071","0.0715","","","","","","1.051","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201050","6.7089","0.0016","12.065","0.0015","11.0782","0.0016","90","","97.472","0.017","90","","889.1","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Lithium Borodilactate","","- C6 H8 B Li O6 -","- C6 H8 B Li O6 -","- C24 H32 B4 Li4 O24 -","4","2","CF6157","Dhanuskodi, S.; Angeli Mary, P. .A; Thamotharan, S.; Parthasarathi, V.","Lithium borodilactate","Acta Crystallographica Section E","2002","58","5","m212","m214","10.1107/S1600536802006773","","","0.71073","MoKα","","0.0346","0.0278","","","0.0712","0.0789","","","","","","0.993","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201051","10.5826","0.0009","11.6428","0.0006","13.3394","0.0006","90","","98.164","0.005","90","","1626.91","0.18","294","","294","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H42 B2 N2 O4 -","- C34 H42 B2 N2 O4 -","- C68 H84 B4 N4 O8 -","2","0.5","CF6158","Kliegel, Wolfgang; Amt, Hennig; Patrick, Brian O.; Rettig, Steven J.; James Trotter","A diphenylboron chelate of an ethylenebishydroxylamine formaldehyde adduct","Acta Crystallographica Section E","2002","58","5","o473","o475","10.1107/S1600536802005391","","","1.54178","CuKα","","0.069","0.038","","0.053","","0.051","","","","","","1.79","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201052","33.365","0.004","3.991","0.002","20.837","0.003","90","","122.679","0.009","90","","2335.4","1.3","296.2","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C13 H12 O5 -","- C13 H12 O5 -","- C104 H96 O40 -","8","1","CF6159","Okabe, Nobuo; Kyoyama, Hasuyo","2,3,4-Trihydroxybenzophenone monohydrate","Acta Crystallographica Section E","2002","58","5","o565","o567","10.1107/S1600536802007109","","","0.7107","MoKα","","","0.0435","","","","0.1839","","","","","","0.859","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201053","7.9639","0.0009","14.017","0.002","13.0563","0.0015","90","","95.995","0.002","90","","1449.5","0.3","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","(tetpy2H) (NO3)2","","","- C12 H12 N6 O7 -","- C12 H12 N6 O7 -","- C48 H48 N24 O28 -","4","1","CF6160","Marina Felloni; Peter Hubberstey; Martin Schröder; Claire Wilson","1-(4-Pyridinio)-2'-[4-pyridinio-(<i>E</i>)-methylidene]hydrazide dinitrate","Acta Crystallographica Section E","2002","58","5","o519","o522","10.1107/S1600536802006050","","","0.71073","MoKα","","0.0756","0.0423","","","0.1071","0.1159","","","","","","1","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2201054","10.845","0.001","16.198","0.001","13.198","0.001","90","","95.26","0.01","90","","2308.7","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[1,2-bis(diphenylphosphino)ethene)]nickel(II) diperchlorate","","- C52 H44 Cl2 Ni O8 P4 -","- C52 H44 Cl2 Ni O8 P4 -","- C104 H88 Cl4 Ni2 O16 P8 -","2","0.5","CF6161","Li, Yi-Zhi; Liu, Jia-Cheng; Qu, Jian-Qiang; Wang, Liu-Fang; Xia, Chun-Gu; Niu, Jian-Zhong","Bis[1,2-bis(diphenylphosphino)ethene]nickel(II) diperchlorate","Acta Crystallographica Section E","2002","58","5","m237","m238","10.1107/S1600536802007213","","","0.71073","MoKα","","0.0365","0.0316","","","0.1051","0.1063","","","","","","0.914","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201055","15.0595","0.0004","17.1977","0.0006","10.8465","0.0004","90","","90","","90","","2809.12","0.16","150","2","150","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","α,α-trehalose ditrityl hexaacetate","2,3,4-tri-O-acetyl-6-O-trityl-1-O-(2,3,4-tri-O-acetyl-6-O-tritylα-D- glucopyranosyl)-α-D-glucopyranose","","- C62 H62 O17 -","- C62 H62 O17 -","- C124 H124 O34 -","2","0.5","CF6162","Baddeley, Thomas C.; Clow, Simon M.; Cox, Philip J.; Davidson, Iain G.; Howie, R. Alan; Wardell, James L.","Ditrityl α,α-trehalose hexaacetate","Acta Crystallographica Section E","2002","58","5","o476","o477","10.1107/S1600536802005408","","","0.71073","MoKα","","0.0744","0.0435","","","0.0895","0.101","","","","","","1.002","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201056","21.0704","0.0002","8.6065","0.0001","23.6443","0.0003","90","","112.459","0.0006","90","","3962.5","0.08","200","","200","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C43 H62 O P2 Pd -","- C43 H62 O P2 Pd -","- C172 H248 O4 P8 Pd4 -","4","1","CF6163","Willis, Anthony C.; Retbøll, Mikael K.; Wenger, Eric","A palladium(0) complex of dibenzylideneacetone and a chelating diphosphine","Acta Crystallographica Section E","2002","58","6","m275","m277","10.1107/S1600536802008140","","","0.7107","MoKα","","0.0545","0.0404","","0.0515","","0.0485","","","1.95","","","1.97","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"2201057","19.3836","0.0003","9.5471","0.0002","21.7994","0.0004","90","","108.164","0.0008","90","","3833.11","0.12","120","2","120","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","trans-Chloro(4-nitrobenzenethiolato-S)bis(triphenylphosphine-P)-palladium(II) 1,2-dichloroethane hemi-solvate","","- C43 H36 Cl2 N O2 P2 Pd S -","- C43 H36 Cl2 N O2 P2 Pd S -","- C172 H144 Cl8 N4 O8 P8 Pd4 S4 -","4","1","CF6164","Howie, R. Alan; Wardell, James L.","<i>trans</i>-Chloro(4-nitrobenzenethiolato-<i>S</i>)bis(triphenylphosphine-<i>P</i>)palladium(II) 1,2-dichloroethane hemisolvate at 120K","Acta Crystallographica Section E","2002","58","5","m178","m180","10.1107/S1600536802006062","","","0.71073","MoKα","","0.0703","0.0402","","","0.0825","0.0921","","","","","","0.989","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201058","5.89","0.0003","8.069","0.0003","8.848","0.0005","94.767","0.0018","92.052","0.0018","104.157","0.0017","405.65","0.03","110","2","110","2","","","","","","","","3","P -1","-P 1","2","","N,N'-Bis[1-(4-pyridyl)ethylidene]-p-phenylenediamine","","- C20 H18 N4 -","- C20 H18 N4 -","- C20 H18 N4 -","1","0.5","CF6165","Goutam Kumar Patra; Israel Goldberg","<i>N,N</i>'-Bis[1-(4-pyridyl)ethylidene]-<i>p</i>-phenylenediamine","Acta Crystallographica Section E","2002","58","5","o528","o529","10.1107/S1600536802006128","","","0.7107","MoKα","","0.0769","0.0482","","","0.1295","0.1529","","","","","","0.884","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201059","10.194","0.0002","11.438","0.0003","11.318","0.0003","90","","101.184","0.0011","90","","1294.61","0.05","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Meso-(4-nitrophenyl)dipyrromethane","","- C15 H13 N3 O2 -","- C15 H13 N3 O2 -","- C60 H52 N12 O8 -","4","1","CF6166","Goutam Kumar Patra; Yael Diskin-Posner; Israel Goldberg","<i>meso</i>-(4-Nitrophenyl)dipyrromethane","Acta Crystallographica Section E","2002","58","5","o530","o531","10.1107/S160053680200613X","","","0.71073","MoKα","","0.0732","0.0438","","","0.0988","0.114","","","","","","1.004","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201060","23.561","0.005","6.952","0.001","13.297","0.003","90","","105.95","0.03","90","","2094.1","0.8","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(1,1-dimethylbiguanido)copper(II) octahydrate","","- C8 H36 Cu N10 O8 -","- C8 H36 Cu N10 O8 -","- C32 H144 Cu4 N40 O32 -","4","0.5","CF6167","Zhu, Miaoli; Lu, Liping; Yang, Pin; Jin, Xianglin","Bis(1,1-dimethylbiguanido)copper(II) octahydrate","Acta Crystallographica Section E","2002","58","5","m217","m219","10.1107/S1600536802007092","","","0.71073","MoKα","","0.038","0.026","","","0.049","0.051","","","","","","0.901","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201061","11.762","0.003","8.628","0.002","17.604","0.006","90","","107.52","0.02","90","","1703.6","0.8","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C4 H14 Cl O P -","- C4 H14 Cl O P -","- C32 H112 Cl8 O8 P8 -","8","1","CF6168","Margraf, Günter; Lerner, Hans-Wolfram; Bolte, Michael","Tetramethylphosphonium chloride hydrate","Acta Crystallographica Section E","2002","58","5","o546","o547","10.1107/S1600536802006785","","","0.71073","MoKα","","0.0839","0.054","","","0.1184","0.1298","","","","","","0.978","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201062","7.39","0.002","14.878","0.004","15.635","0.005","90","","91.91","0.02","90","","1718.1","0.9","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","none","cis,syn,cis-2,3,4,8,9-Pentachloro-1,5,7,7-tetramethoxy- tricyclo[4.3.0.0^2,5^]nona-3,8-diene","","- C13 H13 Cl5 O4 -","- C13 H13 Cl5 O4 -","- C52 H52 Cl20 O16 -","4","1","CF6169","Gilardi, Richard; Tang, Datong; Eaton, Philip E.","<i>cis,syn,cis</i>-2,3,4,8,9-Pentachloro-1,5,7,7-tetramethoxytricyclo[4.3.0.0^2,5^]nona-3,8-diene","Acta Crystallographica Section E","2002","58","6","o615","o617","10.1107/S1600536802007705","","","0.71073","MoKα","","0.0539","0.037","","","0.0837","0.092","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201063","8.323","0.002","16.967","0.005","10.411","0.003","90","","91.31","0.02","90","","1469.8","0.7","98","2","98","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","none","1,2,4,5,6,7,8,9-octachlorotricyclo[5.2.1.0^2,6^]deca-4,8-diene-3,10-diol","","- C10 H4 Cl8 O2 -","- C10.115 H4.345 Cl7.885 O2.115 -","- C40.46 H17.38 Cl31.54 O8.46 -","4","1","CF6170","Gilardi, Richard; Tang, Datong; Eaton, Philip E.","1,2,4,5,6,7,8,9-Octachlorotricyclo[5.2.1.0^2,6^]deca-4,8-diene-3,10-diol","Acta Crystallographica Section E","2002","58","5","o562","o564","10.1107/S1600536802006992","","","0.71073","MoKα","","0.0334","0.0256","","","0.062","0.0643","","","","","","1.012","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201064","13.763","0.004","11.909","0.004","20.357","0.006","90","","90","","90","","3336.6","1.8","93","2","93","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Bis(1-bromo-9-chlorohomocub-9-yl) ether","1-bromo-9-(7-bromo-8-chloropentacyclo[4.3.0.0^2,5^.0^3,9^.0^4,7^]non-8-yloxy)- 9-chloropentacyclo[4.3.0.0^2,5^.0^3,8^.0^4,7^]nonane","","- C18 H14 Br2 Cl2 O -","- C18 H14 Br2 Cl2 O -","- C144 H112 Br16 Cl16 O8 -","8","1","CF6171","Tang, Datong; Gilardi, Richard; Eaton, Philip E.","Bis(1-bromo-9-chlorohomocub-9-yl) ether","Acta Crystallographica Section E","2002","58","6","o618","o619","10.1107/S1600536802007717","","","0.71073","MoKα","","0.036","0.0224","","","0.0436","0.0448","","","","","","0.861","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201065","8.5963","0.0011","12.4609","0.0008","27.7642","0.0015","90","","90","","90","","2974","0.5","300","2","300","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(25R)-23-acetyl-3-β-bromo-16-β-acetoxy-22,26-epoxy-5-α-cholest-22-en-6-one","","- C31 H45 Br O5 -","- C31 H45 Br O5 -","- C124 H180 Br4 O20 -","4","1","CF6172","Castro-Méndez, Albina; Sandoval-Ramírez, Jesús; Bernès, Sylvain","A derivative of diosgenin: (25<i>R</i>)-23-acetyl-3β-bromo-16β-acetoxy-22,26-epoxy-5α-cholest-22-en-6-one","Acta Crystallographica Section E","2002","58","6","o606","o608","10.1107/S1600536802007754","","","0.71073","MoKα","","0.1115","0.056","","","0.1153","0.1391","","","","","","1.008","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2201066","7.8593","0.0016","8.429","0.003","9.039","0.003","84.39","0.03","89.92","0.02","88.91","0.03","595.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H12 N2 O5 -","- C12 H12 N2 O5 -","- C24 H24 N4 O10 -","2","1","CF6173","Moreno-Fuquen, Rodolfo; Montaño, Angela Marcela; Atencio, Reinaldo","The 1:1 complex of hydroquinone and 3-methy-4-nitropyridine 1-oxide","Acta Crystallographica Section E","2002","58","6","o623","o625","10.1107/S160053680200819X","","","0.71073","MoKα","","0.048","0.043","","","0.122","0.127","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201067","11.5354","0.0007","12.7225","0.0012","11.8884","0.001","90","","116.106","0.003","90","","1566.7","0.2","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Diacetyl monoxime","2,3-Butanedione monoxime","","- C4 H7 N O2 -","- C4 H7 N O2 -","- C48 H84 N12 O24 -","12","3","CF6174","Philip J. Cox; Nicola M. Foote","Hydrogen-bonded molecular chains in (2<i>E</i>)-butane-2,3-dione oxime with <i>Z</i>' = 3","Acta Crystallographica Section E","2002","58","6","o603","o605","10.1107/S1600536802007742","","","0.71073","MoKα","","0.2472","0.0671","","","0.1304","0.1809","","","","","","0.942","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201068","11.745","0.003","16.727","0.006","10.425","0.002","106.94","0.02","93.58","0.02","101.33","0.03","1905.3","1","296.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C42 H34 N4 O13 V2 -","- C42 H34 N4 O13 V2 -","- C84 H68 N8 O26 V4 -","2","1","CF6175","Okabe, Nobuo; Muranishi, Yasunori","Aquaoxobis(quinoline-2-carboxylato-<i>N,O</i>)vanadium(IV) ethanol hemisolvate","Acta Crystallographica Section E","2002","58","6","m287","m289","10.1107/S1600536802008619","","","0.7107","MoKα","","","0.0665","","","","0.2448","","","","","","1.088","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2201069","18.6188","0.0014","45.383","0.004","3.945","0.004","90","","90","","90","","3333","3","120","2","120","2","","","","","","","","4","F d d 2","F 2 -2d","43","4-chloropropiophenone","1-(4-chlorophenyl)propane-1-one","","- C9 H9 Cl O -","- C9 H9 Cl O -","- C144 H144 Cl16 O16 -","16","1","CF6176","Philip J. Cox","Weak C—H···O hydrogen bonding and aromatic π‒π-stacking interactions in 1-(4-chlorophenyl)propan-1-one","Acta Crystallographica Section E","2002","58","6","o661","o662","10.1107/S1600536802008590","","","0.71073","MoKα","","0.0527","0.0386","","","0.0804","0.0857","","","","","","1.014","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201070","6.8216","0.0014","18.934","0.004","8.161","0.0016","90","","107.76","0.03","90","","1003.8","0.4","150","2","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C11 H18 O2 -","- C11 H18 O2 -","- C44 H72 O8 -","4","1","CF6177","Coles, Simon J.; Hursthouse, Michael B.","2,6-Dimethyl-3-methylenebicyclo[3.2.1]octane-2,8-diol","Acta Crystallographica Section E","2002","58","6","o673","o674","10.1107/S1600536802008644","","","0.71073","MoKα","","","0.0461","","","","0.1225","","","","","","0.991","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201071","6.435","0.002","14.604","0.006","16.388","0.006","90","","118.641","0.007","90","","1351.6","0.9","193","2","193","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(E)-1-(4-carboxyphenylmethylene)-2-tetralone","","- C18 H14 O3 -","- C18 H14 O3 -","- C72 H56 O12 -","4","1","CF6178","Oloo, Eliud O.; Quail, J. Wilson; Padmanilayam, Maniyan P.; Dimmock, Jonathan R.","(<i>E</i>)-1-(4-Carboxyphenylmethylene)-2-tetralone","Acta Crystallographica Section E","2002","58","6","o687","o688","10.1107/S1600536802008668","","","0.71073","MoKα","","0.0919","0.0594","","","0.1393","0.1543","","","","","","0.936","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201072","8.947","0.003","9.109","0.002","12.495","0.003","90.87","0.02","104.15","0.02","118.17","0.02","860.2","0.5","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","1-(4-carboethoxyphenylmethyl)-2-ethoxynaphthalene","","- C22 H22 O3 -","- C22 H22 O3 -","- C44 H44 O6 -","2","1","CF6179","Oloo, Eliud O.; Quail, J. Wilson; Padmanilayam, Maniyan P.; Dimmock, Jonathan R.","1-(4-Carboethoxyphenylmethyl)-2-ethoxynaphthalene","Acta Crystallographica Section E","2002","58","6","o689","o690","10.1107/S160053680200867X","","","0.71073","MoKα","","0.1655","0.0594","","","0.1214","0.1577","","","","","","0.977","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201073","11.493","0.002","15.285","0.002","15.293","0.003","90","","90","","90","","2686.5","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3β,17β-Diacetoxy-16-(2-Pyridylmethylene)androst-5-ene hydrate (1/0.46)","","- C29 H37.92 N O4.46 -","- C29 H37.92 N O4.46 -","- C116 H151.68 N4 O17.84 -","4","1","CI6090","Vasuki. G; Parthasarathi. V; Ramamurthi. K; Dubey. S; Jindal. D. P","3β,17β-Diacetoxy-16-(2-pyridylmethylene)androst-5-ene hydrate (1/0.46)","Acta Crystallographica Section E","2002","58","4","o355","o356","10.1107/S1600536802003550","","","1.5418","CuKα","","0.05","0.04","","","0.101","0.113","","","","","","1.06","","","","has coordinates,has Fobs","203508","2020-10-21","18:00:00",""
"2201074","13.3861","0.001","7.522","0.002","15.109","0.003","90","","102.12","0.02","90","","1487.4","0.5","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","5,7-diphenyltetrazolo [1,5-a]pyridine-8-carbonitrile","","- C18 H11 N5 -","- C18 H11 N5 -","- C72 H44 N20 -","4","1","CI6093","Patel, Urmila H.; Dave, Chaitanya G.; Jotani, Mukesh M.; Shah, Hetal C.","5,7-Diphenyltetrazolo[1,5-<i>a</i>]pyridine-8-carbonitrile","Acta Crystallographica Section E","2002","58","4","o431","o432","10.1107/S1600536802004634","","","0.71073","MoKα","","0.119","0.06","","","0.155","0.185","","","","","","0.96","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201075","8.9909","0.0017","14.814","0.003","20.469","0.004","90","","90","","90","","2726.3","0.9","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","N-acetyl-N-[1-(2-naphthalenyl)ethenyl]-acetamide","","- C16 H15 N O2 -","- C16 H15 N O2 -","- C128 H120 N8 O16 -","8","1","CI6098","Jia, Xian; Li, Xingshu; Zhou, Zhongyuan; You, Song; Chen, Yubin; Yao, Xinsheng","<i>N</i>-Acetyl-<i>N</i>-[1-(2-naphthalenyl)ethenyl]acetamide","Acta Crystallographica Section E","2002","58","4","o438","o439","10.1107/S160053680200466X","","","0.71073","MoKα","","0.192","0.047","","","0.107","0.164","","","","","","0.96","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201076","16.891","0.003","10.6971","0.0016","9.1959","0.0013","90","","101.673","0.004","90","","1627.2","0.4","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Varacinium chloride","","- C10 H14 Cl N O2 S5 -","- C10 H14 Cl N O2 S5 -","- C40 H56 Cl4 N4 O8 S20 -","4","1","CI6099","Lee, Alex H. F.; Zhou, Zhongyuan; Li, Tianhu; Chan, Albert S. C.","Varacinium chloride","Acta Crystallographica Section E","2002","58","4","o465","o466","10.1107/S160053680200507X","","","0.71073","MoKα","","0.168","0.054","","","0.111","0.133","","","","","","0.81","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201077","5.343","0.0005","16.033","0.002","9.0895","0.0012","90","","95.384","0.012","90","","775.21","0.16","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","N-carboxymethylaspartic acid","N-carboxymethylaspartic acid","","- C6 H9 N O6 -","- C6 H9 N O6 -","- C24 H36 N4 O24 -","4","1","CI6101","Maderová, Jana; Pavelčík, František; Marek, Jaromír","<i>N</i>-(Carboxymethyl)aspartic acid","Acta Crystallographica Section E","2002","58","4","o469","o470","10.1107/S1600536802004117","","","0.71073","MoKα","","0.041","0.033","","","0.079","0.082","","","","","","1.09","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2201078","10.2697","0.0002","9.0419","0.0002","17.9903","0.0004","90","","92.877","0.001","90","","1668.43","0.06","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N,N-(dibenzoyl)-4-chloroaniline","","- C20 H14 Cl N O2 -","- C20 H14 Cl N O2 -","- C80 H56 Cl4 N4 O8 -","4","1","CI6104","Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Jing-Zhi Tian; Yan Zhang; Jian-Hua Xu","<i>N,N</i>-Dibenzoyl-4-chloroaniline","Acta Crystallographica Section E","2002","58","4","o357","o358","10.1107/S1600536802003689","","","0.71073","MoKα","","0.094","0.054","","","0.118","0.131","","","","","","0.89","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201079","36.7805","0.0002","15.563","0.0002","18.6053","0.0002","90","","96.486","0.001","90","","10581.8","0.19","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C59 H53 Cu O P4 S2 -","- C59 H53 Cu O P4 S2 -","- C472 H424 Cu8 O8 P32 S16 -","8","1","CI6105","Theivanayagam C. Deivaraj; Jagadese J. Vittal","[Bis(diphenylphosphino)ethane-<i>P,P</i>')][bis(diphenylphosphino)ethane sulfide-<i>P</i>)](thiobenzoato-<i>S</i>)copper(I)","Acta Crystallographica Section E","2002","58","5","m181","m182","10.1107/S1600536802005810","","","0.71073","MoKα","","0.12","0.071","","","0.155","0.178","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201080","10.1376","0.0001","11.0131","0.0002","13.4833","0.0002","87.599","0.001","71.388","0.001","79.135","0.001","1400.79","0.04","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H70 Cl2 Hg2 N6 O16 -","- C50 H62 Cl2 Hg2 N6 O16 -","- C50 H62 Cl2 Hg2 N6 O16 -","1","0.5","CI6106","Suchada Chantrapromma; Hoong-Kun Fun; Anwar Usman; Chatchanok Karalai; Wanida Wongratchasee; Chanita Ponglimanont; Shaohua Gou","Unexpected ring contraction in a dinuclear mercury(II) complex of a pendant-arm macrocyclic complex","Acta Crystallographica Section E","2002","58","5","m206","m208","10.1107/S1600536802006232","","","0.71073","MoKα","","0.124","0.099","","","0.224","0.238","","","","","","0.96","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201081","8.702","0.001","15","0.002","9.799","0.001","90","","113.7","0.01","90","","1171.2","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","5-Phenyl-1,2,4-Triazolo[3,4-b]benzothiazole","5-Phenyl-1,2,4-triazolo[3,4-b]benzothiazole","","- C14 H9 N3 S -","- C14 H9 N3 S -","- C56 H36 N12 S4 -","4","1","CI6107","A. Abdul Ajees; S. Karthikeyan; G. Jayanthi; V. T. Ramakrishnan","5-Phenyl-1,2,4-triazolo[3,4-<i>b</i>]benzothiazole","Acta Crystallographica Section E","2002","58","4","o380","o381","10.1107/S1600536802004129","","","1.5418","CuKα","","0.048","0.045","","","0.124","0.128","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201082","14.0724","0.0017","16.3184","0.0016","11.768","0.003","90","","103.66","0.02","90","","2626","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,2'-thiobis(2-benzoyl-3-(4-chlorophenyl)oxirane)","","- C30 H20 Cl2 O4 S -","- C30 H20 Cl2 O4 S -","- C120 H80 Cl8 O16 S4 -","4","1","CI6108","R. V. Krishnakumar; M. Subha Nandhini; S. Renuga; S. Natarajan; S. Selvaraj; S. Perumal","2,2'-Thiobis[2-benzoyl-3-(4-chlorophenyl)oxirane]","Acta Crystallographica Section E","2002","58","5","o504","o505","10.1107/S1600536802005986","","","0.71073","MoKα","","0.075","0.044","","","0.095","0.116","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201083","5.9727","0.0004","15.082","0.001","14.3364","0.001","90","","91.895","0.004","90","","1290.72","0.15","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Benzophenone iminium tetrafluoroborate","","- C13 H12 B F4 N -","- C13 H12 B F4 N -","- C52 H48 B4 F16 N4 -","4","1","CI6109","Javier A. Cabeza; Ignacio del Río; Marta Suárez; Santiago García-Granda","Benzophenone iminium tetrafluoroborate","Acta Crystallographica Section E","2002","58","4","o429","o430","10.1107/S160053680200452X","","","1.54178","CuKα","","0.082","0.06","","","0.172","0.196","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201084","8.237","0.005","9.813","0.006","10.237","0.003","65.42","0.04","82.57","0.03","76.34","0.06","730.7","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Bis(μ-η^2^-benzene-1,2-dithiolato-κ^3^S,S':S')bis[(η^6^-p- cymene)ruthenium(II)]","","- C32 H36 Ru2 S4 -","- C32 H36 Ru2 S4 -","- C32 H36 Ru2 S4 -","1","0.5","CI6110","Cabeza, Javier A.; García-Granda, Santiago; Pérez-Priede, Monica; Van der Maelen, Juan Francisco","Bis(μ-η^2^-benzene-1,2-dithiolato-κ^3^<i>S,S</i>':<i>S</i>')bis[(η^6^-<i>p</i>-cymene)ruthenium(II)]","Acta Crystallographica Section E","2002","58","5","m189","m190","10.1107/S1600536802005998","","","0.71073","MoKα","","0.095","0.041","","","0.089","0.105","","","","","","1.02","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201085","8.5729","0.0004","9.3557","0.0004","13.7085","0.0006","107.284","0.001","99.774","0.001","102.644","0.001","991.32","0.08","233","2","233","2","","","","","","","","4","P -1","-P 1","2","","1-Acetyl-3-(1-benzoyl-3-phenyl-propyn-2-ylidene)-3H-indol-2-one","","- C26 H17 N O3 -","- C26 H17 N O3 -","- C52 H34 N2 O6 -","2","1","CI6111","Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Yan Zhang; Jian-Hua Xu","1-Acetyl-3-(1-benzoyl-3-phenylpropyn-2-ylidene)-3<i>H</i>-indol-2-one","Acta Crystallographica Section E","2002","58","5","o511","o513","10.1107/S1600536802006013","","","0.71073","MoKα","","0.094","0.077","","","0.191","0.21","","","","","","0.99","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201086","11.0038","0.001","16.273","0.002","15.578","0.002","90","","100.789","0.01","90","","2740.2","0.6","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H32 Cl2 Fe N5 O2 -","- C26 H32 Cl2 Fe N5 O2 -","- C104 H128 Cl8 Fe4 N20 O8 -","4","1","CI6112","Lee, Sung Jea; Lee, Jun Yong; Kim, Cheal; Nam, Wonwoo; Kim, Youngmee","Triethylammonium dichloro[1,2-bis(2-pyridinecarboxamido)-4,5-dimethylbenzene]ferrate(III)","Acta Crystallographica Section E","2002","58","5","m191","m193","10.1107/S1600536802006001","","","0.71073","MoKα","","0.052","0.04","","","0.113","0.12","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201087","13.919","0.002","14.457","0.003","6.308","0.001","90","","95.07","0.02","90","","1264.4","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2-(p-methylbenzylindene)-1-indanone","2-(p-methylbenzylindene)-1-indanone","","- C17 H14 O -","- C17 H14 O -","- C68 H56 O4 -","4","1","CI6114","A. Abdul Ajees; S. Manikandan; R. Raghunathan","2-(<i>p</i>-Methylbenzylidene)-1-indanone","Acta Crystallographica Section E","2002","58","5","o535","o537","10.1107/S1600536802006190","","","1.5418","CuKα","","0.253","0.065","","","0.138","0.197","","","","","","0.9","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201088","9.6847","0.0009","13.3123","0.0013","17.1221","0.0015","92.613","0.011","90.303","0.011","95.348","0.011","2195.5","0.4","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","Bis(tetrabutylammonium) bis(malonato)oxovanadate(IV)","","- C38 H76 N2 O9 V -","- C38 H76 N2 O9 V -","- C76 H152 N4 O18 V2 -","2","1","CI6115","Therrien, Bruno; Stanislas, Sandrine; Stoeckli-Evans, Helen; Shul'pin, Georgiy B.; Süss-Fink, Georg","Bis(tetrabutylammonium) bis(malonato)oxovanadate(IV)","Acta Crystallographica Section E","2002","58","5","m215","m216","10.1107/S1600536802005913","","","0.71073","MoKα","","0.145","0.068","","","0.159","0.183","","","","","","0.76","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201089","11.58","0.002","14.623","0.002","15.952","0.004","90","","90","","90","","2701.2","0.9","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Arjunolic acid","2α,3β-24-trihydroxyolean-12-en-28-oic acid","","- C30 H48 O5 -","- C30 H48 O5 -","- C120 H192 O20 -","4","1","CI6116","Abdul Ajees, A.; Balakrishna, K.","Arjunolic acid","Acta Crystallographica Section E","2002","58","6","o682","o684","10.1107/S1600536802006451","","","1.5418","CuKα","","0.162","0.05","","","0.122","0.164","","","","","","0.96","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201090","10.647","0.001","7.595","0.001","25.481","0.002","90","","90.298","0.009","90","","2060.5","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","3,3'-Benzylidenebis(4-hydroxy-6-methylcoumarin)","3-[(4-hydroxy-6-methyl-2-oxo-2H-chromen-3-yl)phenylmethyl]-4-hydroxy-6-methyl chromen(2H)-2-one 3-[(4-hydroxy-6-methyl-2-oxo-2H-chromen-3-yl)phenylmethyl]-6-methyl-2-oxo- 2H-chromen-4-olate","","- C27 H20 O6 -","- C27 H20 O6 -","- C108 H80 O24 -","4","1","CI6119","Vijayalakshmi, L.; Parthasarathi, V.; Vora, Vipul; Desai, Bhavik; Shah, Anamik","3,3'-Benzylidenebis(4-hydroxy-6-methylcoumarin)","Acta Crystallographica Section E","2002","58","6","o659","o660","10.1107/S1600536802008346","","","1.5418","CuKα","","0.059","0.038","","","0.091","0.106","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201091","6.727","0.003","12.842","0.0013","15.209","0.007","90","","108.72","0.02","90","","1244.4","0.8","295","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H20 Cu2 N6 O10 P2 -","- C20 H20 Cu2 N6 O10 P2 -","- C40 H40 Cu4 N12 O20 P4 -","2","0.5","CI6121","Breneman, Gary L.; Fields, Michael; Parker, O. Jerry","Di-μ-hypophosphito-bis[(2,2'-bipyridine)copper(II)] nitrate","Acta Crystallographica Section E","2002","58","6","m262","m264","10.1107/S160053680200778X","","","0.71073","MoKα","","","0.0244","","","","0.07","","","","","","1.161","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2201092","10.6135","0.0006","12.6606","0.0008","23.328","0.0016","90","","90","","90","","3134.7","0.3","150","1","150","1","","","","","","","","5","P b c n","-P 2n 2ab","60","","Benzenesulfonyl(1-hydroxy-1,2-dihydronaphthalen-2-yl)acetonitrile","","- C18 H15 N O3 S -","- C18 H15 N O3 S -","- C144 H120 N8 O24 S8 -","8","1","CI6122","Lough, Alan J.; Fagnou, Keith; Lautens, Mark","Benzenesulfonyl(1-hydroxy-1,2-dihydronaphthalen-2-yl)acetonitrile","Acta Crystallographica Section E","2002","58","6","o664","o665","10.1107/S1600536802008115","","","0.71073","MoKα","","0.06","0.048","","","0.122","0.129","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201093","11.2284","0.0001","12.6346","0.0004","12.9056","0.0003","102.453","0.002","96.412","0.002","109.775","0.001","1648.06","0.07","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C39 H38 N2 O5 -","- C39 H38 N2 O5 -","- C78 H76 N4 O10 -","2","1","CI6123","A. Jeyabharathi; M. N. Ponnuswamy; A. Amal Raj; R. Raghunathan; Hoong-Kun Fun","5-Benzoyl-1-cyclohexyl-3-(<i>m</i>-nitrophenyl)-2-phenylpyrrolidine-spiro-4,2'-(6'-methoxy-1'-tetralone)","Acta Crystallographica Section E","2002","58","6","o685","o686","10.1107/S1600536802007791","","","0.71073","MoKα","","0.138","0.068","","","0.148","0.182","","","","","","0.91","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201094","5.1944","0.0006","7.803","0.001","11.05","0.001","90","","98.75","0.01","90","","442.66","0.09","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","L-ornithine nitrate","L-ornithine nitrate","","- C5 H13 N3 O5 -","- C5 H13 N3 O5 -","- C10 H26 N6 O10 -","2","1","CI6124","S. Ramaswamy; B. Sridhar; V. Ramakrishnan; R. K. Rajaram","<small>L</small>-Ornithine nitrate","Acta Crystallographica Section E","2002","58","6","o646","o648","10.1107/S1600536802008358","","","0.71073","MoKα","","0.039","0.037","","","0.088","0.09","","","","","","1.16","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201095","13.4782","0.0015","6.0737","0.0007","21.918","0.003","90","","107.327","0.003","90","","1712.8","0.4","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,3,4,5-tetrahydro-r-2,c-4-diphenyl-1,5-benzothiazepine","","- C21 H19 N S -","- C21 H19 N S -","- C84 H76 N4 S4 -","4","1","CI6126","Laavanya, Parthasarathi; Panchanatheswaran, Krishnaswamy; Muthukumar, Manivannan; Jeyaraman, Ramasubbu; Krause Bauer, Jeanette A.","2,3,4,5-Tetrahydro-<i>r</i>-2,<i>c</i>-4-diphenyl-1,5-benzothiazepine","Acta Crystallographica Section E","2002","58","6","o701","o702","10.1107/S160053680200853X","","","0.71073","MoKα","","0.149","0.054","","","0.103","0.131","","","","","","0.86","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201096","5.9011","0.0002","7.2728","0.0004","17.1567","0.001","90","","90","","90","","736.32","0.06","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1,6:3,4-di-anhydro-2-azido-2-deoxygalactopyranose","","- C6 H7 N3 O3 -","- C6 H7 N3 O3 -","- C24 H28 N12 O12 -","4","1","CM6001","Barnes, John C.; Brimacombe, John S.; Paterson, Michael J.","1,6:3,4-Dianhydro-2-azido-2-deoxy-β-<small>D</small>-galactopyranose","Acta Crystallographica Section E","2002","58","5","o573","o574","10.1107/S1600536802006931","","","0.71073","MoKα","","0.0491","0.041","","","0.1051","0.1113","","","","","","1.076","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201097","7.9938","0.0001","14.4485","0.0002","9.8439","0.0001","90","","112.278","0.001","90","","1052.09","0.02","183","2","183","2","","","","","","","","3","P 1 21 1","P 2yb","4","","2,2'-dimethoxy-4,4'-(tetrahydro-1H,3H-furo[3,4-c]furan-1,4-diyl)diphenyl 1,1'-diacetate","","- C24 H26 O8 -","- C24 H26 O8 -","- C48 H52 O16 -","2","1","CM6002","Langer, Vratislav; Lundquist, Knut; Stomberg, Rolf","The diacetate of (+)-pinoresinol","Acta Crystallographica Section E","2002","58","4","o402","o404","10.1107/S1600536802004403","","","0.71073","MoKα","","0.0751","0.0523","","","0.1327","0.1492","","","","","","1.001","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201098","13.7932","0.0002","4.6909","0.0001","25.2138","0.0003","90","","93.06","","90","","1629.07","0.05","183","2","183","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","threo-1-(3,4-Dimethoxyphenyl)-2-(2-methoxyphenoxy)-1,3-propanediol","","- C18 H22 O6 -","- C18 H22 O6 -","- C72 H88 O24 -","4","1","CM6003","Langer, Vratislav; Lundquist, Knut","<i>threo</i>-1-(3,4-Dimethoxyphenyl)-2-(2-methoxyphenoxy)-1,3-propanediol","Acta Crystallographica Section E","2002","58","4","o433","o435","10.1107/S1600536802004828","","","0.71073","MoKα","","0.0924","0.0654","","","0.1592","0.1752","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201099","10.8436","0.0011","6.0348","0.0006","16.336","0.002","90","","110.001","0.002","90","","1004.54","0.19","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2,2'-thenoin","1,2-di-2-thienyl-2-hydroxyethanone","","- C10 H8 O2 S2 -","- C10 H8 O2 S2 -","- C40 H32 O8 S8 -","4","1","CM6004","Crundwell, Guy; Meskill, Thomas; Sayers, David; Kantardjieff, Katherine","1,2-Di-2-thienyl-2-hydroxyethanone (2,2'-thenoin)","Acta Crystallographica Section E","2002","58","6","o666","o667","10.1107/S1600536802008516","","","0.71073","MoKα","","0.0587","0.0479","","","0.1643","0.1725","","","","","","1.371","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201100","8.2503","0.0017","16.421","0.003","15.041","0.003","90","","100.86","0.03","90","","2001.2","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3,3'-thenoin","1,2-di-3-thienyl-2-hydroxyethanone","","- C10 H8 O2 S2 -","- C10.004 H8.003 O2 S2.001 -","- C80.032 H64.024 O16 S16.008 -","8","2","CM6005","Crundwell, Guy; Meskill, Thomas; Sayers, David; Kantardjieff, Katherine","1,2-Di-3-thienyl-2-hydroxyethanone (3,3'-thenoin)","Acta Crystallographica Section E","2002","58","6","o668","o670","10.1107/S1600536802008528","","","0.71073","MoKα","","0.1164","0.063","","","0.1597","0.1941","","","","","","1.135","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201101","11.2558","0.0006","14.5078","0.0007","31.395","0.0017","90","","90","","90","","5126.7","0.5","193","2","193","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H28 N4 S4 Zn -","- C24 H28 N4 S4 Zn -","- C192 H224 N32 S32 Zn8 -","8","1","CM6006","Guo, Tengwen; Lai, Chian Sing; Tan, Xi Jie; Teo, Chin Seng; Tiekink, Edward R. T.","(4,7-Dimethyl-1,10-phenanthroline)bis(pyrrolinedithiocarbamato)zinc(II)","Acta Crystallographica Section E","2002","58","5","m239","m241","10.1107/S1600536802007572","","","0.71069","MoKα","","0.054","0.043","","","0.106","0.112","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201102","14.8445","0.0005","5.7702","0.0003","20.741","0.009","90","","104.037","0.002","90","","1723.5","0.8","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Cis-1,2-dibromostilbene, diphenylacetylene (2:1)","Cis-1,2-dibromo-1,2-diphenylethene, diphenylethyne (2:1)","","- C42 H30 Br4 -","- C42 H30 Br4 -","- C84 H60 Br8 -","2","0.5","CM6007","Barnes, John C.; Chudek, John A.","<i>cis</i>-1,2-Dibromo-1,2-diphenylethene‒diphenylethyne (2/1)","Acta Crystallographica Section E","2002","58","6","o703","o705","10.1107/S160053680200942X","","","0.71073","MoKα","","0.088","0.0554","","","0.1305","0.1482","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201103","13.6452","0.0005","10.1594","0.0005","10.0848","0.0004","90","","100.163","0.002","90","","1376.09","0.1","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","tert-Butyl 4-acetyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate","","- C12 H21 N O4 -","- C12 H21 N O4 -","- C48 H84 N4 O16 -","4","1","CV6085","Sawatzki, Peter; Mikeska, Thomas; Nieger, Martin; Hupfer, Heike; Kolter, Thomas","<i>tert</i>-Butyl 4-acetyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate","Acta Crystallographica Section E","2002","58","4","o359","o361","10.1107/S1600536802002477","","","0.71073","MoKα","","0.0455","0.0382","","","0.1008","0.1044","","","","","","1.066","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201104","14.121","0.015","5.245","0.002","17.384","0.015","90","","108.99","0.11","90","","1217.5","1.9","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","thiabendazolium perchlorate","","","- C10 H8 Cl N3 O4 S -","- C10 H8 Cl N3 O4 S -","- C40 H32 Cl4 N12 O16 S4 -","4","1","CV6094","Stanley, Nithianantham; Panneerselvam, Pathus; Thomas Muthiah, Packianathan","A hydrogen-bonded supramolecular chain in thiabendazolium perchlorate","Acta Crystallographica Section E","2002","58","4","o426","o428","10.1107/S1600536802004397","","","0.71073","MoKα","","0.104","0.0679","","","0.1565","0.1816","","","","","","1.223","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201105","10.519","0.0001","9.1443","0.0002","18.1947","0.0003","90","","94.148","0.001","90","","1745.54","0.05","183","2","183","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-Acetyl-N,N-dibenzoylphenylamine","","- C22 H17 N O3 -","- C22 H17 N O3 -","- C88 H68 N4 O12 -","4","1","CV6095","Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Jing-Zhi Tian; Yan Zhang; Jian-Hua Xu","4-Acetyl-<i>N,N</i>-dibenzoylphenylamine","Acta Crystallographica Section E","2002","58","4","o377","o379","10.1107/S1600536802004099","","","0.71073","MoKα","","0.0697","0.0543","","","0.1273","0.1346","","","","","","0.959","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201106","10.3404","0.0001","36.9797","0.0007","9.4929","0.0001","90","","108.993","0.001","90","","3432.32","0.08","170","2","170","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2-Nitrobenzanilide","2-Phenyl-4-(2'-hydroxyphenyl)-2,3,4,5-tetrahydro-1,5-benzothiazepine","","- C21 H19 N O S -","- C21 H19 N O S -","- C168 H152 N8 O8 S8 -","8","2","CV6096","Ansari, Farzana; Fedorchuk, Chantall; Parvez, Masood; Umbreen, Sumaira; Saghir, Shazia","Diastereomers of 4-(2-hydroxyphenyl)-2-phenyl-2,3,4,5-tetrahydro-1,5-benzothiazepine","Acta Crystallographica Section E","2002","58","4","o422","o425","10.1107/S1600536802004580","","","0.71069","MoKα","","0.183","0.068","","","0.123","0.148","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201107","5.1428","0.0016","8.908","0.003","31.687","0.011","90","","90","","90","","1451.6","0.8","213","2","213","2","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","","","","- C16 H26 -","- C16 H26 -","- C64 H104 -","4","1","CV6098","Merz, Klaus","1-Phenyldecane","Acta Crystallographica Section E","2002","58","4","o450","o451","10.1107/S1600536802004725","","","0.71073","MoKα","","0.0748","0.0433","","","0.1049","0.1238","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201108","15.342","0.005","17.087","0.002","11.274","0.002","90","","100.4","0.02","90","","2906.9","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","tetracarbonyltungsten(0)-bis(μ-dimethylphosphido-dicyclopentadienyl hydridomolybdenum(IV))","","- C28 H34 Mo2 O4 P2 W -","- C28 H34 Mo2 O4 P2 W -","- C112 H136 Mo8 O16 P8 W4 -","4","1","CV6099","Kubicki, Marek M.; Barré, Christophe; Moïse, Claude","Tetracarbonyltungsten(0)-bis(μ-dimethylphosphido)-bis[dicyclopentadienylhydridomolybdenum(IV)]","Acta Crystallographica Section E","2002","58","4","m152","m153","10.1107/S1600536802004865","","","0.71073","MoKα","","0.1518","0.0421","","0.1115","","0.084","","","0.995","","","1.064","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201109","9.0481","0.0004","8.2368","0.0004","28.4787","0.0013","90","","97.384","0.001","90","","2104.84","0.17","213","2","213","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","5-(1,4-dimethyl-4-phenyl-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2,4- benzenetricarbonitrile","","- C27 H21 N3 -","- C27 H21 N3 -","- C108 H84 N12 -","4","1","CV6100","Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Min Zhang; Jian-Hua Xu","5-(1,4-Dimethyl-4-phenyl-1,2,3,4-tetrahydro-1-naphthyl)-1,2,4-benzenetricarbonitrile","Acta Crystallographica Section E","2002","58","4","o467","o468","10.1107/S1600536802005275","","","0.71073","MoKα","","0.1155","0.0577","","","0.1181","0.1366","","","","","","0.85","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201110","11.6177","0.0006","4.6546","0.0002","31.9119","0.0016","90","","93.047","0.001","90","","1723.22","0.14","213","2","213","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-acetyl-2,N-dibenzoylaniline","","- C22 H17 N O3 -","- C22 H17 N O3 -","- C88 H68 N4 O12 -","4","1","CV6101","Usman, Anwar; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Chantrapromma, Suchada; Tian, 'Jing-Zhi; Zhang, Yan; Xu, Jian-Hua","4-Acetyl-2,<i>N</i>-dibenzoylaniline","Acta Crystallographica Section E","2002","58","5","o492","o494","10.1107/S1600536802005433","","","0.71073","MoKα","","0.1157","0.0674","","","0.1527","0.1718","","","","","","0.871","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201111","10.316","0.003","16.988","0.005","11.635","0.003","90","","97.971","0.007","90","","2019.3","1","294","2","294","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(S)-2,2'-bis(dicyclohexylphosphinoamino)-1,1'-binaphthyl","","- C44 H58 N2 P2 -","- C44 H58 N2 P2 -","- C88 H116 N4 P4 -","2","1","CV6103","Guo, Rongwei; Wang, Lailai; Wu, Jing; Choi, Michael C. K.; Zhou, Zhongyuan","(<i>S</i>)-2,2'-Bis(dicyclohexylphosphinoamino)-1,1'-binaphthyl","Acta Crystallographica Section E","2002","58","6","o598","o599","10.1107/S1600536802006141","","","0.71073","MoKα","","0.1114","0.0681","","","0.1413","0.1554","","","","","","1.133","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201112","10.1595","0.0012","19.961","0.002","22.36","0.003","90","","90","","90","","4534.5","0.9","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(R)-2,2'-bis[bis(3,5-dimethylphenyl)phosphinoamino]- 5,5',6,6',7,7',8,8'-octahydro-1,1'-binaphthyl","","- C52 H58 N2 P2 -","- C52 H58 N2 P2 -","- C208 H232 N8 P8 -","4","1","CV6105","Guo, Rongwei; Ao-Yueng, Terry T. L.; Choi, Michael C. K.; Zhou, Zhongyuan","(<i>R</i>)-2,2'-Bis[bis(3,5-dimethylphenyl)phosphinoamino]-5,5',6,6',7,7',8,8'-octahydro-1,1'-binaphthyl","Acta Crystallographica Section E","2002","58","5","o544","o545","10.1107/S1600536802006098","","","0.71073","MoKα","","0.2161","0.0509","","","0.0811","0.1024","","","","","","0.852","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201113","12.793","0.003","14.89","0.003","8.957","0.0018","90","","99.42","0.03","90","","1683.2","0.6","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(phenanthren-9-ylthiomethylthio)tetrahydropyran","","- C20 H20 O S2 -","- C20 H20 O S2 -","- C80 H80 O4 S8 -","4","1","CV6107","Jarno Kansikas; Kaija Sipilä","2-(Phenanthren-9-ylthiomethylthio)tetrahydropyran at 193K","Acta Crystallographica Section E","2002","58","6","o600","o602","10.1107/S1600536802006542","","","1.5418","CuKα","","0.0489","0.0353","","","0.0924","0.0991","","","","","","1.023","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201114","12.889","0.003","10.854","0.002","11.12","0.002","90","","105.23","0.03","90","","1501","0.6","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","(4-tert-butyl-2-methylthiosemicarbazido)(O-methyldithiophosphato)palladium(II)","","- C7 H17 N3 O2 P Pd S3 -","- C7 H17 N3 O2 P Pd S3 -","- C28 H68 N12 O8 P4 Pd4 S12 -","4","1","CV6108","Janča, Michal; Taraba, Jan; Příhoda, Jiří","(4-<i>tert</i>-Butyl-2-methylthiosemicarbazido)(<i>O</i>-methyldithiophosphato)palladium(II)","Acta Crystallographica Section E","2002","58","6","m245","m247","10.1107/S1600536802007237","","","0.71069","MoKα","","0.08","0.0595","","","0.1039","0.1104","","","","","","1.158","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201115","5.569","0.002","6.205","0.003","7.875","0.004","77.94","0.06","79.17","0.04","71.29","0.05","249.9","0.2","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","2-[(1-Cyano-1-methylethyl)peroxy]-2-methylpropanenitrile","","- C8 H12 N2 O2 -","- C8 H12 N2 O2 -","- C8 H12 N2 O2 -","1","0.5","CV6109","Gravestock, David; Dovey, Martin C.","2-[(1-Cyano-1-methylethyl)peroxy]-2-methylpropanenitrile","Acta Crystallographica Section E","2002","58","6","o631","o633","10.1107/S1600536802008309","","","0.71069","MoKα","","","0.0631","","","","0.2296","","","","","","1.102","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201116","5.1608","0.0001","9.4909","0.0002","25.8492","0.0007","90","","90","","90","","1266.11","0.05","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","S-methyl trans-cis-β-N-(2-hydroxynaphthyl)methylenedithiocarbazate","","- C13 H12 N2 O S2 -","- C13 H12 N2 O S2 -","- C52 H48 N8 O4 S8 -","4","1","CV6111","Gomathy Sethuraman; Bohari M Yamin; Mustaffa Samsudin; Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun","<i>S</i>-Methyl <i>trans</i>-<i>cis</i>-β-<i>N</i>-(2-hydroxynaphthyl)methylenedithiocarbazate","Acta Crystallographica Section E","2002","58","6","o649","o651","10.1107/S1600536802008231","","","0.71073","MoKα","","0.0899","0.0681","","","0.1513","0.1598","","","","","","1.012","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201117","9.5077","0.0003","11.1226","0.0004","14.0147","0.0005","90","","97.823","0.001","90","","1468.27","0.09","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-benzoyl-N'-(2,6-dimethylphenyl)thiourea","","- C16 H16 N2 O S -","- C16 H16 N2 O S -","- C64 H64 N8 O4 S4 -","4","1","CV6112","Anwar Usman; Ibrahim Abdul Razak; Suhana Satar; Maisara Abdul Kadir; Bohari M Yamin; Hoong-Kun Fun","<i>N</i>-Benzoyl-<i>N</i>'-(2,6-dimethylphenyl)thiourea","Acta Crystallographica Section E","2002","58","6","o656","o658","10.1107/S1600536802008450","","","0.71073","MoKα","","0.0801","0.0531","","","0.1395","0.1481","","","","","","0.937","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201118","14.335","0.0004","5.0304","0.0008","9.5755","0.0013","90","","104.571","0.004","90","","668.29","0.14","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","trans-3,6-Dibenzyl-1,2,4,5-tetrazine","","- C16 H14 N4 -","- C16 H14 N4 -","- C32 H28 N8 -","2","0.5","CV6113","Barnes, John C.","<i>trans</i>-3,6-Dibenzyl-1,2,4,5-tetrazine","Acta Crystallographica Section E","2002","58","6","o699","o700","10.1107/S1600536802008991","","","0.71073","MoKα","","0.0972","0.0518","","","0.12","0.1411","","","","","","0.968","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201119","11.291","0.001","13.644","0.002","11.384","0.002","90","","115.94","0.01","90","","1577.1","0.4","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","H2AMAP-PIP-THIAZOLE","2-{[1-(2-Aminophenyl)ethylidene]hydrazino}-5-piperidyl-1,3,4-thiadiazole","","- C15 H20 N6 S -","- C15 H20 N6 S -","- C60 H80 N24 S4 -","4","1","CV6115","Amal A. Nassar; Valdés-Martínez, Jesús; Simón Hernández-Ortega; Douglas X. West","2-{[1-(2-Aminophenyl)ethylidene]hydrazino}-5-piperidyl-1,3,4-thiadiazole","Acta Crystallographica Section E","2002","58","6","o694","o695","10.1107/S1600536802009170","","","0.71073","MoKα","","0.1109","0.047","","","0.0799","0.0902","","","","","","0.881","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201120","10.964","0.003","12.57","0.003","13.84","0.004","90","","96.822","0.005","90","","1893.9","0.9","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-(2,3-Dihydro-1,5-dimethyl-3-oxo-2-phenylpyrazol-4-ylimino)-4,4,4-trifluoro- 1-(2-thienyl)butane-1,2-dione","","- C19 H14 F3 N3 O3 S -","- C19 H14 F3 N3 O3 S -","- C76 H56 F12 N12 O12 S4 -","4","1","DN6020","Jin-Ling Wang; Ming Yu; Xiu-Mei Su; Fang-Ming Miao","3-(2,3-Dihydro-1,5-dimethyl-3-oxo-2-phenylpyrazol-4-ylimino)-4,4,4-trifluoro-1-(2-thienyl)butane-1,2-dione","Acta Crystallographica Section E","2002","58","4","o385","o387","10.1107/S1600536802004233","","","0.71073","MoKα","","0.061","0.0417","","","0.1039","0.1166","","","","","","1.018","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2201121","11.269","0.002","11.376","0.001","25.738","0.003","90","0.02","94.47","0.02","90","0.02","3289.5","0.8","293","2","","","","","","","","","","6","C 1 c 1","C -2yc","9","","N',N'-Dibenzyl-N-(2-chloroethyl)sulfamide","","- C16 H19 Cl N2 O2 S -","- C16 H19 Cl N2 O2 S -","- C128 H152 Cl8 N16 O16 S8 -","8","2","DN6023","Dokhane, Sohere; Benali-Cherif, Nourredine; Abdaoui, Mohamed","<i>N</i>',<i>N</i>'-Dibenzyl-<i>N</i>-(2-chloroéthyl)sulfamide","Acta Crystallographica Section E","2002","58","5","o570","o572","10.1107/S1600536802006463","","","0.71073","MoKα","","0.1038","0.0456","","","0.084","0.117","","","","","","1.11","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201122","8.824","0.001","10.547","0.001","18.928","0.002","90","","90","","90","","1761.6","0.3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","1,4-Butanediammonium chromate","","- C4 H14 Cr N2 O4 -","- C4 H14 Cr N2 O4 -","- C32 H112 Cr8 N16 O32 -","8","1","DN6024","Chebbi, Hammouda; Driss, Ahmed","1,4-Butanediammonium chromate","Acta Crystallographica Section E","2002","58","4","m147","m149","10.1107/S1600536802003975","","","0.71073","MoKα","","0.0316","0.0237","","","0.0702","0.0745","","","","","","1.083","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201123","8.3906","0.0008","8.4339","0.0008","12.09","0.0011","90","","98.036","0.012","90","","847.15","0.14","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H8 N2 O2 S2 -","- C6 H8 N2 O2 S2 -","- C24 H32 N8 O8 S8 -","4","1","DN6025","Evain, Michel; Landreau, Cyrille; Deniaud, David; Reliquet, Alain; Meslin, Jean Claude","2-Methyl-6,7-dihydrothiazolo[3,2-<i>b</i>][1,2,4]thiadiazine 1,1-dioxide","Acta Crystallographica Section E","2002","58","4","o362","o363","10.1107/S1600536802003987","","","0.71069","MoKα","","0.0866","0.0448","","","0.1006","0.1104","","","","","","1.42","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201124","28.4","0.007","5.1148","0.0002","18.321","0.004","90","0.01","120.93","0.01","90","0.01","2282.9","0.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-Méthyl-3-(3-méthyl-1H-pyrazol-5-yl)pyrido[1,2-a]pyrimidin-4-one","","- C13 H12 N4 O -","- C13 H12 N4 O -","- C104 H96 N32 O8 -","8","1","DN6026","Elotmani, B.; Elmahi, M.; Essassi, E. M.; Pierrot, M.","2-Méthyl-3-(3-méthyl-1<i>H</i>-pyrazol-5-yl)pyrido[1,2-<i>a</i>]pyrimidin-4-one","Acta Crystallographica Section E","2002","58","4","o388","o389","10.1107/S1600536802004336","","","0.7107","MoKα","","0.0476","0.0399","","","0.1038","0.1119","","","","","","1.054","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2201125","12.399","0.005","12.808","0.0009","13.348","0.005","90","","138.032","0.018","90","","1417.5","0.9","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl 2,2,4,8-tetramethyl-6-oxo-2H,6H-pyrimidino[2,1-b]thiazine-7-carboxylate","","- C13 H16 N2 O3 S -","- C13 H16 N2 O3 S -","- C52 H64 N8 O12 S4 -","4","1","DN6027","Evain, Michel; Landreau, Cyrille; Deniaud, David; Reliquet, Alain; Meslin, Jean Claude","Methyl 2,2,4,8-tetramethyl-6-oxo-2<i>H</i>,6<i>H</i>-pyrimidino[2,1-<i>b</i>]thiazine-7-carboxylate","Acta Crystallographica Section E","2002","58","4","o452","o453","10.1107/S1600536802005135","","","0.71069","MoKα","","0.0996","0.0453","","","0.0881","0.1021","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201126","19.3584","0.0002","7.6117","0.0001","26.1758","0.0004","90","","107.7","0.001","90","","3674.43","0.09","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","2-(3,4-Dimethoxyphenyl)-5,7-dimethoxy-3,8-dimethyl-4H-1-benzopyran-4-one","","- C21 H22 O6 -","- C21 H22 O6 -","- C168 H176 O48 -","8","1","DN6028","Stomberg, Rolf; Langer, Vratislav; Hauteville, Marcelle","2-(3,4-Dimethoxyphenyl)-5,7-dimethoxy-3,8-dimethyl-4<i>H</i>-1-benzopyran-4-one","Acta Crystallographica Section E","2002","58","5","o506","o508","10.1107/S1600536802006074","","","0.71073","MoKα","","0.0819","0.061","","","0.1712","0.1911","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201127","8.689","0.0004","18.8253","0.0009","13.3728","0.0007","90","","103.47","0.003","90","","2127.26","0.18","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1-(3-Chloro-4-tolyl)-5-méthylthio-3a-phényl-3a,11-dihydro-4H-[1,2,4] oxadiazolo[5,4-d][1,5]benzodiazépine","","- C24 H20 Cl N3 O S -","- C24 H20 Cl N3 O S -","- C96 H80 Cl4 N12 O4 S4 -","4","1","DN6029","El Hazazi, S.; Baouid, A.; Hasnaoui, A.; Pierrot, M.","1-(3-Chloro-4-tolyl)-5-méthylthio-3a-phényl-3a,11-dihydro-4<i>H</i>-[1,2,4]oxadiazolo[5,4-<i>d</i>][1,5]benzodiazépine","Acta Crystallographica Section E","2002","58","5","o548","o550","10.1107/S1600536802006761","","","0.71073","MoKα","","0.0947","0.0671","","","0.1185","0.1303","","","","","","1.114","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201128","8.752","0.002","10.473","0.002","15.685","0.003","90","","101.94","0.02","90","","1406.6","0.5","298","2","298","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C26 H30 Cl4 Fe N5 O2 -","- C26 H30 Cl4 Fe N5 O2 -","- C52 H60 Cl8 Fe2 N10 O4 -","2","1","DN6031","Lee, Sung Jea; Lee, Jun Yong; Yang, Hyun Woong; Kim, Cheal; Nam, Wonwoo; Kim, Youngmee","Tetraethylammonium dichloro[4,5-dichloro-1,2-bis(2-pyridine-2-carboxamido)benzene]ferrate(III), [Et~4~N][(bpc)FeCl~2~]","Acta Crystallographica Section E","2002","58","6","m313","m315","10.1107/S1600536802009273","","","0.71073","MoKα","","0.1195","0.0443","","","0.0839","0.102","","","","","","1.026","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201129","6.6906","0.0005","7.3727","0.0005","8.9552","0.0005","90","","90","","90","","441.74","0.05","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","copper(II) hydrogenphosphite dihydrate","","","- Cu H5 O5 P -","- Cu H5 O5 P -","- Cu4 H20 O20 P4 -","4","1","MG6003","El Bali, Brahim; Massa, Werner","Redetermination of copper(II) hydrogenphosphite dihydrate","Acta Crystallographica Section E","2002","58","4","i29","i31","10.1107/S1600536802003574","","","0.71073","MoKα","","0.0226","0.022","","","0.0468","0.0472","","","","","","1.104","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201130","12.604","0.001","12.614","0.001","14.782","0.002","67.85","0.01","66.02","0.01","74.08","0.01","1968.4","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Barium palladium selenostannate selenide","","","- Ba8 Pd Se18.25 Sn4 -","- Ba8 Pd Se18.25 Sn4 -","- Ba16 Pd2 Se36.5 Sn8 -","2","1","MG6004","Johrendt, Dirk","Barium palladium selenostannate perselenostannate diselenide, Ba~8~Pd(SnSe~4~)~3.75~(SnSe~5~)~0.25~(Se~2~)","Acta Crystallographica Section E","2002","58","6","i52","i55","10.1107/S1600536802009261","","","0.71073","MoKα","","0.0812","0.0374","","","0.0704","0.0773","","","","","","0.672","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201131","8.5376","0.0004","11.0544","0.0005","12.4672","0.0005","83.144","0.001","82.652","0.001","69.848","0.001","1091.94","0.08","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H34 As6 N16 O34 V4 -","- C8 H34 As6 N16 O34 V4 -","- C8 H34 As6 N16 O34 V4 -","1","0.5","MG6008","Bremner, Colin A.; Harrison, William T. A.","Guanylurea vanadium arsenate","Acta Crystallographica Section E","2002","58","6","m254","m256","10.1107/S1600536802007900","","","0.71073","MoKα","","0.0311","0.0236","","","0.0625","0.0643","","","","","","1.012","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2201132","7.2263","0.0003","9.7728","0.0004","10.2349","0.0005","63.409","0.001","87.162","0.001","72.969","0.001","615.18","0.05","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Ammonium zinc hydrogen phosphite hydrate","","","- H11 N O11 P3 Zn2.5 -","- H11 N O11 P3 Zn2.5 -","- H22 N2 O22 P6 Zn5 -","2","1","MG6009","Gordon, Laura E.; Harrison, William T. A.","Ammonium zinc hydrogenphosphite hydrate, (NH~4~)~2~Zn~5~(HPO~3~)~6~·4H~2~O","Acta Crystallographica Section E","2002","58","6","i41","i43","10.1107/S1600536802008243","","","0.71073","MoKα","","0.0326","0.0265","","","0.0719","0.0741","","","","","","1.018","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201133","8.35","0.002","13.925","0.003","14.645","0.004","90","","95.88","0.02","90","","1693.9","0.7","178","2","178","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C21 H26 Fe -","- C21 H26 Fe -","- C84 H104 Fe4 -","4","1","NA6141","Jones, Peter G.; Hopf, Henning; Hartig, Thorsten","(η^5^-4,7-Dimethylindenyl)(η^5^-pentamethylcyclopentadienyl)iron(II)","Acta Crystallographica Section E","2002","58","4","m139","m140","10.1107/S1600536802003884","","","0.71073","MoKα","","0.0503","0.0356","","","0.0824","0.0891","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201134","6.589","0.001","13.365","0.003","14.892","0.003","90","","91.62","0.03","90","","1310.9","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","quaternary azaaromatic salt","5-ethylbenzo[c]-1,5-naphthyridinium iodide","","- C14 H13 I N2 -","- C14 H13 I N2 -","- C56 H52 I4 N8 -","4","1","NA6142","Marciniak, Bernard; Pavlyuk, Volodymyr; Dondela, Barbara","5-Ethylbenzo[<i>c</i>]-1,5-naphthyridinium iodide","Acta Crystallographica Section E","2002","58","5","o484","o486","10.1107/S1600536802005354","","","0.71069","MoKα","","0.0457","0.0424","","","0.1386","0.1479","","","","","","1.336","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201135","11.401","0.002","9.605","0.002","5.142","0.001","80.03","0.03","79.23","0.03","76.63","0.03","533.2","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","C12 H9 N2 Br","5-benzo[c]1,5-naphthyridinium bromide","","- C12 H9 Br N2 -","- C12 H9 Br N2 -","- C24 H18 Br2 N4 -","2","1","NA6143","Marciniak, Bernard; Pavlyuk, Volodymyr; Deska, Malgorzata","5-Benzo[<i>c</i>]-1,5-naphthyridinium bromide","Acta Crystallographica Section E","2002","58","5","o487","o488","10.1107/S1600536802005366","","","0.71069","MoKα","","0.0348","0.0251","","","0.1026","0.1108","","","","","","0.804","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201136","7.057","0.001","7.057","0.001","22.372","0.004","90","","90","","120","","964.9","0.3","293","2","293","2","","","","","","","","5","P 31","P 31","144","C14 H13 N2 O Br","","","- C14 H13 Br N2 O -","- C14 H13 Br N2 O -","- C42 H39 Br3 N6 O3 -","3","1","NA6144","Marciniak, Bernard; Pavlyuk, Volodymyr; Deska, Malgorzata","6-(2-Hydroxyethyl)benzo[<i>f</i>]-1,7-naphthyridin-6-ium bromide","Acta Crystallographica Section E","2002","58","5","o489","o491","10.1107/S1600536802005378","","","0.71069","MoKα","","0.0247","0.0216","","","0.067","0.0678","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201137","10.029","0.002","10.198","0.002","12.233","0.002","74.96","0.02","88.12","0.02","61.38","0.02","1054.5","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Aqua(hexacyano ferrato-N)bis(μ-glycine)glycinelantanum(III) monohydrate","","- C12 H19 Fe La N9 O8 -","- C12 H19 Fe La N9 O8 -","- C24 H38 Fe2 La2 N18 O16 -","2","1","NA6145","Dago Morales, Angel; Novoa de Armas, Héctor","Aqua(hexacyanoferrato-<i>N</i>)bis(μ-glycine)glycinelanthanum(III) monohydrate","Acta Crystallographica Section E","2002","58","4","m157","m158","10.1107/S1600536802004968","","","0.71073","MoKα","","0.0613","0.0557","","0.1547","0.149","0.1545","","","1.061","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201138","4.607","0.0002","11.2898","0.0004","24.9751","0.0012","90","","90","","90","","1299.01","0.1","150","1","150","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1R,2R)-2-(2-Bromophenoxy)-1,2-dihydronaphthalen-1-ol","","- C16 H13 Br O2 -","- C16 H13 Br O2 -","- C64 H52 Br4 O8 -","4","1","NA6146","Fagnou, Keith; Lautens, Mark; Lough, Alan J.","(1<i>R</i>,2<i>R</i>)-2-(2-Bromophenoxy)-1,2-dihydronaphthalen-1-ol","Acta Crystallographica Section E","2002","58","5","o540","o541","10.1107/S1600536802006384","","","0.71073","MoKα","","0.058","0.039","","","0.078","0.085","","","","","","1.018","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201139","7.818","0.0002","11.285","0.0003","18.683","0.0005","90.906","0.001","91.966","0.0011","90.094","0.0014","1647.15","0.08","150","1","150","1","","","","","","","","5","P 1","P 1","1","","(1R,2R,5R,6S)-5,6-Bis(4-methoxybenzyloxymethyl)-2-(methylphenylamino)cyclohex- 3-enyl 4-bromobenzoate","","- C38 H40 Br N O6 -","- C38 H40 Br N O6 -","- C76 H80 Br2 N2 O12 -","2","2","NA6147","Lautens, Mark; Lough, Alan J.; Fagnou, Keith","(1<i>R</i>,2<i>R</i>,5<i>R</i>,6<i>S</i>)-5,6-Bis(4-methoxybenzyloxymethyl)-2-(methylphenylamino)cyclohex-3-enyl 4-bromobenzoate","Acta Crystallographica Section E","2002","58","5","o542","o543","10.1107/S1600536802006499","","","0.7107","MoKα","","0.082","0.06","","","0.137","0.15","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201140","6.541","0.0007","10.5452","0.001","10.3952","0.0012","90","","96.029","0.009","90","","713.05","0.13","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","p-Bis(trimethylsilyl)benzene","","- C12 H22 Si2 -","- C12 H22 Si2 -","- C24 H44 Si4 -","2","0.5","NA6148","Haberecht, Monika; Lerner, Hans-Wolfram; Bolte, Michael","<i>p</i>-Bis(trimethylsilyl)benzene: rerefinement against new intensity data","Acta Crystallographica Section E","2002","58","4","o436","o437","10.1107/S1600536802004671","","","0.71073","MoKα","","0.0442","0.0381","","","0.0893","0.0917","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201141","13.7474","0.0003","13.7474","0.0003","31.9658","0.0014","90","","90","","120","","5231.9","0.3","160","2","160","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C66 H72 I3 N12 O6 Tb -","- C66 H72 I3 N12 O6 Tb -","- C198 H216 I9 N36 O18 Tb3 -","3","0.166667","NA6149","Clegg, William; Bourhill, Grant; Sage, Ian","Hexakis(antipyrine-<i>O</i>)terbium(III) triiodide at 160K: confirmation of a centrosymmetric structure for a brilliantly triboluminescent complex","Acta Crystallographica Section E","2002","58","4","m159","m161","10.1107/S1600536802005093","","","0.71073","MoKα","","0.0224","0.0185","","","0.0459","0.0474","","","","","","1.098","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201142","12.352","0.002","13.616","0.005","12.118","0.003","102.47","0.02","102.31","0.02","85.59","0.02","1943.2","0.9","297","","","","","","","","","","","5","P -1","-P 1","2","","","","- C50 H34 Co N5 O2 -","- C50 H34 Co N5 O2 -","- C100 H68 Co2 N10 O4 -","2","1","NA6150","Ohba, Shigeru; Seki, Hiroshi","Nitro(α,β,γ,δ-tetraphenylporphyrinato)cobalt(III) benzene solvate","Acta Crystallographica Section E","2002","58","4","m162","m164","10.1107/S1600536802005160","","","0.7107","MoKα","","","0.0572","","","","0.1749","","","","","","1.07","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2201143","14.713","0.003","19.54","0.006","13.413","0.004","90","","101.74","0.02","90","","3775.5","1.8","297","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C45 H32 Cl2 Co N5 O3 -","- C45 H32 Cl2 Co N5 O3 -","- C180 H128 Cl8 Co4 N20 O12 -","4","1","NA6151","Ohba, Shigeru; Seki, Hiroshi","Aquanitro(α,β,γ,δ-tetraphenylporphyrinato)cobalt(III) dichloromethane solvate","Acta Crystallographica Section E","2002","58","5","m169","m171","10.1107/S1600536802005524","","","0.7107","MoKα","","","0.0894","","","","0.3167","","","","","","1.036","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201144","8.234","0.0016","8.7827","0.0018","14.9145","0.0018","89.299","0.011","78.697","0.011","89.906","0.007","1057.6","0.3","150","","150","","","","","","","","","5","P 1","P 1","1","","3-Methyl 5-[(S)-2-methylbutyl] 4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-1,4-dihydropyridine- 3,5-dicarboxylate","","- C22 H27 F2 N O5 -","- C22 H27 F2 N O5 -","- C44 H54 F4 N2 O10 -","2","2","NA6152","Kooijman, Huub; Spek, Anthony L.; Sobolev, Arkadij; Jongejan, Hugo; Franssen, Maurice C. R.","3-Methyl 5-[(<i>S</i>)-2-methylbutyl] 4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate","Acta Crystallographica Section E","2002","58","5","o532","o534","10.1107/S1600536802006487","","","0.71073","MoKa","","0.0834","0.046","","","0.0839","0.0948","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201145","10.071","0.002","11.653","0.002","9.184","0.002","92.65","0.02","108.81","0.02","65.45","0.01","923.2","0.4","297","","","","","","","","","","","5","P -1","-P 1","2","","","","- C46 H34 Co N5 O3 -","- C46 H28 Co N5 O3 -","- C46 H28 Co N5 O3 -","1","0.5","NA6153","Ohba, Shigeru; Seki, Hiroshi","(Ethanol-<i>O</i>)nitro(α,β,γ,δ-tetraphenylporphyrinato)cobalt(III)","Acta Crystallographica Section E","2002","58","5","m183","m185","10.1107/S1600536802006049","","","0.7107","MoKα","","","0.0388","","","","0.1125","","","","","","1.113","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201146","7.611","0.004","17.137","0.005","26.161","0.01","90","","90","","90","","3412","2","133","2","133","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","trans-3,6-Bis(chlorophenylmethylene)-1,2,4,5-tetrathiane","","- C16 H10 Cl2 S4 -","- C16 H10 Cl2 S4 -","- C128 H80 Cl16 S32 -","8","1","NA6154","Jones, Peter G.; Bubenitschek, Peter; Sander, Wolfram; Wierlacher, Stefan","<i>trans</i>-3,6-Bis(chlorophenylmethylene)-1,2,4,5-tetrathiane","Acta Crystallographica Section E","2002","58","5","o555","o556","10.1107/S1600536802006372","","","0.71073","MoKα","","0.0577","0.0487","","","0.1295","0.1396","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201147","10.921","0.002","12.905","0.003","15.868","0.004","90","","90","","90","","2236.4","0.9","143","2","143","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2S,1'S)-2-[1-(2,3-Dimethoxyphenyl)-1-hydroxy-3-oxo-1,3-dihydroisoindol- 2-yl]-N,N-diethylpropionamide","","- C23 H28 N2 O5 -","- C23 H28 N2 O5 -","- C92 H112 N8 O20 -","4","1","NA6155","Jones, Peter G.; Woydowski, Karsten; Liebscher, Jürgen","(2<i>S</i>,1'<i>S</i>)-2-[1-(2,3-Dimethoxyphenyl)-1-hydroxy-3-oxo-1,3-dihydroisoindol-2-yl]-<i>N,N</i>-diethylpropionamide: reaction of phthalimido-protected alanine amides with lithiated 1,2-dimethoxybenzene","Acta Crystallographica Section E","2002","58","5","o557","o559","10.1107/S1600536802006736","","","0.71073","MoKα","","0.0831","0.0531","","","0.0936","0.1101","","","","","","1.123","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201148","10.784","0.001","29.701","0.004","8.8317","0.001","90","","93.015","0.01","90","","2824.8","0.6","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C62 H64 Cu2 N4 O14 -","- C62 H64 Cu2 N4 O14 -","- C124 H128 Cu4 N8 O28 -","2","0.5","NA6156","Kooijman, Huub; Spek, Anthony L.; Aromí, Guillem; Gamez, Patrick; Carrero Berzal, Paula; Driessen, Willem L.; Reedijk, Jan","Bis[μ-2-hydroxy-5-methyl-1,3-bis(3-oxido-κ<i>O</i>-3-phenylprop-2-enonyl-κ<i>O</i>)benzene]bis[(<i>N,N</i>-dimethylformamide-<i>O</i>)copper(II)] bis(<i>N,N</i>-dimethylformamide) solvate","Acta Crystallographica Section E","2002","58","5","m223","m225","10.1107/S1600536802006918","","","0.71073","MoKα","","0.0953","0.0574","","","0.1395","0.1572","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201149","24.449","0.002","5.2431","0.0005","12.6633","0.0009","90","","91.714","0.006","90","","1622.6","0.2","250","1","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C19 H21 N O3 -","- C19 H21 N O3 -","- C76 H84 N4 O12 -","4","1","NA6157","Ohba, Shigeru; Ito, Yoshikatsu","<i>N</i>-[2-(3,4-Dimethoxyphenyl)ethyl]-3-phenylacrylamide","Acta Crystallographica Section E","2002","58","5","o517","o518","10.1107/S1600536802006360","","","1.5418","CuKα","","","0.056","","","","0.156","","","","","","1.26","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201150","14.2535","0.001","33.714","0.003","14.3511","0.0012","90","","100.831","0.006","90","","6773.5","1","290","2","290","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","4,4'-bipyridine 1,2-diiodotetrafluorobenzene","","- C16 H8 F4 I2 N2 -","- C16 H8 F4 I2 N2 -","- C256 H128 F64 I32 N32 -","16","2","NA6158","Rosalba Liantonio; Pierangelo Metrangolo; Tullio Pilati; Giuseppe Resnati","4,4'-Bipyridine 1,2-diiodo-3,4,5,6-tetrafluorobenzene","Acta Crystallographica Section E","2002","58","5","o575","o577","10.1107/S1600536802007201","","","0.71069","MoKα","","0.0566","0.0385","","","0.0879","0.094","","","","","","0.966","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201151","11.92","0.001","18.114","0.002","7.383","0.001","90","","90","","90","","1594.1","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(3S,4R)-4-(2,5-Dimethoxyphenyl)-8-methoxyisochroman-3-ol","","- C18 H20 O5 -","- C18 H20 O5 -","- C72 H80 O20 -","4","1","NA6159","Palusiak, Marcin; Małecka, Magdalena; Grabowski, Sławomir J.; Epsztajn, Jan; Bieniek, Adam; Kowalska, Justyna A.","(3<i>S</i>,4<i>R</i>)-4-(2,5-Dimethoxyphenyl)-8-methoxyisochroman-3-ol","Acta Crystallographica Section E","2002","58","6","o620","o622","10.1107/S1600536802007419","","","1.54178","CuKα","","0.0447","0.0373","","","0.1048","0.1087","","","","","","1.024","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201152","24.871","0.004","5.6208","0.0006","18.2216","0.0019","90","","90","","90","","2547.3","0.6","143","2","143","2","","","","","","","","6","F d d 2","F 2 -2d","43","","N,N-Bis-(trifluoromethylsulfonyl)-aniline","","- C8 H5 F6 N O4 S2 -","- C8 H5 F6 N O4 S2 -","- C64 H40 F48 N8 O32 S16 -","8","0.5","NA6160","Bats, Jan W.; Weyrauch, Jan P.; Hashmi, A. Stephen K.","<i>N,N</i>-Bis(trifluoromethylsulfonyl)aniline","Acta Crystallographica Section E","2002","58","6","o590","o591","10.1107/S160053680200764X","","","0.71073","MoKα","","0.0312","0.0263","","","0.0675","0.0691","","","","","","1.195","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201153","20.9399","0.001","9.1673","0.0005","9.6144","0.0005","90","","115.559","0.003","90","","1664.99","0.15","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(2-carboethoxyethyl)diiodotin","","- C10 H18 I2 O4 Sn -","- C10 H18 I2 O4 Sn -","- C40 H72 I8 O16 Sn4 -","4","0.5","NA6161","Howie, R. Alan; Wardell, Solange M. S. V.","Bis(2-carboethoxyethyl)diiodotin at 120K","Acta Crystallographica Section E","2002","58","6","m257","m259","10.1107/S1600536802007912","","","0.71073","MoKα","","0.0695","0.0376","","","0.0654","0.0772","","","","","","0.891","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201154","5.5577","0.0003","25.5016","0.0014","7.4588","0.0005","90","","95.134","0.002","90","","1052.9","0.11","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(4-Acetylphenyl)maleamic acid","","- C12 H11 N O4 -","- C12 H11 N O4 -","- C48 H44 N4 O16 -","4","1","NA6162","Daniel E. Lynch; Ian McClenaghan","<i>N</i>-(4-Acetylphenyl)maleamic acid","Acta Crystallographica Section E","2002","58","6","o678","o679","10.1107/S1600536802008851","","","0.71073","MoKα","","0.0853","0.0467","","","0.1035","0.1328","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201155","10.665","0.0007","9.814","0.0008","11.1544","0.0012","90","","108.833","0.003","90","","1104.99","0.17","293","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Cyano-6-(4-methoxyphenyl)-2(1H)-pyridone","","- C13 H10 N2 O2 -","- C13 H10 N2 O2 -","- C52 H40 N8 O8 -","4","1","NA6164","Daniel E. Lynch; Ian McClenaghan","3-Cyano-6-(4-methoxyphenyl)-2(1<i>H</i>)-pyridone","Acta Crystallographica Section E","2002","58","6","o680","o681","10.1107/S1600536802008863","","","0.71073","MoKα","","0.2092","0.0627","","","0.1281","0.201","","","","","","0.904","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201156","8.252","0.004","12.012","0.006","13.867","0.006","76.26","0.03","80.99","0.03","89.69","0.04","1318","1.1","173","1","173","1","","","","","","","","5","P -1","-P 1","2","","bis(tetra-n-butylammonium) bis(2-dicyanomethylene-4,5-dimercapto- 1,3-dithiole)nickel(II)","","- C44 H72 N6 Ni S8 -","- C44 H72 N6 Ni S8 -","- C44 H72 N6 Ni S8 -","1","0.5","OB6113","Tomura, Masaaki; Yamashita, Yoshiro","Bis(tetra-<i>n</i>-butylammonium) bis(2-dicyanomethylene-4,5-dimercapto-1,3-dithiole)nickel(II)","Acta Crystallographica Section E","2002","58","4","m133","m135","10.1107/S1600536802004816","","","0.7107","MoKα","","0.125","0.0934","","","0.2393","0.2711","","","","","","1.107","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201157","9.91","0.001","10.411","0.001","16.401","0.001","89.88","0.01","73.19","0.01","88.89","0.01","1619.5","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4-chloro-1,1-diphenyl-3-(1-pyrrolyl)-2-azabuta-1,3-diene","","- C19 H15 Cl N2 -","- C19 H15 Cl N2 -","- C76 H60 Cl4 N8 -","4","2","OB6114","Jacquot-Rousseau, Sandrine; Schmitt, Gérard; Laude, Bernard; Kubicki, Marek M.; Delarue, Patrice","4-Chloro-1,1-diphenyl-3-(1-pyrrolyl)-2-azabuta-1,3-diene","Acta Crystallographica Section E","2002","58","4","o364","o365","10.1107/S1600536802004014","","","0.71073","MoKα","","0.0841","0.0402","","0.1189","","0.0986","","","1.021","","","1.067","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201158","5.306","0.001","16.625","0.004","15.02","0.001","90","","92.06","0.01","90","","1324.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,6-bis(2-furyl)-2,5-bis(3-formyl-2-hydroxy-5-methylbenzyl)-2,5-diazahexane","","- C30 H32 N2 O6 -","- C30 H32 N2 O6 -","- C60 H64 N4 O12 -","2","0.5","OB6115","Shun, Gang-Chun; Li, Yi-Zhi; He, Zhan-Hang; Li, Zhong-Jun; Qu, Jian-Qiang; Liu, Chang-Rang; Wang, Liu-Fang","1,6-Bis(2-furyl)-2,5-bis(3-formyl-2-hydroxy-5-methylbenzyl)-2,5-diazahexane","Acta Crystallographica Section E","2002","58","4","o417","o418","10.1107/S1600536802004531","","","0.71073","MoKα","","0.0509","0.0453","","","0.1315","0.1349","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201159","9.8779","0.0012","13.0945","0.0013","11.5305","0.0011","90","","105.354","0.007","90","","1438.2","0.3","301","2","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C12 H9 Br5 -","- C12 H9 Br5 -","- C48 H36 Br20 -","4","1","OB6116","Ülkü, Dinçer; Arıcı, Cengiz; Çakmak, Osman; Balcı, Metin","<i>endo,endo,endo</i>-9,9,10,11,12-Pentabromotricyclo[6.2.2.0^2,7^]dodeca-2(7),3,5-triene","Acta Crystallographica Section E","2002","58","4","o382","o384","10.1107/S1600536802004257","","","0.71073","MoKα","","","0.065","","","","0.149","","","","","","0.93","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201160","10.5304","0.0012","14.4184","0.0011","16.3327","0.0013","90","","90","","90","","2479.8","0.4","295","","295","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","Dibromo-2κ^2^Br-(N,N'-dimethylformamide-1κO)-(methanole-1κO) -μ-[2,2'-[1,3-propandiylbis(nitrilomethylidene)]diphenolato] 1κ^4^O,N,N',O':2κ^2^O,O'-nickel(II)zinc(II)","","- C21 H27 Br2 N3 Ni O4 Zn -","- C21 H27 Br2 N3 Ni O4 Zn -","- C84 H108 Br8 N12 Ni4 O16 Zn4 -","4","1","OB6117","Leyla Tatar; Atakol, Orhan; Arıcı, Cengiz","{[μ-<i>N,N</i>'-Bis(salicylidene)-1,3-propanediaminato](<i>N,N</i>-dimethylformamide)(methanol)nickel(II)}dibromozinc(II)","Acta Crystallographica Section E","2002","58","4","m154","m156","10.1107/S1600536802004658","","","0.71073","MoKα","","0.0988","0.0356","","","0.0671","0.0792","","","","","","1.019","","","","has coordinates,has Fobs","194596","2020-10-21","18:00:00",""
"2201161","7.671","0.0007","13.9712","0.0006","16.639","0.002","90","","93.809","0.009","90","","1779.3","0.3","130","2","130","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(diethylenetriamine)mercury(II) thiocyanate","","- C10 H26 Hg N8 S2 -","- C10 H26 Hg N8 S2 -","- C40 H104 Hg4 N32 S8 -","4","0.5","OB6118","M. Linh Tran; Paul V. Bernhardt; Ian R. Gentle","Bis(diethylenetriamine)mercury(II) bis(thiocyanate)","Acta Crystallographica Section E","2002","58","4","m150","m151","10.1107/S1600536802004701","","","0.71073","MoKα","","0.0213","0.0192","","","0.0483","0.0491","","","","","","1.069","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201162","7.553","0.001","12.328","0.002","19.038","0.002","90","","98.317","0.008","90","","1754","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis-(1,2-diaminobenzene-N)-bis-(1,3-diphenyl-1,3-propanedionato-O,O)zinc(II)","","- C42 H38 N4 O4 Zn -","- C42 H38 N4 O4 Zn -","- C84 H76 N8 O8 Zn2 -","2","0.5","OB6120","Ovalle-Marroquín, Pilar; Gómez-Lara, Jacobo; Hernández-Ortega, Simón","Octahedral arrangement of <i>trans</i>-bis(diphenylpropanedionato)bis(<i>o</i>-phenylenediamino)zinc(II)","Acta Crystallographica Section E","2002","58","6","m269","m271","10.1107/S1600536802007699","","","0.71073","MoKα","","0.0756","0.0407","","","0.078","0.0857","","","","","","0.929","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2201163","4.798","0.001","12.094","0.001","30.974","0.002","90","","90","","90","","1797.3","0.4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","catena-Poly[[[diaqualanthanum(III)]-tri-μ-glycinato] trichloride monohydrate]","","- C6 H21 Cl3 La N3 O9 -","- C6 H21 Cl3 La N3 O9 -","- C24 H84 Cl12 La4 N12 O36 -","4","1","OB6121","Gao, Sheng-Li; Li, Yi-Zhi; Ren, Fei; Shi, Qi-Zhen; Wang, Liu-Fang","<i>catena</i>-Poly[[[diaqualanthanum(III)]-tri-μ-glycinato] trichloride monohydrate]","Acta Crystallographica Section E","2002","58","5","m234","m236","10.1107/S1600536802007444","","","0.71073","MoKα","","0.0422","0.0324","","","0.0839","0.0855","","","","","","0.97","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201164","9.2033","0.0008","18.8786","0.0013","19.1011","0.0015","90","","102.358","0.008","90","","3241.8","0.5","295","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C31 H34 Br2 N4 Ni O2 Zn -","- C31 H34 Br2 N4 Ni O2 Zn -","- C124 H136 Br8 N16 Ni4 O8 Zn4 -","4","1","OB6123","Ülkü, Dinçer; Kaynak, F. Betül; Atakol, Orhan","{[μ-Bis(salicylidene)-1,3-propanediaminato]bis(3,5-dimethylpyridine)nickel(II)}dibromozinc(II)","Acta Crystallographica Section E","2002","58","6","m251","m253","10.1107/S1600536802007456","","","0.71073","MoKα","","","0.0342","","","","0.1009","","","","","","0.93","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201165","7.777","0.002","26.904","0.008","7.6","0.002","90","","107.72","0.01","90","","1514.7","0.7","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(3-amino-2-chloropyridine-κN)silver(I) perchlorate","","- C10 H10 Ag Cl3 N4 O4 -","- C10 H10 Ag Cl3 N4 O4 -","- C40 H40 Ag4 Cl12 N16 O16 -","4","1","OB6124","Li, Wei; Tong, Ming-Liang; Chen, Xiao-Ming; Yuan, Ji-Xin; Hu, Mao-Lin","Bis(3-amino-2-chloropyridine-κ<i>N</i>)silver(I) perchlorate","Acta Crystallographica Section E","2002","58","5","m203","m205","10.1107/S1600536802006396","","","0.71073","MoKα","","0.0826","0.0425","","","0.0803","0.0932","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201166","17","0.005","20.351","0.004","13.915","0.004","90","","108.87","0.02","90","","4555","2","296.2","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C35 H32 F18 N11 P3 Pt2 -","- C35 H32 F18 N11 P3 Pt2 -","- C140 H128 F72 N44 P12 Pt8 -","4","0.5","OB6125","Kato, Masako; Toshikawa, Asami; Kishi, Shinobu","μ-Guanidinido-bis[(terpyridine)platinum(II)] tris(hexafluorophosphate) acetonitrile solvate","Acta Crystallographica Section E","2002","58","6","m248","m250","10.1107/S1600536802007468","","","0.7107","MoKα","","","0.0577","","","","0.1744","","","","","","1.019","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201167","12.3695","0.0009","13.7644","0.001","8.2403","0.0006","90","","90.01","0.01","90","","1402.98","0.18","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(2,4-dichlorophenylmethylene)-1-tetralone","","- C17 H12 Cl2 O -","- C17 H12 Cl2 O -","- C68 H48 Cl8 O4 -","4","1","OB6126","Oloo, Eliud O.; Quail, J. Wilson; Perjési, Pál; Dimmock, Jonathan R.","2-(2,4-Dichlorophenylmethylene)-1-tetralone","Acta Crystallographica Section E","2002","58","5","o580","o581","10.1107/S160053680200747X","","","0.71073","MoKα","","0.0496","0.0329","","","0.0769","0.0817","","","","","","0.975","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201168","23.257","0.001","8.715","0.001","14.668","0.001","90","","100.27","0.01","90","","2925.3","0.4","123","2","123","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-(2,4-dichlorophenylhydroxymethyl)-1-tetralone","","- C17 H14 Cl2 O2 -","- C17 H14 Cl2 O2 -","- C136 H112 Cl16 O16 -","8","1","OB6127","Oloo, Eliud O.; Quail, J. Wilson; Perjési, Pál; Dimmock, Jonathan R.","2-(2,4-Dichlorophenylhydroxymethyl)-1-tetralone","Acta Crystallographica Section E","2002","58","5","o582","o583","10.1107/S1600536802007481","","","0.71073","MoKα","","0.0329","0.0265","","","0.0717","0.0746","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201169","10.6018","0.0011","15.3204","0.0015","18.269","0.0017","90","","98.727","0.012","90","","2933","0.5","295","","","","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C23 H30 I2 N4 Ni O4 Zn -","- C23 H30 I2 N4 Ni O4 Zn -","- C92 H120 I8 N16 Ni4 O16 Zn4 -","4","1","OB6128","Leyla Tatar","{[μ-Bis(salicylidene)-1,3-propanediaminato]bis(<i>N,N</i>-dimethylformamide)nickel(II)}diiodozinc(II)","Acta Crystallographica Section E","2002","58","5","m231","m233","10.1107/S1600536802007493","","","0.71073","MoKα","","0.0407","0.032","","","0.0814","0.0855","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201170","7.962","0.0018","18.734","0.002","11.6482","0.0015","90","","98.678","0.011","90","","1717.6","0.5","149","2","149","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C19 H20 Cl N O2 S Ti -","- C19 H20 Cl N O2 S Ti -","- C76 H80 Cl4 N4 O8 S4 Ti4 -","4","1","OB6129","Lensink, Cornelis; Gainsford, Graeme J.","Chloro(η^5^-cyclopentadienyl){[η^5^:η^1^-2-(<i>p</i>-tolylsulfonamido)ethyl]cyclopentadienyl}titanium","Acta Crystallographica Section E","2002","58","6","m267","m268","10.1107/S160053680200781X","","","0.71073","MoKα","","0.0856","0.0444","","","0.0857","0.0971","","","","","","0.969","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201171","7.3761","0.0008","17.3967","0.0019","13.9155","0.0015","90","","96.961","0.003","90","","1772.5","0.3","163","2","163","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H17 Cl2 N O2 S Ti -","- C18 H17 Cl2 N O2 S Ti -","- C72 H68 Cl8 N4 O8 S4 Ti4 -","4","1","OB6130","Lensink, Cornelis; Gainsford, Graeme J.","Dichloro{<i>N</i>-[2-(η^5^-indenyl)ethyl]-<i>p</i>-tolylsulfonamido-κ<i>N</i>}titanium","Acta Crystallographica Section E","2002","58","6","m296","m297","10.1107/S1600536802007821","","","0.71073","MoKα","","0.1195","0.0866","","","0.1662","0.1808","","","","","","1.169","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2201172","15.053","0.001","13.703","0.001","6.772","0.001","90","","97.93","0.01","90","","1383.5","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[[1,4-bis(4-pyridyl)-2,3-diaza-1,3-butadiene]silver(I)] nitrate]","","- C12 H10 Ag N5 O3 -","- C12 H10 Ag N5 O3 -","- C48 H40 Ag4 N20 O12 -","4","0.5","OB6132","Shi, Yu-Jun; Li, Yi-Zhi; Tong, Wen-Jun; Chen, Xue-Tai; You, Xiao-Zeng","<i>catena</i>-Poly[[[1,4-bis(4-pyridyl)-2,3-diaza-1,3-butadiene]silver(I)] nitrate]","Acta Crystallographica Section E","2002","58","6","m293","m295","10.1107/S1600536802008681","","","0.71073","MoKα","","0.052","0.0451","","","0.139","0.1452","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201173","18.1344","0.0014","6.6257","0.0005","9.0173","0.0007","90","","95.903","0.003","90","","1077.71","0.14","145","2","145","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H6 Cl2 O2 -","- C12 H6 Cl2 O2 -","- C48 H24 Cl8 O8 -","4","1","OM6077","Lehmler, Hans-Joachim; Robertson, Larry W.; Parkin, Sean","2-(3,5-Dichlorophenyl)-1,4-benzoquinone","Acta Crystallographica Section E","2002","58","4","o366","o367","10.1107/S160053680200291X","","","0.71073","MoKα","","0.0818","0.0522","","","0.0761","0.0827","","","","","","1.095","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201174","4.468","0.002","15.355","0.005","13.121","0.005","90","","97.792","0.007","90","","891.9","0.6","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","C7H8N4O2 . H2O","theophylline monohydrate","","- C7 H10 N4 O3 -","- C7 H10 N4 O3 -","- C28 H40 N16 O12 -","4","1","OM6079","Sun, Changquan; Zhou, Deliang; Grant, David J. W.; Young Jr, Victor G.","Theophylline monohydrate","Acta Crystallographica Section E","2002","58","4","o368","o370","10.1107/S1600536802002921","","","0.71073","MoKα","","0.0528","0.0448","","","0.1212","0.1253","","","","","","1.005","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201175","10.636","0.002","15.34","0.002","15.545","0.002","105.467","0.002","107.949","0.004","109.453","0.002","2073.3","0.6","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C35 H54 B6 N3 O11.5 -","- C35 H54 B6 N3 O11.5 -","- C70 H108 B12 N6 O23 -","2","1","OM6081","Wolfgang Kliegel; Klaus Drückler; Brian O. Patrick; Steven J. Rettig; James Trotter","A polycyclic condensate of phenylboronic and boric acids with <i>N</i>-hydroxypiperidine","Acta Crystallographica Section E","2002","58","4","o393","o395","10.1107/S160053680200380X","","","0.7107","MoKα","","0.073","0.043","","0.102","","0.102","","","1.41","","","1.41","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201176","9.9331","0.0014","20.188","0.003","14.701","0.002","90","","90","","90","","2948","0.7","193","2","193","2","","","","","","","","5","C m c a","-C 2ac 2","64","","3-methyl-1,2-butadiene-1,1-diphosphonic acid, anilinium salt","","- C11 H17 N O6 P2 -","- C11 H17 N O6 P2 -","- C88 H136 N8 O48 P16 -","8","","OM6082","Angelov, Christo M.; van den Heever, Johan P.; McDonald, Robert; McEwan, Alexander J. B.; Mercer, John R.; 3-methyl-1,2-butadiene-1,1-diphosphonic acid, anilinium salt","Anilinium 3-methyl-1,2-butadienyl-1,1-diphosphonate(1‒)","Acta Crystallographica Section E","2002","58","5","o498","o500","10.1107/S1600536802005743","","","0.71073","MoKα","","0.0679","0.0428","","","0.0983","0.1102","","","","","","1.015","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201177","9.6912","0.0016","13.389","0.002","7.1699","0.0012","90","","90","","90","","930.3","0.3","193","2","193","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","2-(3-Methyl-1,2-butadienyl)-2-oxo-1,3,2-oxazaphosphorinane","","- C8 H14 N O2 P -","- C8 H14 N O2 P -","- C32 H56 N4 O8 P4 -","4","1","OM6083","Angelov, Christo M.; Mazzuca, Dean A.; van den Heever, Johan P.; McDonald, Robert; McEwen, Alexander J. B.; Mercer, John R.; 2-(3-Methyl-1,2-butadienyl)-2-oxo-1,3,2-oxazaphosphorinane","2-(3-Methyl-1,2-butadienyl)-2-oxo-1,3,2-oxazaphosphorinane","Acta Crystallographica Section E","2002","58","4","o399","o401","10.1107/S1600536802004105","","","0.71073","MoKα","","0.0534","0.0412","","","0.0874","0.0919","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201178","15.393","0.002","11.2392","0.0017","22.124","0.003","90","","107.424","0.003","90","","3651.9","0.9","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","warfarin sodium 2-propanol solvate","2-propanol solvate of the sodium salt of 4-hydroxy-3-(3-oxo-1-phenylbutyl)-2H-1-benzopyran-2-one","","- C20.5 H19 Na O4.5 -","- C20.5 H19 Na O4.5 -","- C164 H152 Na8 O36 -","8","2","OM6084","Sheth, Agam R.; Young Jr, Victor G.; Grant, David J. W.","Warfarin sodium 2-propanol solvate","Acta Crystallographica Section E","2002","58","5","m197","m199","10.1107/S1600536802005809","","","0.71073","MoKα","","0.1195","0.0693","","","0.1883","0.2254","","","","","","1.036","","","","has coordinates,has disorder,has Fobs","283803","2023-05-16","08:05:53",""
"2201179","6.3673","0.0005","11.3245","0.0009","28.297","0.002","90","","90","","90","","2040.4","0.3","93","2","93","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","sodium 2-[N-morpholino]ethanesulfonate hydrate","","- C6 H14 N Na O5 S -","- C6 H14 N Na O5 S -","- C48 H112 N8 Na8 O40 S8 -","8","1","OM6085","Deschamps, Jeffrey R.; Flippen-Anderson, Judith L.; George, Clifford","Sodium 2-(<i>N</i>-morpholino)ethanesulfonate monohydrate","Acta Crystallographica Section E","2002","58","5","m167","m168","10.1107/S160053680200541X","","","0.71073","MoKα","","0.04","0.0356","","","0.0867","0.0889","","","","","","1.118","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201180","7.1304","0.0005","7.0213","0.0005","14.4857","0.0009","90","","93.333","0.004","90","","724","0.09","173","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H12 Cl N O -","- C5 H12 Cl N O -","- C20 H48 Cl4 N4 O4 -","4","1","OM6086","Wolfgang Kliegel; Ulf Riebe; Brian O. Patrick; Steven J. Rettig; James Trotter","<i>N</i>-Hydroxypiperidinium chloride","Acta Crystallographica Section E","2002","58","5","o509","o510","10.1107/S1600536802005792","","","0.7107","MoKα","","0.047","0.028","","0.061","","0.061","","","1.625","","","1.625","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201181","11.366","0.002","5.7345","0.0013","13.327","0.003","90","","97.388","0.005","90","","861.4","0.3","300","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","N-Acetoacetylurethane","Ethyl N-(3-Oxobutanoyl)carbamate","","- C7 H11 N O4 -","- C7 H11 N O4 -","- C28 H44 N4 O16 -","4","1","OM6087","Golden, Mace C.; McGill,Robert J.; Heimer, Norman E.","Ethyl <i>N</i>-(3-oxobutanoyl)carbamate","Acta Crystallographica Section E","2002","58","5","o553","o554","10.1107/S1600536802006797","","","0.71073","MoKα","","0.0777","0.054","","","0.1272","0.1391","","","","","","1.037","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201182","3.7923","0.0011","6.468","0.0018","7.504","0.002","113.099","0.01","94.412","0.01","97.128","0.01","166.4","0.08","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","p-isocyanobenzonitrile","","- C8 H4 N2 -","- C8 H4 N2 -","- C8 H4 N2 -","1","0.5","OM6088","Britton, Doyle","<i>p</i>-Isocyanobenzonitrile","Acta Crystallographica Section E","2002","58","6","o637","o639","10.1107/S1600536802008371","","","0.71073","MoKα","","0.061","0.049","","","0.126","0.133","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201183","10.353","0.003","9.5269","0.001","18.9124","0.0018","90","","91.541","0.014","90","","1864.7","0.6","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","dichloromethyl phenyl sulfone","","- C7 H6 Cl2 O2 S -","- C7 H6 Cl2 O2 S -","- C56 H48 Cl16 O16 S8 -","8","2","OM6089","Chan-Yu-King, Roch; Anil, Jose; Meyers, Cal Y.; Robinson, Paul D.","Dichloromethyl phenyl sulfone","Acta Crystallographica Section E","2002","58","6","o592","o595","10.1107/S1600536802007559","","","0.71069","MoKα","","0.074","0.032","","","0.073","0.088","","","","","","1.018","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201184","8.9766","0.0014","12.3744","0.0019","12.4145","0.0018","90","","90","","90","","1379","0.4","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-[2-methyl-1-(2-naphthyl)propenyl]acetamide","","- C16 H17 N O -","- C16 H17 N O -","- C64 H68 N4 O4 -","4","1","TK6051","Chen, Xuanhua; Guo, Rongwei; Zhou, Zhongyuan","<i>N</i>-[2-Methyl-1-(2-naphthyl)propenyl]acetamide","Acta Crystallographica Section E","2002","58","5","o568","o569","10.1107/S1600536802007079","","","0.71073","MoKα","","0.107","0.035","","","0.056","0.065","","","","","","0.94","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201185","10.646","0.008","10.702","0.006","8.53","0.006","105.53","0.06","99.88","0.06","119.27","0.04","762.1","1.1","295","","295","","","","","","","","","4","P -1","-P 1","2","","(2-Chlorophenyl)diphenylphosphine","","- C18 H14 Cl P -","- C18 H14 Cl P -","- C36 H28 Cl2 P2 -","2","1","TK6057","Williams, Michael L.; Noack, Cassandra L.; Saverin, Rodney J.; Healy, Peter C.","(2-Chlorophenyl)diphenylphosphine","Acta Crystallographica Section E","2002","58","4","o419","o421","10.1107/S1600536802004440","","","0.71069","MoKα","","0.07","0.039","","","0.102","0.115","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201186","6.103","0.0003","6.103","0.0003","36.826","0.002","90","","90","","90","","1371.64","0.12","293","2","293","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","Poly[triaqua(μ-hydrogen tartrato)(μ-tartrato)samarium(III)]","","- C8 H15 O15 Sm -","- C8 H14 O15 Sm -","- C32 H56 O60 Sm4 -","4","0.5","TK6058","Wu, Chuan-De; Zhan, Xiao-Ping; Lu, Can-Zhong; Zhuang, Hong-Hui; Huang, Jin-Shun","Poly[triaqua(μ-hydrogen tartrato)(μ-tartrato)samarium(III)]","Acta Crystallographica Section E","2002","58","5","m228","m230","10.1107/S1600536802007420","","","0.71073","MoKα","","0.029","0.028","","","0.071","0.072","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201187","10.9627","0.0005","4.8481","0.0002","18.515","0.0009","90","","105.991","0.001","90","","945.96","0.07","149","2","149","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H20 N2 O5 -","- C21 H20 N2 O5 -","- C42 H40 N4 O10 -","2","1","TK6059","Hayman, Alan R.; Simpson, Jim","<i>N</i>-Phthaloyl-<small>L</small>-alanyl-<small>L</small>-phenylalanine methyl ester","Acta Crystallographica Section E","2002","58","6","o596","o597","10.1107/S1600536802007067","","","0.71073","MoKα","","0.044","0.038","","","0.081","0.086","","","","","","1.13","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201188","7.395","0.0001","25.8407","0.0004","12.4431","0.0002","90","","90.46","0.0008","90","","2377.7","0.06","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2-Carbomethoxyethyl)triiodotin at 120K","","- C4 H7 I3 O2 Sn -","- C4 H7 I3 O2 Sn -","- C32 H56 I24 O16 Sn8 -","8","2","TK6061","Howie, R. Alan; Wardell, Solange M. S. V.","(2-Carbomethoxyethyl)triiodotin at 120K","Acta Crystallographica Section E","2002","58","5","m220","m222","10.1107/S1600536802007080","","","0.71073","MoKα","","0.065","0.06","","","0.164","0.168","","","","","","1.14","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201189","5.2034","0.0002","8.5978","0.0003","15.9048","0.0006","90","","90.112","0.001","90","","711.54","0.05","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(E)-1,2-bis(methylthio)-1,2-diphenylethylene","","- C16 H16 S2 -","- C16 H16 S2 -","- C32 H32 S4 -","2","0.5","TK6062","Rieger, Anne L.; Simpson, Jim","Monoclinic form of (<i>E</i>)-1,2-bis(methylthio)-1,2-diphenylethylene","Acta Crystallographica Section E","2002","58","5","o578","o579","10.1107/S1600536802007407","","","0.71073","MoKα","","0.049","0.044","","","0.117","0.121","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201190","20.773","0.004","6.5109","0.001","17.063","0.003","90","","101.918","0.004","90","","2258","0.7","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-{[3-acetamido-1,3-bis(4-ethylphenyl)butenyl]}acetamide","","- C24 H30 N2 O2 -","- C24 H30 N2 O2 -","- C96 H120 N8 O8 -","4","1","TK6063","Chen, Xuanhua; Guo, Rongwei; Zhou, Zhongyuan","<i>N</i>-[3-Acetamido-1,3-bis(4-ethylphenyl)butenyl]acetamide","Acta Crystallographica Section E","2002","58","6","o671","o672","10.1107/S1600536802008607","","","0.71073","MoKα","","0.202","0.054","","","0.068","0.082","","","","","","0.91","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201191","8.6833","0.001","22.975","0.002","9.9726","0.001","90","","94.675","0.01","90","","1982.9","0.3","293","2","0","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H26 N2 O2 S2 -","- C22 H26 N2 O2 S2 -","- C88 H104 N8 O8 S8 -","4","1","WN6085","Hökelek, Tuncer; Patır, Süleyman","A novel bridged hexahydropyrrolo[2,3-<i>d</i>]carbazole","Acta Crystallographica Section E","2002","58","4","o374","o376","10.1107/S1600536802004075","","","0.71073","MoKα","","0.0906","0.0642","","","0.1951","0.2173","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201192","10.448","0.001","17.276","0.002","14.525","0.001","90","","109.81","0.01","90","","2466.6","0.4","294","","294","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H32 B2 N2 O4 -","- C26 H30.97 B2 N2 O4 -","- C104 H123.88 B8 N8 O16 -","4","1","WN6086","Wolfgang Kliegel; Klaus Drückler; Brian O. Patrick; Steven J. Rettig; James Trotter","An O-bridged BONBON ring system (phenol adduct)","Acta Crystallographica Section E","2002","58","4","o371","o373","10.1107/S1600536802004063","","","1.54178","CuKα","","0.069","0.046","","0.062","","0.059","","","","","","0.95","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201193","7.748","0.002","8.792","0.003","12.41","0.005","92.51","0.03","90.13","0.03","96.91","0.03","838.4","0.5","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","4,4'bis[2,2bis(4-methoxyphenyl)ethenyl]biphenyl","","- C44 H38 O4 -","- C44 H38 O4 -","- C44 H38 O4 -","1","0.5","WN6087","Vande Velde, Christophe M. L.; Hoefnagels, Roel; Geise, Herman J.","4,4'-Bis[2,2-bis(4-methoxyphenyl)ethenyl]biphenyl","Acta Crystallographica Section E","2002","58","4","o454","o455","10.1107/S1600536802004907","","","0.71073","MoKα","","0.0598","0.038","","","0.0899","0.1016","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201194","6.556","0.008","10.02","0.02","11.37","0.02","76.5","0.1","104.1","0.1","108.2","0.1","678","2","296.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C11 H18 O7 -","- C11 H18 O7 -","- C22 H36 O14 -","2","1","WN6088","Okabe, Nobuo; Kyoyama, Hasuyo","Butyl gallate dihydrate","Acta Crystallographica Section E","2002","58","4","o442","o444","10.1107/S1600536802004774","","","0.7107","MoKα","","","0.0482","","","","0.1849","","","","","","0.926","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2201195","14.174","0.002","21.64","0.004","18.239","0.003","90","","92.533","0.017","90","","5588.9","1.6","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tris(tricarbonyl-(triphenylphosphine)ruthenium)","","- C631 H45 O9 P3 Ru3 -","- C63 H45 O9 P3 Ru3 -","- C252 H180 O36 P12 Ru12 -","4","1","WN6089","Zoe R. Bell; Rebecca H. Laye; Michael D. Ward","Tris(tricarbonyl(triphenylphosphine)ruthenium","Acta Crystallographica Section E","2002","58","4","m165","m166","10.1107/S1600536802004932","","","0.71073","MoKα","","0.093","0.0421","","","0.0834","0.1056","","","","","","0.955","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201196","22.784","0.005","5.9117","0.0012","13.788","0.003","90","","96.69","0.03","90","","1844.5","0.7","123","2","123","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Sarcosinium maleate","`N-methyl-α-aminoetnol maleate'","","- C7 H11 N O6 -","- C7 H11 N O6 -","- C56 H88 N8 O48 -","8","1","WN6090","Rajagopal, K.; Subha Nandhini, M.; Krishnakumar, R. V.; Mostad, A.; Natarajan, S.","Sarcosinium maleate at 123K","Acta Crystallographica Section E","2002","58","5","o478","o480","10.1107/S160053680200538X","","","0.71073","MoKα","","0.0433","0.0387","","","0.0999","0.104","","","","","","1.136","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201197","9.0531","0.0016","14.667","0.003","12.186","0.002","90","","98.485","0.004","90","","1600.4","0.5","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H28 Cd2 N4 O22 -","- C28 H28 Cd2 N4 O22 -","- C56 H56 Cd4 N8 O44 -","2","0.5","WN6091","Ranjbar, M.; Aghabozorg, Hossein; Moghimi, A.","A seven-coordinate pyridine-2,6-dicarboxylate-bridged cadmium(II) complex, at 110K","Acta Crystallographica Section E","2002","58","6","m304","m306","10.1107/S1600536802009066","","","0.71073","MoKα","","0.045","0.039","","","0.089","0.091","","","","","","1.21","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2201198","11.1205","0.0006","17.7659","0.0009","24.9002","0.0013","90","","92.712","0.001","90","","4913.9","0.4","183","2","183","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H52 O4 P2 S8 Zn2 -","- C42 H52 O4 P2 S8 Zn2 -","- C168 H208 O16 P8 S32 Zn8 -","4","1","WN6092","Beer, Stephan; Lai, Chian Sing; Halbach, Tobias S.; Tiekink, Edward R. T.","μ-Bis(diphenylphosphino)ethane-<i>P,P</i>'-bis[bis(<i>O</i>-isopropyldithiocarbonato-<i>S,S</i>')zinc(II)]","Acta Crystallographica Section E","2002","58","5","m194","m196","10.1107/S1600536802005974","","","0.71069","MoKα","","0.075","0.045","","","0.097","0.109","","","","","","0.97","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201199","8.1662","0.0007","14.3524","0.0014","12.093","0.001","90","","109.59","0.004","90","","1335.3","0.2","120","2","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H10 O8 -","- C16 H10 O8 -","- C64 H40 O32 -","4","1","WN6094","Coles, Simon J.; Holmes, Richard; Hursthouse, Michael B.; Price, Daniel J.","Biphenyl-3,3',5,5'-tetracarboxylic acid","Acta Crystallographica Section E","2002","58","6","o626","o628","10.1107/S1600536802008206","","","0.71073","MoKα","","","0.0669","","","","0.2034","","","","","","0.983","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201200","11.844","0.002","6.8736","0.0012","25.939","0.006","90","0.016","101.038","0.017","90","0.016","2072.7","0.7","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Sodium p-Nitrophenolate Tetrahydrate","","- C6 H12 N Na O7 -","- C6 H12 N Na O7 -","- C48 H96 N8 Na8 O56 -","8","2","WN6095","S. Brahadeeswaran; H. L. Bhat; J. N. Sherwood; R. M. Vrcelj","Sodium <i>p</i>-nitrophenolate tetrahydrate","Acta Crystallographica Section E","2002","58","6","m290","m292","10.1107/S1600536802008553","","","0.71073","MoKα","","0.0445","0.041","","0.1024","","0.101","","","","","","1.12","","","","has coordinates,has Fobs","183154","2020-10-21","18:00:00",""
"2201201","14.6579","0.0015","18.163","0.0019","19.268","0.002","90","","94.621","0.002","90","","5113.1","0.9","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","μ-terephthalate-bis[tris(μ-N,N'-di-p-anisylformamidinate)dimolybdenum(II)] hexane disolvate","","- C110 H122 Mo4 N12 O16 -","- C110 H94 Mo4 N12 O16 -","- C220 H188 Mo8 N24 O32 -","2","0.5","WN6096","Cotton, F. Albert; Donahue, James P.; Lin, Chun; Murillo, Carlos A.; Rockwell, Jeffrey","A molecular pair having two quadruply bonded dimolybdenum units linked by a terephthalate dianion","Acta Crystallographica Section E","2002","58","6","m298","m300","10.1107/S160053680200884X","","","0.71073","MoKα","","0.1118","0.057","","","0.133","0.166","","","","","","1.044","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201202","13.2736","0.0014","13.5405","0.0016","17.3572","0.0019","90","","92.007","0.003","90","","3117.7","0.6","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H64 Cl12 O18 Sn6 -","- C34 H64 Cl12 O18 Sn6 -","- C68 H128 Cl24 O36 Sn12 -","2","0.5","WN6099","Kuan, Fong Sheen; Dakternieks, Dainis; Tiekink, Edward R. T.","Hexameric isopropyloxotin acetate chloroform tetrasolvate","Acta Crystallographica Section E","2002","58","6","m301","m303","10.1107/S1600536802008978","","","0.71069","MoKα","","0.065","0.042","","","0.084","0.091","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201203","16.6641","0.0006","13.1396","0.0005","27.8664","0.0011","90","","98.482","0.001","90","","6034.9","0.4","223","2","223","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C54 H68 Cd2 Fe N4 P2 S8 -","- C54 H68 Cd2 Fe N4 P2 S8 -","- C216 H272 Cd8 Fe4 N16 P8 S32 -","4","0.5","WW6010","Dee, Cathleen M.; Tiekink, Edward R. T.","[μ-1,1'-Bis(diphenylphosphino)ferrocene-<i>P,P</i>']bis[bis(<i>N,N</i>-diethyldithiocarbamato-<i>S,S</i>')cadmium(II)]","Acta Crystallographica Section E","2002","58","4","m136","m138","10.1107/S1600536802003604","","","0.71069","MoKα","","0.041","0.031","","","0.071","0.074","","","","","","0.95","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201204","9.0334","0.0012","10.0491","0.0009","13.86","0.002","90","","93.539","0.012","90","","1255.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4,5-Bis(2'-cyanoethylthio)-1,3-dithiole-2-one","","- C9 H8 N2 O S4 -","- C9 H8 N2 O S4 -","- C36 H32 N8 O4 S16 -","4","1","WW6011","Liu, Guoqun; Yu, Wentao; Xue, Gang; Liu, Zhi; Fang, Qi","4,5-Bis(2-cyanoethylthio)-1,3-dithiol-2-one","Acta Crystallographica Section E","2002","58","5","o514","o516","10.1107/S1600536802005445","","","0.71073","MoKα","","0.047","0.0368","","","0.1295","0.1409","","","","","","1.066","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201205","11.07","0.002","5.746","0.005","19.697","0.014","90","0.07","102.34","0.03","90","0.04","1223.9","1.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","DL-methioninium maleate","","- C9 H15 N O6 S -","- C9 H15 N O6 S -","- C36 H60 N4 O24 S4 -","4","1","WW6012","M. Alagar; M. Subha Nandhini; R. V. Krishnakumar; S. Natarajan","<small>DL</small>-Methioninium maleate","Acta Crystallographica Section E","2002","58","4","o396","o398","10.1107/S1600536802004324","","","1.5418","CuKα","","0.0451","0.0424","","","0.1247","0.129","","","","","","0.934","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201206","9.168","0.003","10.884","0.001","10.969","0.002","84.83","0.01","82.21","0.02","65.51","0.02","986.2","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-{5-(dimethylamino)-2-[(4-(dimethylamino)-2 -iodophenyl)methyl]phenyl}-(3E)-3-Buten-2-one","","- C21 H25 I N2 O -","- C21 H25 I N2 O -","- C42 H50 I2 N4 O2 -","2","1","WW6013","Cheng, Bao-Hua; Liang, Yong-Min; Wu, Xiao-Li; Xie, Tong; Wang, Liu-Fang; Ma, Yong-Xiang","4-{5-(Dimethylamino)-2-[4-(dimethylamino)-2-iodophenylmethyl]phenyl}-(3<i>E</i>)-3-buten-2-one","Acta Crystallographica Section E","2002","58","4","o471","o472","10.1107/S1600536802004956","","","0.71069","MoKα","","0.0506","0.0446","","","0.1018","0.1027","","","","","","1.066","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201207","7.3902","0.0011","12.9763","0.0012","15.1615","0.0018","89.111","0.01","78.107","0.011","80.045","0.01","1401","0.3","298","2","","","","","","","","","","7","P -1","-P 1","2","","","","- C24 H20 Cl2 Co N8 O2 S2 -","- C24 H20 Cl2 Co N8 O2 S2 -","- C48 H40 Cl4 Co2 N16 O4 S4 -","2","1","WW6014","Zhi-Yong Wu; Duan-Jun Xu; Jing-Yun Wu; Michael Y. Chiang","Dichlorobis(thiourea)cobalt(II) di(4,5-diazafluoren-9-one)","Acta Crystallographica Section E","2002","58","6","m260","m261","10.1107/S1600536802007778","","","0.71073","MoKα","","0.0699","0.0327","","","0.0858","0.0992","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201208","12.4779","0.0006","18.0879","0.0019","10.458","0.0019","90","","92.782","0.009","90","","2357.6","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Spiropyrrolidine","Spiro[5-carbomethoxy-2-(4-methoxyphenyl)-4-(4-methylphenyl)pyrrolidine-3,3'- chroman-4'-one]","","- C28 H27 N O5 -","- C28 H27 N O5 -","- C112 H108 N4 O20 -","4","1","WW6016","M. Nilofar Nissa; V. Rajakannan; Moon-Jib Kim; G. Subramaniyan; R. Raghunathan; D.Velmurugan","Spiro[5-carbomethoxy-2-(4-methoxyphenyl)-4-(4-methylphenyl)pyrrolidine-3,3'-chroman-4'-one]","Acta Crystallographica Section E","2002","58","6","o691","o693","10.1107/S1600536802008942","","","0.71073","MoKα","","0.1375","0.0643","","","0.1686","0.2003","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201209","15.23","0.004","5.789","0.001","9.415","0.002","90","","90","","90","","830.1","0.3","293","2","293","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","","(1R,2R)-Bis(4-pyridylmethyleneamino)cyclohexane","","- C18 H20 N4 -","- C18 H20 N4 -","- C36 H40 N8 -","2","0.5","WW6018","Xue-Jun Yuan; Yi-Zhi Li; Yong-Jiang Liu; Yun-Qi Tian; Xiao-Zeng You","(1<i>R</i>,2<i>R</i>)-Bis(4-pyridylmethyleneamino)cyclohexane","Acta Crystallographica Section E","2002","58","6","o640","o641","10.1107/S160053680200822X","","","0.71073","MoKα","","0.0585","0.0532","","","0.1391","0.1432","","","","","","1.014","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201210","9.9698","0.0004","15.6977","0.0004","9.9088","0.0008","90","","90","","90","","1550.76","0.15","223","2","170","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","Di-n-butyltin(IV)glutarate polymer","","","- C13 H24 O4 Sn -","- C13 H24 O4 Sn -","- C52 H96 O16 Sn4 -","4","0.5","WW6019","Ramirez, Alejandro R.; Parvez, Masood; Ahmad, Viqar Uddin; Hussain, Javid; Hussain, Hidayat","Polymeric di-<i>n</i>-butyl(glutarato)tin(IV)","Acta Crystallographica Section E","2002","58","6","m278","m280","10.1107/S1600536802008164","","","0.71073","MoKα","","0.033","0.028","","","0.063","0.066","","","","","","1.19","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201211","8.9962","0.0002","10.1856","0.0002","10.8439","0.0003","69.9082","0.0009","83.7866","0.001","75.1111","0.0013","901.63","0.04","173","2","173","2","","","","","","","","6","P -1","-P 1","2","Triethylammonium dichloro dimethyl tin(IV) 3-carboxy acrylate","","","- C12 H25 Cl2 N O4 Sn -","- C12 H25 Cl2 N O4 Sn -","- C24 H50 Cl4 N2 O8 Sn2 -","2","1","WW6021","Chandler, Brett D.; Parvez, Masood; Ahmad, Viqar Uddin; Hussain, Javid; Hussain, Hidayat; Zubair, Mohammad","Triethylammonium (3-carboxyacrylato)dichlorodimethyltin(IV)","Acta Crystallographica Section E","2002","58","6","m281","m283","10.1107/S1600536802008176","","","0.71073","MoKα","","0.021","0.02","","","0.047","0.048","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201212","13.164","0.001","8.3883","0.0007","17.939","0.002","90","","97.869","0.002","90","","1962.2","0.3","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","μ-Peroxo-bis[acetonitrilebis(ethylenediamine)cobalt(III)] tetratriflate","","- C16 H38 Co2 F12 N10 O14 S4 -","- C16 H38 Co2 F12 N10 O14 S4 -","- C32 H76 Co4 F24 N20 O28 S8 -","2","0.5","YA6077","McMullen, Sarah E.; Hagen, Karl S.","μ-Peroxo-bis[acetonitrilebis(ethylenediamine)cobalt(III)] tetratriflate","Acta Crystallographica Section E","2002","58","4","m141","m143","10.1107/S160053680200226X","","","0.71073","MoKα","","0.056","0.04","","","0.095","0.1","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201213","7.5424","0.0006","9.5834","0.0008","10.7427","0.0008","69.671","0.007","80.402","0.009","87.077","0.008","717.92","0.11","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2-(4-Methylbenzoyloxy)-5-methylacetophenone","","- C17 H16 O3 -","- C17 H16 O3 -","- C34 H32 O6 -","2","1","YA6088","Kazak, Canan; Aygün, Muhittin; Kuş, Canan; Özbey, Süheyla; Büyükgüngör, Orhan","5-Methyl-2-(4-methylbenzoyloxy)acetophenone","Acta Crystallographica Section E","2002","58","6","o612","o614","10.1107/S1600536802007651","","","1.5418","CuKα","","0.069","0.052","","","0.146","0.158","","","","","","1.09","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201214","7.623","0.003","12.762","0.004","28.155","0.007","90","","90","","90","","2739.1","1.5","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","N-(1,1-dimethylethyl)-9-acridinamine","","- C17 H18 N2 -","- C17 H18 N2 -","- C136 H144 N16 -","8","1","YA6091","Joanna Meszko; Karol Krzymiński; Antoni Konitz; Jerzy Błażejowski","9-(<i>tert</i>-Butylamino)acridine","Acta Crystallographica Section E","2002","58","4","o458","o460","10.1107/S1600536802005111","","","0.71073","MoKα","","0.072","0.044","","","0.11","0.129","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201215","8.796","0.002","16.337","0.005","11.058","0.003","90","","106.994","0.003","90","","1519.7","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[VO(H~2~biim)(H~2~O)~3~]SO~4~^.^2H~2~O","Triaqua(2,2'-biimidazole)oxovandium(IV) sulfate dihydrate","","- C6 H16 N4 O10 S V -","- C6 H16 N4 O10 S V -","- C24 H64 N16 O40 S4 V4 -","4","1","YA6092","Sang, Ruili; Zhu, Miaoli; Yang, Pin","Triaqua(2,2'-biimidazole)oxovanadium(IV) sulfate dihydrate","Acta Crystallographica Section E","2002","58","5","m172","m175","10.1107/S1600536802005615","","","0.71073","MoKα","","0.066","0.057","","","1","0.102","","","","","","1","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2201216","21.8715","0.0007","21.8715","0.0007","7.8297","0.0003","90","","90","","120","","3243.64","0.19","150","1","150","1","","","","","","","","5","R -3 :H","-R 3","148","","meso-1,2-(2-Hydroxyphenyl)-1,2-ethylenediammonium dichloride","","- C14 H18 Cl2 N2 O2 -","- C14 H18 Cl2 N2 O2 -","- C126 H162 Cl18 N18 O18 -","9","0.5","YA6093","Bryant, Craig; Chin, Jik; Lough, Alan J.; Alhakimi, Gamil","<i>meso</i>-1,2-(2-Hydroxyphenyl)-1,2-ethylenediammonium dichloride","Acta Crystallographica Section E","2002","58","4","o456","o457","10.1107/S1600536802004920","","","0.71073","MoKα","","0.028","0.026","","","0.067","0.068","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201217","6.6676","0.0013","8.9717","0.0018","8.5003","0.0016","90","","104.358","0.004","90","","492.6","0.17","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","N-methylmethanesulfonamide","N-methylmethanesulfonamide","","- C2 H7 N O2 S -","- C2 H7 N O2 S -","- C8 H28 N4 O8 S4 -","4","1","YA6094","Timothy C. Higgs; Andrew Parkin; Simon Parsons; Peter A. Tasker","<i>N</i>-Methylmethanesulfonamide at 150K","Acta Crystallographica Section E","2002","58","5","o523","o525","10.1107/S1600536802006244","","","0.71073","MoKα","","0.039","0.035","","","0.082","0.083","","","","","","0.96","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201218","19.7987","0.0011","11.232","0.0005","19.3329","0.0011","90","","115.88","0.002","90","","3868.1","0.4","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","6,8-Dimethoxy-1,3-trans-dimethylisochroman-5-yl diethyl phosphate","","- C17 H27 O7 P -","- C17 H27 O7 P -","- C136 H216 O56 P8 -","8","1","YA6095","Cook, Leanne; de Koning, Charles B.; Fernandes, Manuel A.; Michael, Joseph P.; van Otterlo, Willem A. L.","6,8-Dimethoxy-1,3-<i>trans</i>-dimethylisochroman-5-yl diethyl phosphate","Acta Crystallographica Section E","2002","58","4","o440","o441","10.1107/S1600536802004567","","","0.71073","MoKα","","0.108","0.074","","","","0.17","","","","","","1.15","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201219","8.219","0.004","16.203","0.007","12.991","0.006","90","","105.19","0.01","90","","1669.6","1.3","298","2","298","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Hexakis(imidazole-N)cobalt(II) 1,4-benzenedicarboxylate tetrahydrate","","- C26 H36 Co N12 O8 -","- C26 H36 Co N12 O8 -","- C52 H72 Co2 N24 O16 -","2","0.5","YA6096","Tong, Ming-Liang; Li, Wei; Chen, Xiao-Ming; Ng, Seik Weng","Hexakis(imidazole-<i>N</i>)cobalt(II) 1,4-benzenedicarboxylate tetrahydrate","Acta Crystallographica Section E","2002","58","5","m186","m188","10.1107/S1600536802005925","","","0.71073","MoKα","","0.086","0.058","","","0.157","0.179","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201220","8.925","0.002","13.862","0.003","18.341","0.004","91.81","0.03","91.85","0.03","104.32","0.03","2195.6","0.9","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Tetradecaaquatetrasodium hexaaquanickel(II) decavanadate(V) trihydrate","","- H46 Na4 Ni O51 V10 -","- H46 Na4 Ni O51 V10 -","- H92 Na8 Ni2 O102 V20 -","2","1","YA6097","Sun, Zi-Guang; Long, La-Sheng; Ren, Yan-Ping; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","Tetradecaaquatetrasodium hexaaquanickel(II) decavanadate(V) trihydrate","Acta Crystallographica Section E","2002","58","5","i34","i36","10.1107/S1600536802005421","","","0.71073","MoKα","","0.065","0.04","","","0.089","0.1","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201221","11.7347","0.0014","11.6976","0.0013","17.6391","0.0014","90","","94.32","0.01","90","","2414.4","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4,8,9,10-Tetraphenyl-1,3-diazaadamantan-6-one","4,8,9,10-Tetraphenyl-1,3-diazaadamantan-6-one","","- C32 H28 N2 O -","- C32 H28 N2 O -","- C128 H112 N8 O4 -","4","1","YA6098","M. Subha Nandhini; R. V. Krishnakumar; T. Narasimhamurthy; V. Vijayakumar; M. Sundaravadivelu; S. Natarajan","4,8,9,10-Tetraphenyl-1,3-diazaadamantan-6-one","Acta Crystallographica Section E","2002","58","6","o675","o677","10.1107/S1600536802008772","","","1.5418","CuKα","","0.054","0.044","","","0.109","0.118","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201222","6.8629","0.0004","9.1707","0.0005","10.7176","0.0006","90","","108.048","0.001","90","","641.35","0.06","223","2","223","2","","","","","","","","4","P 1 c 1","P -2yc","7","","","","- C13 H14 N4 S -","- C13 H14 N4 S -","- C26 H28 N8 S2 -","2","1","YA6100","Lai, Chian Sing; Tiekink, Edward R. T.","1,3-Bis(3-pyridylmethyl)-2-thiourea","Acta Crystallographica Section E","2002","58","5","o538","o539","10.1107/S1600536802006220","","","0.71069","MoKα","","0.041","0.04","","","0.11","0.111","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201223","8.1183","0.0007","5.928","0.0005","9.0398","0.0007","90","","113","0.007","90","","400.46","0.06","120","2","120","2","","","","","","","","3","P 1 21 1","P 2yb","4","","4,4-Dimethyl-3,5,8,10-tetraoxatricyclo[5.2.1.0^2,6^]decane","","- C8 H12 O4 -","- C8 H12 O4 -","- C16 H24 O8 -","2","1","YA6101","Light, Mark E.; Murphy, Patrick J.; Brown, Paul M.; Hursthouse, Michael B.","4,4-Dimethyl-3,5,8,10-tetraoxatricyclo[5.2.1.0^2,6^]decane","Acta Crystallographica Section E","2002","58","5","o560","o561","10.1107/S160053680200661X","","","0.71073","MoKα","","0.052","0.033","","","0.063","0.069","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201224","15.48","0.001","15.638","0.002","8.048","0.001","90","","90","","90","","1948.2","0.4","298","2","298","2","","","","","","","","5","C m m a","-C 2a 2","67","","catena-μ-(N,N'-hexamethylenetetramine)[tetra-μ-acetatodinickel(II)]","","- C14 H24 N4 Ni2 O8 -","- C14 H24 N4 Ni2 O8 -","- C56 H96 N16 Ni8 O32 -","4","0.25","YA6102","Wang, Shun; Hu, Mao-Lin; Ng, Seik Weng","<i>catena</i>-Poly[[tetra-μ-acetatodinickel(II)]μ-<i>N,N</i>'-hexamethylenetetramine]","Acta Crystallographica Section E","2002","58","5","m242","m244","10.1107/S1600536802007316","","","0.71073","MoKα","","0.042","0.03","","","0.07","0.076","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201225","11.329","0.001","13.595","0.002","9.565","0.001","90","","106.32","0.01","90","","1413.8","0.3","295","","295","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Iron methylxanthate","Tris(O-methyldithiocarbonato)iron(III)","","- C6 H9 Fe O3 S6 -","- C6 H9 Fe O3 S6 -","- C24 H36 Fe4 O12 S24 -","4","1","YA6103","Tetsuzo Ito","Iron methylxanthate","Acta Crystallographica Section E","2002","58","6","m265","m266","10.1107/S1600536802007808","","","0.71069","MoKα","","","0.026","","","","0.034","","","","","","1.42","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201226","7.0273","0.0014","9.684","0.0019","15.24","0.003","90","","90","","90","","1037.1","0.4","90","0.2","90","0.2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","1-Hydro-4,4'-bipyridinium bromide monohydrate","","- C10 H11 Br N2 O -","- C10 H11 Br N2 O -","- C40 H44 Br4 N8 O4 -","4","1","AC6006","Iyere, Peter A.; Boadi, William Y.; Brooks, Roxanne S.; Atwood, David; Parkin, Sean","4,4'-Bipyridin-1-ium bromide monohydrate","Acta Crystallographica Section E","2002","58","8","o825","o827","10.1107/S1600536802011728","","","0.71073","MoKα","","0.0296","0.0249","","","0.0512","0.0523","","","","","","1.068","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201227","7.4171","0.0002","9.2543","0.0003","11.0343","0.0004","90","","95.073","0.001","90","","754.43","0.04","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C5 H14 N2 O2 -","- C5 H14 N2 O2 -","- C20 H56 N8 O8 -","4","1","AC6007","Kreher, Ulf; Raston, Colin L.; Strauss, Christopher R.; Nichols, Peter J.","<i>N,N</i>-Dimethylammonium <i>N</i>',<i>N</i>'-dimethylcarbamate","Acta Crystallographica Section E","2002","58","8","o948","o949","10.1107/S1600536802013363","","","0.71073","MoKα","","0.0787","0.0426","","","0.0981","0.1097","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201228","13.546","0.002","7.6006","0.0012","11.698","0.0019","90","","90","","90","","1204.4","0.3","100","2","100","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C11 H17 N5 -","- C11 H17 N5 -","- C44 H68 N20 -","4","1","AC6008","Ilia A. Guzei; Galina A. Bikzhanova","Diethylammonium 5-phenyltetrazolate","Acta Crystallographica Section E","2002","58","8","o937","o939","10.1107/S1600536802013351","","","0.71073","MoKα","","0.0515","0.049","","","0.1061","0.107","","","","","","1.369","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201229","13.936","0.002","10.887","0.0019","8.4833","0.0014","90","","90","","90","","1287.1","0.4","295","2","295","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C8 H2 N6 O12 -","- C8 H2 N6 O12 -","- C32 H8 N24 O48 -","4","0.5","AC6009","Richard Gilardi; Ray J. Butcher; Mao-Xi Zhang","1,2,3,4,5,7-Hexanitrocubane","Acta Crystallographica Section E","2002","58","9","o978","o980","10.1107/S1600536802013739","","","0.71073","MoKα","","0.068","0.0456","","","0.1242","0.1357","","","","","","1.029","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201230","6.7571","0.0014","12.43","0.003","28.88","0.006","90","","90","","90","","2425.7","0.9","180","2","180","2","","","","","","","","4","C 2 2 21","C 2c 2","20","","4-(R)-[4-amino-2,6-dioxopyrimidine-1-yl]-3(S)-hydroxy-2(R)-furan methanol solvate","","- C10 H17 N3 O6 -","- C9.9997 H16.9989 N3 O5.9997 -","- C79.9976 H135.991 N24 O47.9976 -","8","1","AC6010","Swenson, Dale C.; Bera ,Sanjib; Nair, Vasu","Tautomeric 6-oxoisocytidine (methanol solvate)","Acta Crystallographica Section E","2002","58","9","o1031","o1033","10.1107/S1600536802015040","","","0.71073","MoKα","","0.0678","0.0517","","","0.1193","0.1282","","","","","","1.062","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2201231","10.473","0.005","10.473","0.005","28.166","0.018","90","","90","","120","","2675","2","298","2","298","2","","","","","","","","5","P 31","P 31","144","","bis[(1R,2R)-(-)-1,2-bis(trimethylsilylamino)cyclohexane-κ^2^N,N']zirconium","","- C24 H56 N4 Si4 Zr -","- C24 H56 N4 Si4 Zr -","- C72 H168 N12 Si12 Zr3 -","3","1","AC6011","Jian-Feng Li; Lin-Hong Weng; Shu-Ping Huang; Hong-Bo Tong; Dian-Sheng Liu","Bis[(1<i>R</i>,2<i>R</i>)-({-})-1,2-bis(trimethylsilylamino)cyclohexane(2{-})-κ^2^<i>N,N</i>']zirconium(IV)","Acta Crystallographica Section E","2002","58","10","m510","m512","10.1107/S1600536802015660","","","0.71073","Mokα","","0.0485","0.0474","","","0.1082","0.1088","","","","","","1.281","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201232","7.872","0.002","7.986","0.002","9.414","0.002","90.456","0.005","95.284","0.005","118.701","0.005","516","0.2","93","2","93","2","","","","","","","","5","P -1","-P 1","2","","dihydronium 3-nitrobenzenesulfonate","","- C6 H9 N O7 S -","- C6 H9 N O7 S -","- C12 H18 N2 O14 S2 -","2","1","AC6012","George, Clifford; Deschamps, Jeffrey R; Purdy, Andrew P.","Dihydronium 3-nitrobenzenesulfonate","Acta Crystallographica Section E","2002","58","10","o1128","o1129","10.1107/S1600536802016914","","","0.71073","MoKα","","0.042","0.036","","","0.1","0.104","","","","","","1.08","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2201233","8.709","0.002","10.76","0.003","14.429","0.004","88.272","0.003","80.296","0.004","73.54","0.003","1277.9","0.6","168","2","168","2","","","","","","","","5","P -1","-P 1","2","","cis-[1,3-Bis(diphenylphosphino)propane]dibromoplatinum(II)","","- C27 H26 Br2 P2 Pt -","- C27 H26 Br2 P2 Pt -","- C54 H52 Br4 P4 Pt2 -","2","1","AC6013","Morgan, Joy L.; Robinson, Brian H.; Simpson, Jim","<i>cis</i>-[1,3-Bis(diphenylphosphino)propane]dibromoplatinum(II)","Acta Crystallographica Section E","2002","58","10","m504","m506","10.1107/S1600536802015428","","","0.71073","MoKα","","0.051","0.046","","","0.112","0.114","","","","","","1.23","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201234","14.383","0.003","14.217","0.003","15.252","0.005","90","","92.85","0.01","90","","3114.9","1.4","298","1","293","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","κ^2^N^13^,N^43^Hydro-rac-2,2'-bis[2-(1-propyl benzimidazol-2yl)]biphenyl trifluoromethanesulfonate","","- C33 H31 F3 N4 O3 S -","- C33 H31 F3 N4 O3 S -","- C132 H124 F12 N16 O12 S4 -","4","0.5","AC6014","Robert T. Stibrany; Harvey J. Schugar; Joseph A. Potenza","κ^2^<i>N</i>^13^,<i>N</i>^13'^-Hydro-<i>rac</i>-2,2'-bis[2-(1-propylbenzimidazol-2yl)]biphenyl trifluoromethanesulfonate, the salt of a novel proton sponge","Acta Crystallographica Section E","2002","58","10","o1142","o1144","10.1107/S1600536802016756","","","0.71073","MoKα","","0.0588","0.0463","","","0.1367","0.1463","","","","","","1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201235","12.941","0.0008","16.1308","0.0011","15.4715","0.0011","90","","100.988","0.002","90","","3170.4","0.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Trans-bis(isothiocyanato)tetrakis(pyridine)ruthenium(II)","","- C24 H24 Cl4 N6 Ru S2 -","- C24 H24 Cl4 N6 Ru S2 -","- C96 H96 Cl16 N24 Ru4 S8 -","4","0.5","AC6015","Chen, Jinglin; Han, Lei; Chen, Zhongning","<i>trans</i>-Bis(isothiocyanato)tetrapyridineruthenium(II) dichloromethane disolvate","Acta Crystallographica Section E","2002","58","10","m588","m589","10.1107/S1600536802017300","","","0.71073","MoKα","","0.0603","0.0472","","","0.1063","0.1172","","","","","","1.148","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2201236","5.1113","0.0001","11.3497","0.0002","19.3853","0.0003","90","","90","","90","","1124.57","0.03","105","2","105","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","L-citrullinium perchlorate","L-citrullinium perchlorate","","- C6 H14 Cl N3 O7 -","- C6 H14 Cl N3 O7 -","- C24 H56 Cl4 N12 O28 -","4","1","AC6016","Sridhar, B.; Srinivasan, N.; Dalhus, Bjoern; Rajaram, R. K.","<small>L</small>-Citrullinium perchlorate","Acta Crystallographica Section E","2002","58","10","o1177","o1179","10.1107/S160053680201766X","","","0.71074","MoKα","","0.0235","0.0229","","","0.0674","0.0678","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201237","10.0098","0.0012","15.1046","0.0018","11.5086","0.0014","90","","106.5","0.02","90","","1668.4","0.4","203","2","203","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","[Cu(trifac)2(dabcoCH2Cl)2][BF4]2","","","- C24 H36 B2 Cl2 Cu F14 N4 O4 -","- C24 H36 B2 Cl2 Cu F14 N4 O4 -","- C48 H72 B4 Cl4 Cu2 F28 N8 O8 -","2","0.5","AC6017","Twamley, Brendan; Gupta, O. D.; Shreeve, Jean'ne M.","Bis(1-chloromethyldiazabicyclo[2.2.2]octane-κ<i>N</i>^4^)bis(trifluoropentane-2,4-dionato)copper(II) bis(tetrafluoroborate)","Acta Crystallographica Section E","2002","58","11","m663","m665","10.1107/S1600536802018998","","","0.71073","MoKα","","0.0541","0.0398","","","0.1034","0.1099","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201238","5.1446","0.0008","13.721","0.003","7.4751","0.0009","90","0.01","98.09","0.01","90","0.01","522.41","0.15","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","L-alaninium tartrate","L-alaninium tartrate","","- C7 H13 N O8 -","- C7 H13 N O8 -","- C14 H26 N2 O16 -","2","1","AC6018","K. Rajagopal; M. Subha Nandhini; R. V. Krishnakumar; S. Natarajan","<small>L</small>-Alaninium tartrate","Acta Crystallographica Section E","2002","58","11","o1306","o1308","10.1107/S1600536802019414","","","0.71073","MoKα","","0.0439","0.0436","","","0.114","0.1144","","","","","","1.066","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201239","7.416","0.0015","13.344","0.003","11.141","0.002","90","","92.9","0.03","90","","1101.1","0.4","295","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C11 H12 N4 -","- C11 H12 N4 -","- C44 H48 N16 -","4","1","AC6019","Nesterov, Volodymyr V.","6-Ethyl-5,7-dimethyl-6<i>H</i>-1,4-diazepine-2,3-dicarbonitrile","Acta Crystallographica Section E","2002","58","12","o1458","o1459","10.1107/S1600536802020858","","","0.71073","MoKα","","0.1141","0.0425","","","0.0946","0.1105","","","","","","1.176","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201240","6.698","0.0002","13.6063","0.0003","17.2155","0.0005","90","","90","","90","","1568.93","0.07","120","2","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","ent-5α,15α-epoxy-9,10-friedo-10β,11β-dihydroxy-16,11α:19,10β-disecco-17- norkauran-16,19-dioic acid 16\ρightarrow11:19\ρightarrow10-dilactone","","- C19 H24 O5 -","- C19 H24 O5 -","- C76 H96 O20 -","4","1","AC6020","Doriguetto, Antonio C.; Vieira, Henriete S.; Ellena, Javier A.; Takahashi, Jacqueline A.; Boaventura, Maria A. D.; Mascarenhas, Yvonne P.","A novel diterpene lactone","Acta Crystallographica Section E","2002","58","12","o1392","o1394","10.1107/S160053680202086X","","","0.7107","MoKα","","","0.0383","","","","0.1217","","","","","","1.191","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201241","18.6108","0.0004","10.7729","0.0002","18.5661","0.0006","90","","100.381","0.002","90","","3661.43","0.16","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H24 Cl8 Fe3 N6 -","- C30 H24 Cl8 Fe3 N6 -","- C120 H96 Cl32 Fe12 N24 -","4","1","AC6021","L. Mihiri D. Ariyananda; Richard E. Norman","Tris(2,2'-bipyridyl-<i>N,N</i>')iron(II) bis[tetrachloroferrate(III)]","Acta Crystallographica Section E","2002","58","12","m775","m776","10.1107/S1600536802021773","","","0.7107","MoKα","","0.0555","0.0427","","0.0856","","0.0717","","","0.916","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201242","7.55","0.005","9.068","0.005","9.983","0.005","90","","110.07","0.04","90","","642","0.6","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- Ca Mo5 O8 -","- Ca Mo5 O8 -","- Ca4 Mo20 O32 -","4","1","","Gougeon, P.; Gall, p.","CaMo~5~O~8~","Acta Crystallographica, Section E","2002","58","","i65","i67","10.1107/S1600536802010218","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2201243","7.3114","0.0004","10.9216","0.0006","6.1711","0.0003","90","","90","","90","","492.78","0.05","293","2","293","2","","","","","","","","3","P b c n","-P 2n 2ab","60","manganese ditellurite","","","- Mn O5 Te2 -","- Mn O5 Te2 -","- Mn4 O20 Te8 -","4","0.5","","Johnston, Magnus G.; Harrison, William T. A.","Managanese tellurite, β-MnTe~2~O~5~","Acta Crystallographica, Section E","2002","58","","i59","i61","10.1107/S1600536802010231","","","","","","","","","","","","","","","","","","","","","has coordinates","277836","2022-09-14","17:02:02",""
"2201244","23.034","0.002","14.677","0.002","14.348","0.001","90","","104.816","0.003","90","","4689.4","0.8","296.2","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- Gd4 Mo7 O27 -","- Gd4 Mo7 O27 -","- Gd32 Mo56 O216 -","8","1","BR6055","Haruo Naruke; Toshihiro Yamase","Gd~4~Mo~7~O~27~, a novel phase in the Gd~2~O~3~‒MoO~3~ system","Acta Crystallographica Section E","2002","58","7","i62","i64","10.1107/S1600536802010334","","","0.7107","MoKα","","","0.0389","","","","0.1077","","","","","","1.377","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201245","9.4959","0.001","9.4959","0.001","7.0361","0.0007","90","","90","","120","","549.46","0.1","295","2","295","2","","","","","","","","3","P 63/m","-P 6c","176","samarium orthosilicate oxyapatite","","","- O13 Si3 Sm5 -","- O13 Si3 Sm5 -","- O26 Si6 Sm10 -","2","0.166667","","Morgan, Mark G.; Wang, Meitian; Mar, Arthur","Samarium orthosilicate oxyapatite, Sm~5~(SiO~4~)~3~O","Acta Crystallographica, Section E","2002","58","","i70","i71","10.1107/S1600536802011868","","","","","","","","","","","","","","","","","","","","","has coordinates","277836","2022-09-14","17:02:02",""
"2201246","10.143","0.002","11.149","0.002","9.837","0.002","90","","106.31","0.03","90","","1067.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","potassium chromate dinitrate","","","- Cr K4 N2 O10 -","- Cr K4 N2 O10 -","- Cr4 K16 N8 O40 -","4","1","","Kolitsch, Uwe","K~4~(CrO~4~)(NO~3~)~2~, the first chromate(VI)-nitrate","Acta Crystallographica, Section E","2002","58","","i88","i90","10.1107/S1600536802016008","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2201247","7.4416","0.0003","11.1779","0.0004","10.4536","0.0004","90","","104.431","0.001","90","","842.11","0.06","300","","300","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","calcium sodium iminodisulfonate trihydrate","","- Ca H6 N Na O9 S2 -","- Ca H6 N Na O9 S2 -","- Ca4 H24 N4 Na4 O36 S8 -","4","1","BR6059","Folmer Fogh; Alan Hazell; Svend Erik Rasmussen","Calcium sodium iminodisulphonate trihydrate, a product of flue-gas desulfurization","Acta Crystallographica Section E","2002","58","10","i82","i84","10.1107/S1600536802015623","","","0.71073","MoKα","","","0.021","","","","0.029","","","","","","1.123","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201248","9.7044","0.0005","11.0023","0.0006","13.3937","0.0008","90","","90","","90","","1430.05","0.14","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- Co H8 K2 O16 P4 -","- Co H8 K2 O16 P4 -","- Co4 H32 K8 O64 P16 -","4","0.5","BR6060","Alaoui Tahiri, Aziz; Ouarsal, Rachid; Lachkar, Mohammed; El Bali, Brahim; Bolte, Michael","Cobalt potassium dihydrogendiphosphate dihydrate, CoK~2~(H~2~P~2~O~7~)~2~·2H~2~O","Acta Crystallographica Section E","2002","58","10","i91","i92","10.1107/S1600536802016161","","","0.71073","MoKα","","0.0292","0.0242","","","0.0592","0.0608","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201249","9.67","0.002","6.4737","0.0015","9.682","0.002","90","","102.168","0.004","90","","592.5","0.2","150","","150","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- Cl4 Ti -","- Cl4 Ti -","- Cl16 Ti4 -","4","1","","Alice Dawson; Andrew Parkin; Simon Parsons; Colin R. Pulham; Amy L.C. Young","Titanium(IV) chloride at 150 K","Acta Crystallographica, Section E","2002","58","","i95","i97","10.1107/S1600536802016665","","","","","","","","","","","","","","","","","","","","","has coordinates","282067","2023-03-26","07:49:21",""
"2201250","6.5629","0.0007","6.643","0.001","6.5309","0.0006","112.6","0.01","87.935","0.008","96.14","0.01","261.35","0.05","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- Co H Na O7 P2 -","- Co H Na O7 P2 -","- Co2 H2 Na2 O14 P4 -","2","1","","Guesmi, Abderrahmen; Driss, Ahmed","Sodium cobalt(II) hydrogendiphosphate, NaCoHP~2~O~7~","Acta Crystallographica, Section E","2002","58","","i108","i110","10.1107/S1600536802019116","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2201251","6.975","0.001","7.177","0.001","6.759","0.002","90","","104.69","0.01","90","","327.29","0.12","293","2","293","2","","","","","","","Synthetic","3","P 1 21/n 1","-P 2yn","14","","","Gasparite-(Ce)","- As Ce O4 -","- As Ce O4 -","- As4 Ce4 O16 -","4","1","","Brahim, Ayed; Mohamed Mongi, Ftini; Amor, Haddad","Cerium arsenate, CeAsO~4~","Acta Crystallographica, Section E","2002","58","","i98","i99","10.1107/S1600536802018664","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2201252","12.188","0.002","12.188","0.002","12.188","0.002","90","","90","","90","","1810.5","0.5","293","2","293","2","","","","","","","","4","I a -3 d","-I 4bd 2c 3","230","","trisodium dichrome (III) triarsenate","","- As3 Cr2 Na3 O12 -","- As3 Cr2 Na3 O12 -","- As24 Cr16 Na24 O96 -","8","0.0833333","BR6064","Bouzemi, Besma; Boughzala, Habib; Jouini, Tahar","Na~3~Cr~2~(AsO~4~)~3~: trisodium dichromium(III) triarsenate","Acta Crystallographica, Section E: Structure Reports Online","2002","58","12","i117","i118","10.1107/s1600536802019128","","","0.71073","MoKα","","0.0236","0.0191","","","0.038","0.0391","","","","","","1.136","","","","has coordinates,has Fobs","282053","2023-03-24","19:00:11",""
"2201253","16.11","0.003","7.9175","0.0012","10.931","0.002","90","","97.94","0.02","90","","1380.9","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","lanthanum iodide thiosilicate","Lanthanum(III)-iodide-di-ortho-thiosilicate","","- I La3 S8 Si2 -","- I La3 S8 Si2 -","- I4 La12 S32 Si8 -","4","0.5","BR6065","Hatscher, Stephan T.; Urland, Werner","Lanthanum iodide thiosilicate, La~3~I[SiS~4~]~2~","Acta Crystallographica Section E","2002","58","11","i100","i102","10.1107/S1600536802019256","","","0.71073","MoKα","","0.0237","0.0191","","","0.0396","0.0402","","","","","","0.95","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201254","7.838","0.002","7.493","0.001","7.812","0.002","90","","91.4","0.03","90","","458.66","0.18","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","potassium chlorochromate","","","- Cl Cr K O3 -","- Cl Cr K O3 -","- Cl4 Cr4 K4 O12 -","4","1","","Kolitsch, Uwe","Redetermination of potassium chlorochromate, KCrO~3~Cl","Acta Crystallographica, Section E","2002","58","","i105","i107","10.1107/S1600536802019396","","","","","","","","","","","","","","","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201255","14.717","0.003","12.813","0.003","9.251","0.002","90","","128.73","0.03","90","","1360.9","0.8","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","hexapotassium hexamolybdodivanadate tetrahydrate","","- H8 K6 Mo6 O30 V2 -","- H8 K6 Mo6 O30 V2 -","- H16 K12 Mo12 O60 V4 -","2","0.25","BR6067","Strukan, Neven; Devčić, Maja; Kamenar, Boris; Giester, Gerald","K~6~[Mo~6~V~2~O~26~]·4H~2~O","Acta Crystallographica Section E","2002","58","12","i114","i116","10.1107/S1600536802020536","","","0.71073","MoKα","","0.0254","0.0242","","","0.0646","0.0653","","","","","","1.088","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201256","5.9783","0.0006","13.809","0.001","8.0481","0.0007","90","","90.8","0.01","90","","664.4","0.1","293","2","293","2","","","","","","","Synthetic","4","P 1 21/n 1","-P 2yn","14","manganese(II) sulfate tetrahydrate","","Ilesite","- H16 Mn2 O16 S2 -","- H16 Mn2 O16 S2 -","- H32 Mn4 O32 S4 -","2","0.5","","Held, Peter; Bohatý, Ladislav","Manganese(II) sulfate tetrahydrate (ilesite)","Acta Crystallographica, Section E","2002","58","","i121","i123","10.1107/S1600536802020962","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2201257","5.551","0.001","5.551","0.001","8.037","0.002","90","","90","","120","","214.47","0.08","293","2","295","2","","","","","","","","4","P -3 m 1","-P 3 2""","164","CsAl(MoO~4~)~2~","","","- Al Cs Mo2 O8 -","- Al Cs Mo2 O8 -","- Al Cs Mo2 O8 -","1","0.0833333","","Tomaszewski, Paweł E.; Pietraszko, Adam; Mączka, Mirosław; Hanuza, Jerzy","CsAl(MoO~4~)~2~","Acta Crystallographica, Section E","2002","58","","i119","i120","10.1107/S1600536802020950","","","","","","","","","","","","","","","","","","","","","has coordinates","277836","2022-09-14","17:02:02",""
"2201258","12.3","0.002","10.29","0.002","16.061","0.003","90","","90","","90","","2032.8","0.6","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","samarium chloride thiosilicate","samarium chloride ortho-thiosilicate","","- Cl S6 Si Sm3 -","- Cl S6 Si Sm3 -","- Cl8 S48 Si8 Sm24 -","8","1","BR6070","Hatscher, Stephan T.; Urland, Werner","Samarium chloride sulfide thiosilicate, Sm~3~ClS~2~[SiS~4~]","Acta Crystallographica Section E","2002","58","12","i124","i126","10.1107/S1600536802021694","","","0.71073","MoKα","","0.0306","0.0198","","","0.0368","0.0384","","","","","","0.897","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201259","9.0531","0.001","13.2213","0.0014","16.0249","0.0018","82.51","0.02","82.04","0.03","82.82","0.02","1872.2","0.4","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C26 H28 B Cl4 F4 Fe N10 S4 -","- C26 H28 B Cl4 F4 Fe N10 S4 -","- C52 H56 B2 Cl8 F8 Fe2 N20 S8 -","2","1","BT6147","Lewis, Gareth R.; Hubberstey, Peter; Sampson, Claire L.","Bis[2-(1-methyl-1<i>H</i>-imidazol-2-yl-3-iosulfanyl)-6-(1-methyl-1<i>H</i>-imidazol-2-ylsulfanyl)pyridine] tetrachloroferrate tetrafluoroborate","Acta Crystallographica Section E","2002","58","7","m331","m333","10.1107/S1600536802010140","","","0.71073","MoKα","","0.1205","0.0493","","","0.0803","0.0947","","","","","","0.886","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201260","4.3347","0.0007","13.858","0.003","17.019","0.003","90","","90","","90","","1022.3","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3-Hydroxy-2,4,6-triiodobenzaldehyde","","- C7 H3 I3 O2 -","- C7 H3 I3 O2 -","- C28 H12 I12 O8 -","4","1","BT6148","Matos Beja, A.; Paixão, J. A.; Ramos Silva, M.; Alte da Veiga, L.; Serra, A.C; d'A Rocha Gonsalves, A. M.","3-Hydroxy-2,4,6-triiodobenzaldehyde","Acta Crystallographica Section E","2002","58","7","o774","o776","10.1107/S1600536802010486","","","0.71073","MoKα","","0.0625","0.0323","","","0.0895","0.1041","","","","","","0.902","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201261","10.9913","0.0003","12.6073","0.0005","11.4222","0.0003","90","","90","","90","","1582.78","0.09","293","2","293","3","","","","","","","","6","P n m a","-P 2ac 2n","62","","Tetraethylammonium aquatetrachlorooxomolybdenum(V)","","- C8 H22 Cl4 Mo N O2 -","- C8 H22 Cl4 Mo N O2 -","- C32 H88 Cl16 Mo4 N4 O8 -","4","0.5","BT6149","Simon J. Hibble; Sharon G. Eversfield; Ann M. Chippindale","Tetraethylammonium aquatetrachlorooxomolybdate(V), [Et~4~N][MoOCl~4~(H~2~O)]","Acta Crystallographica Section E","2002","58","7","m366","m368","10.1107/S1600536802010966","","","0.71073","MoKα","","","0.031","","","","0.0283","","","","","","1.1459","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2201262","14.1202","0.0005","7.1989","0.0003","29.3581","0.001","90","","99.592","0.002","90","","2942.53","0.19","160","2","160","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C18 H42 Cu2 Mo N4 O S4 -","- C18 H42 Cu2 Mo N4 O S4 -","- C72 H168 Cu8 Mo4 N16 O4 S16 -","4","1","BT6150","Clegg, William; Azizolla Beheshti; Moayad Hosaini Sadr","Bis(tetraethylammonium) bis[cyanocuprate(I)]tetrathiomolybdate(VI) hydrate","Acta Crystallographica Section E","2002","58","7","m349","m351","10.1107/S160053680201070X","","","0.71073","MoKα","","0.0292","0.0236","","","0.0543","0.0561","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201263","5.5614","0.0007","7.81","0.001","27.52","0.005","90","","90","","90","","1195.3","0.3","160","2","160","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(4S,5S)-4-Methyl-5-(4-tolylthiocarbonyl)oxazolidin-2-one","","- C12 H13 N O3 S -","- C12 H13 N O3 S -","- C48 H52 N4 O12 S4 -","4","1","BT6151","Clegg, William; .; Elsegood, Mark R. J.","(4<i>S</i>,5<i>S</i>)-4-Methyl-5-(4-tolylthiocarbonyl)oxazolidin-2-one","Acta Crystallographica Section E","2002","58","7","o758","o759","10.1107/S1600536802010711","","","0.71073","MoKα","","0.0267","0.0267","","","0.0682","0.0682","","","","","","1.108","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201264","8.931","0.003","12.854","0.005","14.884","0.004","75.067","0.018","72.757","0.014","75.547","0.015","1548.7","0.9","160","2","160","2","","","","","","","","5","P -1","-P 1","2","","(4RS,5RS)-4-Phenyl-5-(4-tolylthiocarbonyl)oxazolidin-2-one","","- C17 H15 N O3 S -","- C17 H15 N O3 S -","- C68 H60 N4 O12 S4 -","4","2","BT6152","Clegg, William; .; Elsegood, Mark R. J.","(4<i>RS</i>,5<i>RS</i>)-4-Phenyl-5-(4-tolylthiocarbonyl)oxazolidin-2-one","Acta Crystallographica Section E","2002","58","7","o760","o762","10.1107/S1600536802010723","","","0.71073","MoKα","","0.0413","0.0393","","","0.1053","0.1078","","","","","","1.046","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201265","22.696","0.003","6.2094","0.0008","24.555","0.003","90","","106.205","0.003","90","","3323","0.7","160","2","160","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(4RS,5RS)-4-Benzyl-5-(4-tolylthiocarbonyl)oxazolidin-2-one","","- C18 H17 N O3 S -","- C18 H17 N O3 S -","- C144 H136 N8 O24 S8 -","8","2","BT6153","Clegg, William; Elsegood, Mark R. J.","(4<i>RS</i>,5<i>RS</i>)-4-Benzyl-5-(4-tolylthiocarbonyl)oxazolidin-2-one","Acta Crystallographica Section E","2002","58","7","o763","o764","10.1107/S1600536802010735","","","0.71073","MoKα","","0.1402","0.0726","","","0.1209","0.1453","","","","","","1.118","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201266","7.244","0.003","6.3067","0.0019","11.554","0.003","90","","99.41","0.03","90","","520.8","0.3","160","2","160","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(4S,5S)-4-Benzyl-2-oxooxazolidine-5-carboxylic acid","","- C11 H11 N O4 -","- C11 H11 N O4 -","- C22 H22 N2 O8 -","2","1","BT6154","Clegg, William; Elsegood, Mark R. J.","(4<i>S</i>,5<i>S</i>)-4-Benzyl-2-oxooxazolidine-5-carboxylic acid","Acta Crystallographica Section E","2002","58","7","o765","o766","10.1107/S1600536802010747","","","1.54184","CuKα","","0.0275","0.0272","","","0.0736","0.0739","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201267","11.901","0.0009","5.7705","0.0004","13.7964","0.001","90","","109.043","0.002","90","","895.61","0.11","160","2","160","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(4S,5S)-2-Benzyloxy-4-methyl-5-(4-tolylthiocarbonyl)oxazoline","","- C19 H19 N O3 S -","- C19 H19 N O3 S -","- C38 H38 N2 O6 S2 -","2","1","BT6155","Clegg, William; Horsburgh, Lynne","(4<i>S</i>,5<i>S</i>)-2-Benzyloxy-4-methyl-5-(4-tolylthiocarbonyl)oxazoline","Acta Crystallographica Section E","2002","58","7","o767","o768","10.1107/S1600536802010759","","","0.71073","MoKα","","0.0321","0.03","","","0.0776","0.0791","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201268","15.5758","0.0016","5.4976","0.0005","11.2826","0.0015","90","","90","","90","","966.12","0.18","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","Ammonium mercury(II)-dichloride-nitrate","","","- Cl2 H8 Hg N4 O6 -","- Cl2 H8 Hg N4 O6 -","- Cl8 H32 Hg4 N16 O24 -","4","0.5","","Nockemann, Peter; Meyer, Gerd","Ammonium mercury(II) dichloride nitrate, (NH~4~)~2~HgCl~2~(NO~3~)~2~","Acta Crystallographica, Section E","2002","58","","i68","i69","10.1107/S1600536802011145","","","","","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2201269","9.9298","0.0002","16.4275","0.0005","12.4812","0.0004","90","","108.817","0.001","90","","1927.14","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Hexakis(μ~3~-pridine-2-thiolato-κ^3^N:S:S)hexasilver(I)","","- C30 H24 Ag6 N6 S6 -","- C30 H24 Ag6 N6 S6 -","- C60 H48 Ag12 N12 S12 -","2","0.5","BT6157","Han, Lei; Chen, Zhongning; Luo, Junhua; Hong, Maochun; Cao, Rong","Hexakis(μ~3~-pyridine-2-thiolato-κ^3^<i>N</i>:<i>S</i>:<i>S</i>)hexasilver(I), [Ag~6~(μ~3~-SPy)~6~]","Acta Crystallographica Section E","2002","58","8","m383","m384","10.1107/S1600536802011388","","","0.71073","MoKα","","0.0798","0.0528","","","0.1052","0.1203","","","","","","1.263","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201270","27.0655","0.0006","5.6822","0.0002","19.3829","0.0006","90","","120.394","0.0018","90","","2571.26","0.14","291","1","291","1","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","","","- C18 H16 -","- C18 H16 -","- C144 H128 -","8","1","BT6158","Jovanovic, Jovan; Elling, Wilhelm; Schürmann, Markus; Preut, Hans; Spiteller, Michael","2,3,1',3'-Tetrahydro-[1,2']biindenylidene","Acta Crystallographica Section E","2002","58","8","o815","o816","10.1107/S1600536802011492","","","0.71073","MoKα","","0.1191","0.0359","","","0.0629","0.0685","","","","","","0.98","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201271","7.04","0.0014","11.89","0.002","13.104","0.003","116.95","0.03","91.45","0.03","96","0.03","969.1","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(3,4-dimethylaniline)bis(dimethylglyoximato)nitrocobalt(III)‒ (3,4-dichloroaniline)bis(dimethylglyoximato)nitrocobalt(III) cocrystal","","- C15 H22 Cl Co N6 O6 -","- C15 H22 Cl Co N6 O6 -","- C30 H44 Cl2 Co2 N12 O12 -","2","1","BT6159","Calmuschi, Beatrice; Kalf, Irmgard; Kirch, Monika; Thamer, Katja; Englert, Ulli","Co(dmgH)~2~(NO~2~)[C~6~H~3~(CH~3~)~2~NH~2~]‒Co(dmgH)~2~(NO~2~)(C~6~H~3~Cl~2~NH~2~) cocrystal","Acta Crystallographica Section E","2002","58","8","m402","m403","10.1107/S160053680201187X","","","0.71073","MoKα","","0.1004","0.0619","","","0.147","0.1672","","","","","","1.013","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201272","9.97","0.003","10.945","0.003","19.874","0.003","90","0.01","90","0.01","90","0.01","2168.7","0.9","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H27 N3 O5 -","- C22 H27 N3 O5 -","- C88 H108 N12 O20 -","4","1","BT6160","Flippen-Anderson, Judith L.; Deschamps, Jeffrey R; Brossi, Arnold; Greig, Nigel H.","2-Hydroxybenzoic acid salt of physostigmine","Acta Crystallographica Section E","2002","58","8","o853","o855","10.1107/S1600536802012278","","","1.54178","CuKα","","0.0455","0.0451","","","0.1229","0.1238","","","","","","0.801","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201273","9.201","0.001","10.0035","0.0006","11.195","0.002","90","","113.73","0.01","90","","943.3","0.2","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","DL-valinium dihydrogen phosphate","DL-valinium dihydrogen phosphate","","- C5 H14 N O6 P -","- C5 H14 N O6 P -","- C20 H56 N4 O24 P4 -","4","1","BT6161","Ravikumar, Bagavath Singh; Sridhar, Balasubramanian; Rajaram, Ramaswamy Karunanandam","<small>DL</small>-Valinium dihydrogen phosphate","Acta Crystallographica Section E","2002","58","8","o879","o881","10.1107/S1600536802012011","","","0.71073","MoKα","","0.0395","0.0279","","","0.0734","0.0789","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201274","12.5494","0.0008","18.3233","0.0012","20.0687","0.0013","90","","92.063","0.002","90","","4611.7","0.5","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","hydridodichlorotris(methyldiphenylphosphine)rhodium(III) dichloromethane trisolvate","","- C42 H46 Cl8 P3 Rh -","- C42 H46 Cl8 P3 Rh -","- C168 H184 Cl32 P12 Rh4 -","4","1","BT6162","Clegg, William; Scott, Andrew J.; Norman, Nicholas C.; Robins, Edward G.; Whittell, George R.","Hydridodichlorotris(methyldiphenylphosphine)rhodium(III) dichloromethane trisolvate","Acta Crystallographica Section E","2002","58","8","m408","m409","10.1107/S1600536802012242","","","0.71073","MoKα","","0.064","0.044","","","0.1024","0.118","","","","","","1.113","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201275","26.4006","0.0009","14.1098","0.0006","19.8335","0.0012","90","","111.666","0.002","90","","6866.2","0.6","160","2","160","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","trichloro(perdeuteroacetonitrile)bis(triphenylphosphine)rhodium(III)","","- C38 H30 Cl3 D3 N P2 Rh -","- C38 H33 Cl3 N P2 Rh -","- C304 H264 Cl24 N8 P16 Rh8 -","8","2","BT6163","Clegg, William; Scott, Andrew J.; Norman, Nicholas C.; Robins, Edward G.; Whittell, George R.","Trichloro(perdeuteroacetonitrile)bis(triphenylphosphine)rhodium(III)","Acta Crystallographica Section E","2002","58","8","m410","m411","10.1107/S1600536802012254","","","0.71073","MoKα","","0.0729","0.0534","","","0.1097","0.1209","","","","","","1.21","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201276","9.39","0.005","12.581","0.006","20.096","0.01","83.3","0.05","83.42","0.04","76.64","0.04","2285","2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Chloro-cis-dihydro-mer-tris(triphenylphosphine)rhodium(III) dichloromethane hemisolvate","","- C54.5 H48 Cl2 P3 Rh -","- C54.5 H46 Cl2 P3 Rh -","- C109 H92 Cl4 P6 Rh2 -","2","1","BT6164","Clegg, William; Elsegood, Mark R. J.; Norman, Nicholas C.; Pickett, Nigel L.","Chloro-<i>cis</i>-dihydro-<i>mer</i>-tris(triphenylphosphine)rhodium(III) dichloromethane hemisolvate","Acta Crystallographica Section E","2002","58","8","m406","m407","10.1107/S1600536802012266","","","0.71073","MoKα","","0.0663","0.0385","","","0.098","0.109","","","","","","1.057","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201277","6.1527","0.0003","28.9053","0.0015","7.4404","0.0004","90","","92.036","0.002","90","","1322.41","0.12","291","1","291","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H14 N2 O3 -","- C15 H14 N2 O3 -","- C60 H56 N8 O12 -","4","1","BT6165","Kolev, Tsonko; Schürmann, Markus; Kleb, Dirk-Christian; Preut, Hans; Bleckmann, Paul","4-Dimethylamino-4'-nitrobenzophenone","Acta Crystallographica Section E","2002","58","8","o867","o868","10.1107/S1600536802012436","","","0.71073","MoKα","","0.1319","0.0399","","","0.0769","0.089","","","","","","0.928","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201278","14.8002","0.0015","7.4029","0.0016","16.0091","0.0016","90","","96.395","0.008","90","","1743.1","0.5","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","3,5-Dinitrosalicylic acid‒phenazine (1/1)","3,5-Dinitrosalicylic acid‒phenazine (1/1)","","- C19 H12 N4 O7 -","- C19 H12 N4 O7 -","- C76 H48 N16 O28 -","4","1","BT6166","V. S. Senthil Kumar; Srinivasan S. Kuduva; Gautam R. Desiraju","3,5-Dinitrosalicylic acid-phenazine (1/1)","Acta Crystallographica Section E","2002","58","8","o865","o866","10.1107/S1600536802012473","","","0.71073","MoKα","","0.1521","0.0587","","","0.112","0.1319","","","","","","0.916","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201279","9.5848","0.0006","15.6021","0.0009","16.4734","0.0009","90","","90","","90","","2463.5","0.2","150","","150","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","Dichloro{2,2'-thiobis[(4S)-4-isopropyl-1,3-oxazolinylphenyl]}zinc(II)","","- C24 H28 Cl2 N2 O2 S Zn -","- C24 H28 Cl2 N2 O2 S Zn -","- C96 H112 Cl8 N8 O8 S4 Zn4 -","4","1","BT6167","Kooijman, Huub; Spek, Anthony L.; Zondervan, Charon; Feringa, Ben L.","Dichloro{2,2'-thiobis[(4<i>S</i>)-4-isopropyl-1,3-oxazolinylphenyl]}zinc(II)","Acta Crystallographica Section E","2002","58","8","m429","m431","10.1107/S1600536802012497","","","0.71073","MoKa","","0.0325","0.0277","","","0.0612","0.0628","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201280","12.056","0.002","7.545","0.001","12.62","0.02","90","","99.04","0.04","90","","1133.7","1.8","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(E)-5-Methyl-2-(2-methylstyryl)pyrrole","","- C14 H15 N -","- C14 H15 N -","- C56 H60 N4 -","4","1","BT6168","Višnjevac, Aleksandar; Basarić, Nikola; Kojić-Prodić, Biserka; Šindler-Kulyk, Marija","(<i>E</i>)-5-Methyl-2-(2-methylstyryl)pyrrole","Acta Crystallographica Section E","2002","58","8","o909","o910","10.1107/S1600536802012886","","","0.71069","MoKa","","0.2836","0.0536","","","0.128","0.1859","","","","","","0.901","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201281","7.7375","0.0015","13.029","0.003","7.7605","0.0015","90","","119.744","0.003","90","","679.3","0.2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","{[Co(H2O)4(MeCN)2](NO3)2}","Tetraaquobis(acetonitrile)cobalt(II) di-nitrate","","- C4 H14 Co N4 O10 -","- C4 H14 Co N4 O10 -","- C8 H28 Co2 N8 O20 -","2","0.5","BT6169","Barnett, Sarah A.; Blake, Alexander J.; Champness, Neil R.","<i>trans</i>-Bis(acetonitrile)tetraaquacobalt(II) dinitrate at 150K","Acta Crystallographica Section E","2002","58","8","m444","m446","10.1107/S1600536802012850","","","0.71073","MoKα","","0.041","0.0339","","","0.0779","0.0817","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201282","7.4727","0.0006","8.2356","0.0004","9.6678","0.0008","81.208","0.005","88.722","0.003","76.169","0.004","570.87","0.07","150","1","150","1","","","","","","","","4","P -1","-P 1","2","","N-(6-amino-3,4-dihydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl)glycylglycinate","","- C9 H12 N6 O5 -","- C9 H12 N6 O5 -","- C18 H24 N12 O10 -","2","1","BT6170","Low, John Nicolson; Quesada, Antonio; Glidewell, Christopher; Fontecha, M. Angeles; Arranz, Paloma; Godino, M. Luz; López, Rafael","The supramolecular structure of <i>N</i>-(6-amino-3,4-dihydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl)glycylglycinate contains a unique O—H···N(nitroso) hydrogen bond","Acta Crystallographica Section E","2002","58","8","o942","o945","10.1107/S1600536802013405","","","0.71073","MoKα","","0.0622","0.0444","","","0.1117","0.1215","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201283","8.3572","0.0009","12.1209","0.0013","12.5925","0.0013","76.912","0.002","84.302","0.002","85.681","0.002","1234.5","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4,4'-[2,2-methylenebis(4-chlorophenoxy)]diphthalonitrile","","- C29 H14 Cl2 N4 O2 -","- C29 H14 Cl2 N4 O2 -","- C58 H28 Cl4 N8 O4 -","2","1","BT6171","Çoruh, Ufuk; Işık, Şamil; Akdemir, Nesuhi; Ag̃ar, Erbil; Vázquez-López, Ezequiel M.; Erdönmez, Ahmet","4,4'-[2,2-Methylenebis(4-chlorophenoxy)]diphthalonitrile","Acta Crystallographica Section E","2002","58","8","o953","o955","10.1107/S1600536802013491","","","0.71073","MoKα","","0.112","0.0473","","","0.0888","0.1036","","","","","","0.83","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201284","11.1715","0.0009","5.9994","0.0005","11.7159","0.001","90","","109.961","0.002","90","","738.05","0.11","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,4,5,8-tetramethoxyanthracene","","- C18 H18 O4 -","- C18 H18 O4 -","- C36 H36 O8 -","2","0.5","BT6172","Springer, J. W.; Moore, T. A.; Moore, A. L.; Gust, Devens; Groy, Thomas L.","1,4,5,8-Tetramethoxyanthracene","Acta Crystallographica Section E","2002","58","10","o1145","o1146","10.1107/S1600536802016975","","","0.71073","MoKα","","0.0778","0.0525","","","0.1269","0.1395","","","","","","1.008","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201285","6.312","0.001","10.571","0.001","12.396","0.002","84.205","0.007","77.098","0.008","88.827","0.005","802.1","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","ethyl 2-cyclopentoxy-4-hydroxy-5-ethyl-6-methylnicotinate","","- C16 H23 N O4 -","- C16 H23 N O4 -","- C32 H46 N2 O8 -","2","1","BT6173","Boland, Sandro; Cauvin, Christine; Norberg, Bernadette; Le Van, Kiet; Georges, Benoît; Hevesi, Laszlo; Durant, François","Ethyl 2-(cyclopentyloxy)-5-ethyl-4-hydroxy-6-methylnicotinate","Acta Crystallographica Section E","2002","58","8","o964","o965","10.1107/S1600536802013612","","","1.54178","CuKα","","0.1257","0.0594","","","0.1489","0.1854","","","","","","1.007","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201286","9.826","0.002","7.171","0.001","23.941","0.005","90","","101.57","0.03","90","","1652.7","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","9-thio-2-methyl-4-nitrophenyl) acridine","","- C20 H14 N2 O2 S -","- C20 H14 N2 O2 S -","- C80 H56 N8 O8 S4 -","4","1","BT6174","Mrozek, Agnieszka; Karolak-Wojciechowska, Janina; Amiel, Pascale; Barbe, Jacques","9-(Thio-2'-methyl-4'-nitrophenyl) acridine","Acta Crystallographica Section E","2002","58","10","o1065","o1067","10.1107/S1600536802015763","","","1.54178","CuKα","","0.0733","0.0578","","","0.1371","0.1655","","","","","","1.108","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201287","7.9356","0.0001","14.4258","0.0001","24.4415","0.0004","96.613","0.001","92.518","0.001","91.815","0.001","2774.8","0.06","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H29 Cl6 Mo3 N O7 -","- C14 H29 Cl6 Mo3 N O7 -","- C56 H116 Cl24 Mo12 N4 O28 -","4","2","BT6175","Yu-Biao Chen; Zhao-Ji Li; Ye-Yan Qin; Yao Kang; Jian-Kai Cheng; Rui-Feng Hu; Yi-Hang Wen; Yuan-Gen Yao","A new polymorph of tetraethylammonium tris(μ-acetato-<i>O,O</i>')tri-μ-chloro-trichloro-μ~3~-oxo-<i>triangulo</i>-trimolybdenum","Acta Crystallographica Section E","2002","58","9","m490","m491","10.1107/S1600536802013892","","","0.71073","MoKα","","0.1064","0.071","","","0.1331","0.1574","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201288","12.972","0.002","23.653","0.004","9.304","0.004","100.61","0.02","98.53","0.02","96.03","0.013","2749","1.4","297.2","","","","","","","","","","","3","P -1","-P 1","2","","trans-3,3'-Bis(diphenylhydroxymethyl)stilbene-benzene (3/4)","","- C144 H120 O6 -","- C144 H120 O6 -","- C144 H120 O6 -","1","0.5","BT6176","Ohba, Shigeru; Hiratsuka, Takaichi; Tanaka, Koichi","<i>trans</i>-3,3'-Bis(diphenylhydroxymethyl)stilbene‒benzene (3/4)","Acta Crystallographica Section E","2002","58","9","o1013","o1015","10.1107/S1600536802014095","","","0.7107","MoKα","","","0.051","","","","0.155","","","","","","0.969","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201289","12.162","0.003","11.1693","0.0015","14.241","0.003","90","","110.642","0.014","90","","1810.3","0.7","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H22 Bi Cl2 N -","- C16 H22 Bi Cl2 N -","- C64 H88 Bi4 Cl8 N4 -","4","1","BT6177","Charmant, Jonathan P. H.; Orpen, A. Guy; James, Sian C.; Norman, Nicholas C.; Starbuck, Jonathan","Tetramethylammonium dichlorodiphenylbismuthate(III)","Acta Crystallographica Section E","2002","58","9","m488","m489","10.1107/S1600536802013909","","","0.71073","MoKα","","0.0271","0.0223","","","0.0507","0.0519","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201290","16.38","0.004","15.653","0.003","24.074","0.004","90","","90","","90","","6172","2","178","2","178","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","{N-[tert-Butyl(phenyl)phosphino]-N'-diphenylphosphino-N,N'-dimethylurea- P,P'}dichloroplatinum(II) chloroform solvate","","- C26 H31 Cl5 N2 O P2 Pt -","- C26 H31 Cl5 N2 O P2 Pt -","- C208 H248 Cl40 N16 O8 P16 Pt8 -","8","1","BT6178","Jones, Peter G.; Schmutzler, Reinhard; Vogt, Roland","{<i>N</i>-[<i>tert</i>-Butyl(phenyl)phosphino]-<i>N</i>'-diphenylphosphino-<i>N</i>,<i>N</i>'-dimethylurea-<i>P</i>,<i>P</i>'}dichloroplatinum(II) chloroform solvate","Acta Crystallographica Section E","2002","58","9","m476","m477","10.1107/S1600536802014083","","","0.71073","MoKα","","0.0712","0.0336","","","0.0716","0.0866","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201291","7.916","0.004","12.114","0.006","13.28","0.007","106.19","0.02","98.18","0.01","95.43","0.02","1198.4","1.1","296","2","296","2","","","","","","","","6","P -1","-P 1","2","sodium pyrithione dihydrate","Sodium 1-hydroxypyridine-2(1H)-thiolate dihydrate","","- C5 H8 N Na O3 S -","- C5 H8 N Na O3 S -","- C30 H48 N6 Na6 O18 S6 -","6","3","BT6179","Bond, Andrew D.","Sodium 1-hydroxypyridine-2(1<i>H</i>)-thiolate dihydrate","Acta Crystallographica Section E","2002","58","9","m492","m493","10.1107/S1600536802015003","","","1.5418","CuKα","","0.0585","0.0417","","","0.1037","0.1128","","","","","","1.047","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201292","15.89","0.002","11.2944","0.0016","21.125","0.003","90","","90","","90","","3791.3","0.9","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","Modified amino acid","Macrocyclic cyclophane-based unusual amino acid","","- C42 H46 N2 O6 -","- C42 H46 N2 O6 -","- C168 H184 N8 O24 -","4","0.5","BT6180","Lakshminarasimhan Damodharan; B. Syed Ibrahim; Vasantha Pattabhi; Manoranjan Behera; Sambasivarao Kotha","<i>anti</i>-2,19-Diethoxycarbonyl-2,19-diformylamino[3.2.3.2]paracyclophane","Acta Crystallographica Section E","2002","58","9","o1038","o1039","10.1107/S1600536802015313","","","0.71073","MoKα","","0.1052","0.0674","","","0.1586","0.1788","","","","","","1.085","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201293","7.4699","0.0019","14.379","0.002","12.5687","0.001","90","","90","","90","","1350","0.4","293","2","293","2","","","","","","","","5","A m a 2","A 2 -2a","40","","","","- C9 H14 Cl3 Hg N -","- C9 H14 Cl3 Hg N -","- C36 H56 Cl12 Hg4 N4 -","4","0.5","BT6181","Nockemann, Peter; Meyer, Gerd","Trimethylphenylammonium trichloromercurate(II), (Me~3~PhN)[HgCl~3~]","Acta Crystallographica Section E","2002","58","10","m527","m528","10.1107/S1600536802015325","","","0.71073","MoKα","","0.0282","0.0232","","","0.0565","0.0577","","","","","","0.996","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2201294","9.1148","0.0016","10.8302","0.0013","16.14","0.004","90","","107.377","0.017","90","","1520.5","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H40 Br6 Hg2 N2 -","- C16 H40 Br6 Hg2 N2 -","- C32 H80 Br12 Hg4 N4 -","2","0.5","BT6182","Nockemann, Peter; Meyer, Gerd","Bis(tetraethylammonium) di-μ-bromo-bis[dibromomercurate(II)], (Et~4~N)~2~[Hg~2~Br~6~]","Acta Crystallographica Section E","2002","58","10","m529","m530","10.1107/S1600536802015337","","","0.71073","MoKα","","0.0827","0.0341","","","0.0587","0.0674","","","","","","0.812","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201295","7.4925","0.0005","7.4925","0.0005","23.989","0.003","90","","90","","120","","1166.26","0.18","173","2","173","2","","","","","","","","5","P 31 2 1","P 31 2""","152","2046","","","- C4 H10 Li N O5 -","- C4 H10 Li N O5 -","- C24 H60 Li6 N6 O30 -","6","1","BT6184","Henderson, Wesley A.; Brooks, Neil R.; Smyrl, William H.","Polymeric [Li(NO~3~)(monoglyme)]~<i>n~</i>","Acta Crystallographica Section E","2002","58","9","m500","m501","10.1107/S160053680201499X","","","0.71073","MoKα","","0.029","0.0247","","","0.0587","0.0603","","","","","","1.063","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2201296","10.0888","0.0011","10.0888","0.0011","16.094","0.002","90","","90","","90","","1638.1","0.3","293","2","293","2","","","","","","","","5","P 42/m","-P 4c","84","Bis(tetraethylammonium) octabromotrimercurate(II)","","","- C16 H40 Br8 Hg3 N2 -","- C16 H40 Br8 Hg3 N2 -","- C32 H80 Br16 Hg6 N4 -","2","0.25","BT6185","Nockemann, Peter; Meyer, Gerd","Bis(tetraethylammonium) octabromotrimercurate(II), (Et~4~N)~2~[Hg~3~Br~8~]","Acta Crystallographica Section E","2002","58","10","m531","m533","10.1107/S1600536802015301","","","0.71073","MoKα","","0.0592","0.0345","","","0.0808","0.0877","","","","","","0.908","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2201297","9.818","0.002","11.935","0.002","19.514","0.004","90","","98.42","0.03","90","","2262","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","bis(enneaaqualanthanum) vanadium octacosaoxide octahydrate","","- H52 La2 O54 V10 -","- H52 La2 O54 V10 -","- H104 La4 O108 V20 -","2","0.5","BT6186","Peng, Xu-Hong; Li, Yi-Zhi; Cai, Li-Xiang; Wang, Liu-Fang; Wu, Ji-Gui","A novel polyoxometalate supramolecular compound: [La(H~2~O)~9~]~2~[V~10~O~28~]·8H~2~O","Acta Crystallographica Section E","2002","58","12","i111","i113","10.1107/S1600536802019700","","","0.71073","MoKα","","0.0442","0.0393","","","0.1218","0.1236","","","","","","1.073","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201298","16.3606","0.0009","16.3606","0.0009","16.3606","0.0009","90","","90","","90","","4379.2","0.4","293","2","293","2","","","","","","","","4","P n -3 n :2","-P 4a 2bc 3","222","Poly[diaqua(μ~4~-squarato-O,O',O'',O''')iron(II)]","","","- C4 H4 Fe O6 -","- C4 H4 Fe O6 -","- C96 H96 Fe24 O144 -","24","0.5","BT6187","Näther, Christian; Greve, Jan; Jeß, Inke","Poly[diaqua(μ~4~-squarato-<i>O</i>,<i>O</i>',<i>O</i>'',<i>O</i>''')iron(II)]","Acta Crystallographica Section E","2002","58","10","m507","m509","10.1107/S1600536802015647","","","0.71073","MoKα","","0.0449","0.0399","","","0.172","0.1776","","","","","","1.184","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201299","8.3409","0.0015","10.5043","0.0018","11.039","0.002","105.537","0.014","96.467","0.015","109.182","0.014","858.4","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H40 Cl10 Hg4 N2 -","- C16 H40 Cl10 Hg4 N2 -","- C16 H40 Cl10 Hg4 N2 -","1","0.5","BT6188","Nockemann, Peter; Meyer, Gerd","Bis(tetraethylammonium) decachloro- tetramercurate(II), (Et~4~N)~2~[Hg~4~Cl~10~]","Acta Crystallographica Section E","2002","58","10","m534","m536","10.1107/S1600536802016094","","","0.71073","MoKα","","0.0706","0.0367","","","0.0723","0.0804","","","","","","0.822","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201300","19.006","0.002","3.9728","0.0003","12.5126","0.0014","90","","107.993","0.004","90","","898.58","0.16","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Cadmium methylxanthate","","","- C4 H6 Cd O2 S4 -","- C4 H6 Cd O2 S4 -","- C16 H24 Cd4 O8 S16 -","4","0.5","BT6189","Young Jr, Victor G.; Tiekink, Edward R. T.","Bis(<i>O</i>-methyldithiocarbonato)cadmium(II)","Acta Crystallographica Section E","2002","58","10","m537","m539","10.1107/S1600536802015945","","","0.56357","synchrotron","","0.03","0.03","","","0.073","0.073","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201301","11.164","0.003","7.662","0.003","13.063","0.004","90","","101.84","0.03","90","","1093.6","0.6","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 O2 -","- C14 H14 O2 -","- C56 H56 O8 -","4","1","BT6190","Jones, Peter G.; Noble, Karl-Ludwig; Bubenitschek, Peter; Hopf, Henning","<i>trans</i>-[8]Paracyclophan-4-ene-3,6-dione","Acta Crystallographica Section E","2002","58","10","o1068","o1069","10.1107/S1600536802015957","","","0.71073","MoKα","","0.0663","0.0376","","","0.0803","0.0877","","","","","","0.886","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201302","16.5527","0.0008","16.5527","0.0008","16.5527","0.0008","90","","90","","90","","4535.3","0.4","293","2","293","2","","","","","","","","4","P n -3 n :2","-P 4a 2bc 3","222","Poly[[diaqua(μ~4~-squarato-O,O',O'',O''')manganese(II)] 0.93-hydrate]","Poly[[diaqua(μ~4~-squarato-O,O',O'',O''')manganese(II)] 0.93-hydrate]","","- C4 H5.86 Mn O6.93 -","- C4 H4 Mn O6.93 -","- C96 H96 Mn24 O166.32 -","24","0.5","BT6191","Greve, Jan; Näther, Christian","Poly[[diaqua(μ~4~-squarato-<i>O</i>,<i>O</i>',<i>O</i>'',<i>O</i>''')manganese(II)] 0.93-hydrate]","Acta Crystallographica Section E","2002","58","11","m625","m627","10.1107/S1600536802018329","","","0.71073","MoKα","","0.0396","0.037","","","0.1109","0.1125","","","","","","1.179","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201303","13.088","0.003","27.188","0.005","17.525","0.004","90","","102.25","0.03","90","","6094","2","200","2","199","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Di(aqua)dihydroxohexakis(tri-tert-butoxysilanethiolato)octalithium(I) - toluene (1/2)","","- C86 H184 Li8 O22 S6 Si6 -","- C86 H184 Li8 O22 S6 Si6 -","- C172 H368 Li16 O44 S12 Si12 -","2","0.5","BT6192","Katarzyna Baranowska; .; Jaroslaw Chojnacki; .; Wieslaw Wojnowski; .; Ingo Krossing; .","Diaquadihydroxohexakis(tri-<i>tert</i>-butoxysilanethiolato)octalithium(I)‒toluene (1/2)","Acta Crystallographica Section E","2002","58","10","m569","m570","10.1107/S1600536802016987","","","0.71073","MoKα","","0.0426","0.0362","","","0.1011","0.1051","","","","","","1.041","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201304","9.3854","0.0012","31.179","0.005","12.7972","0.0018","90","","91.084","0.016","90","","3744.1","0.9","220","1","220","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Tris(2,2'-bipyridine)copper(II) tricyanomethanide","","- C44 H24 Cu N12 -","- C44 H24 Cu N12 -","- C176 H96 Cu4 N48 -","4","1","BT6193","Potočňák, Ivan; Pohlová, Martina; Wagner, Christoph; Jäger, Lothar","Tris(1,10-phenanthroline)copper(II) tricyanomethanide","Acta Crystallographica Section E","2002","58","10","m595","m596","10.1107/S1600536802017610","","","0.71073","MoKα","","0.074","0.0439","","","0.1236","0.1524","","","","","","0.821","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201305","8.593","0.001","18.181","0.001","12.649","0.001","90","","111.38","0.01","90","","1840.2","0.3","296","1","296","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,1,6,6-tetraphenylhexa-2,4-diyne-1,6-diol‒4-methoxybenzaldehyde (1/2)","","- C46 H38 O6 -","- C46 H38 O6 -","- C92 H76 O12 -","2","0.5","BT6194","Cheng Wang; Ningbo Gong; Yang Lu","A host‒guest 1:2 inclusion compound of 1,1,6,6-tetraphenylhexa-2,4-diyne-1,6-diol and 4-methoxybenzaldehyde","Acta Crystallographica Section E","2002","58","12","o1339","o1340","10.1107/S1600536802019670","","","0.71073","MoKα","","","0.058","","","","0.124","","","","","","1.463","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201306","8.4111","0.0017","10.486","0.002","11.774","0.002","106.59","0.03","96.05","0.03","99.38","0.03","969.2","0.4","150","","150","","","","","","","","","6","P -1","-P 1","2","","Bis(μ-N-n-propyl-N-trimethylsilylbenzamidinato)bis[(diethyl ether-O)lithium]","","- C34 H62 Li2 N4 O2 Si2 -","- C34 H62 Li2 N4 O2 Si2 -","- C34 H62 Li2 N4 O2 Si2 -","1","0.5","BT6195","Boyd, Catherine L.; Tyrrell, Ben R.; Mountford, Philip","Bis(μ-<i>N</i>-<i>n</i>-propyl-<i>N</i>-trimethylsilylbenzamidinato)bis[(diethyl ether-<i>O</i>)lithium]","Acta Crystallographica Section E","2002","58","10","m597","m598","10.1107/S1600536802017579","","","0.71073","MoKα","","","0.0463","","","","0.0424","","","","","","1.0541","","","","has coordinates","211332","2020-10-21","18:00:00",""
"2201307","8.6401","0.0004","9.3228","0.0005","11.8281","0.0007","90","","90","","90","","952.75","0.09","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Ethylenediammonium tetrathiotungstate","","","- C2 H10 N2 S4 W -","- C2 H10 N2 S4 W -","- C8 H40 N8 S16 W4 -","4","1","BT6196","Srinivasan, Bikshandarkoil R.; Dhuri, Sunder N.; Näther, Christian; Bensch, Wolfgang","Ethylenediammonium tetrathiotungstate(VI)","Acta Crystallographica Section E","2002","58","11","m622","m624","10.1107/S1600536802017841","","","0.71073","MoKα","","0.0255","0.023","","","0.0531","0.054","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201308","18.728","0.002","17.031","0.0016","7.758","0.003","90","","90","","90","","2474.5","1","296","","296","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-Propyl mesityl sulfone","","- C12 H18 O2 S -","- C12 H18 O2 S -","- C96 H144 O16 S8 -","8","1","BT6197","Meyers, Cal Y.; Roper, William; Klavetter, Floyd; Horii, T.; Sandrock, Paul B.; Robinson, Paul D.","2-Propyl mesityl sulfone","Acta Crystallographica Section E","2002","58","10","o1166","o1168","10.1107/S1600536802017580","","","0.71069","MoKα","","0.078","0.036","","","0.102","0.12","","","","","","1.018","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201309","7.938","0.002","9.5038","0.0014","9.906","0.003","100.765","0.013","102.87","0.02","107.855","0.01","666.7","0.3","120","2","120","2","","","","","","","","4","P 1","P 1","1","","(+)-(R,E)-2-Ethylidene-4-ferrocenylcyclopentanone","","- C17 H18 Fe O -","- C17 H18 Fe O -","- C34 H36 Fe2 O2 -","2","2","BT6198","Van der Maelen Uría, Juan Francisco; García-Granda, Santiago; López, Salomé","(+)-(<i>R,E</i>)-2-Ethylidene-4-ferrocenylcyclopentanone","Acta Crystallographica Section E","2002","58","11","m613","m615","10.1107/S160053680201783X","","","1.54178","CuKα","","0.1235","0.1108","","","0.2812","0.3005","","","","","","1.17","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201310","11.35","0.002","15.5152","0.0015","13.084","0.002","90","","104.677","0.014","90","","2228.9","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","10-[2-(4-Hydroxyphenyl)ethyl]-3,3,6,6,9-pentamethyl-3,4,6,7,9,10-hexahydro- acridine-1,8(2H,5H)-dione","","- C26 H33 N O3 -","- C26 H33 N O3 -","- C104 H132 N4 O12 -","4","1","BT6199","P. R. Seshadri; D. Velmurugan; T. Josephrajan; V. T. Ramakrishnan; M. J. Kim","10-[2-(4-Hydroxyphenyl)ethyl]-3,3,6,6,9-pentamethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2<i>H</i>,5<i>H</i>)-dione","Acta Crystallographica Section E","2002","58","12","o1330","o1332","10.1107/S160053680201958X","","","0.71073","MoKα","","0.116","0.0593","","","0.152","0.1802","","","","","","1.007","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201311","9.6277","0.0013","17.017","0.002","16.755","0.002","90","","104.172","0.011","90","","2661.5","0.6","180","2","180","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-Bis[ethane-1,2-diylbis(diphenylphosphane)-κ2P,P']bis(thiocyanato- κN)molybdenum(II) toluene solvate","","- C61 H56 Mo N2 P4 S2 -","- C61 H56 Mo N2 P4 S2 -","- C122 H112 Mo2 N4 P8 S4 -","2","0.5","BT6200","Philippopoulos, Athanassios I.; Ziemer, Burkhard; Filippou, Alexander C.","<i>trans</i>-Bis[ethane-1,2-diylbis(diphenylphosphane)-κ2<i>P,P</i>']bis(thiocyanato-κ<i>N</i>)molybdenum(II) toluene solvate","Acta Crystallographica Section E","2002","58","12","m705","m706","10.1107/S1600536802020123","","","0.71073","MoKα","","0.061","0.0402","","","0.087","0.1006","","","","","","1.085","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201312","8.0237","0.0014","10.2293","0.0014","38.636","0.006","90","","90","","90","","3171.1","0.9","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-(2',3',4',6'-Tetra-O-acetyl-β-D-glucopyranosylthio)-4-pyridin-4-yl- 6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile","","- C30 H33 N3 O9 S -","- C30 H33 N3 O9 S -","- C120 H132 N12 O36 S4 -","4","1","BT6201","Elgemeie, Galal H.; Hussein, Mona M.; Jones, Peter G.","2-(2',3',4',6'-Tetra-<i>O</i>-acetyl-β-<small>D</small>-glucopyranosylthio)-4-pyridin-4-yl-6,7,8,9-tetrahydro-5<i>H</i>-cyclohepta[<i>b</i>]pyridine-3-carbonitrile","Acta Crystallographica Section E","2002","58","11","o1244","o1246","10.1107/S160053680201872X","","","0.71073","MoKα","","0.0636","0.0446","","","0.1046","0.111","","","","","","0.957","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201313","7.006","0.003","8.702","0.003","19.115","0.004","90","","99.36","0.03","90","","1149.9","0.7","143","2","143","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-Phenyl-7,8-dihydro-6H-cyclopenta[e]pyrazolo[1,5-a]pyrimidine","","- C15 H13 N3 -","- C15 H13 N3 -","- C60 H52 N12 -","4","1","BT6202","Elgemeie, Galal H.; Ali, Hani A.; Jones, Peter G.","2-Phenyl-7,8-dihydro-6<i>H</i>-cyclopenta[<i>e</i>]pyrazolo[1,5-<i>a</i>]pyrimidine","Acta Crystallographica Section E","2002","58","11","o1247","o1249","10.1107/S1600536802018780","","","0.71073","MoKα","","0.078","0.0535","","","0.1278","0.1459","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201314","11.3275","0.0012","12.0995","0.001","11.8282","0.001","90","","92.377","0.009","90","","1619.7","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-(3-Cyano-2-oxo-5,6,7,8-tetrahydroquinoline-1(2H)-yl)- 4-methylbenzenesulfonamide","","- C17 H17 N3 O3 S -","- C17 H17 N3 O3 S -","- C68 H68 N12 O12 S4 -","4","1","BT6203","Elgemeie, Galal H.; Jones, Peter G.","<i>N</i>-[3-Cyano-2-oxo-5,6,7,8-tetrahydroquinoline-1(2<i>H</i>)-yl]-4-methylbenzenesulfonamide","Acta Crystallographica Section E","2002","58","11","o1250","o1252","10.1107/S1600536802018731","","","0.71073","MoKα","","0.049","0.0343","","","0.0845","0.0889","","","","","","1.005","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201315","3.7376","0.0006","11.0011","0.0018","5.7184","0.0009","90","","96.778","0.019","90","","233.48","0.07","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Pyrazine dioxide","Pyrazine N,N'-dioxide","","- C4 H4 N2 O2 -","- C4 H4 N2 O2 -","- C8 H8 N4 O4 -","2","0.5","BT6204","Näther, Christian; Kowallik, Petra; Jeß, Inke","Pyrazine <i>N,N</i>'-dioxide","Acta Crystallographica Section E","2002","58","11","o1253","o1254","10.1107/S1600536802018883","","","0.71073","MoKα","","0.0501","0.0394","","","0.0999","0.1058","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201316","16.1467","0.0008","16.1467","0.0008","16.1467","0.0008","90","","90","","90","","4209.7","0.4","293","2","293","2","","","","","","","","4","P n -3 n :2","-P 4a 2bc 3","222","Poly[[diaqua(μ~4~-squarato-O,O',O'',O''')nickel(II)] 0.71-hydrate]","Poly[[diaqua(μ~4~-squarato-O,O',O'',O''')nickel(II)] 0.71-hydrate]","","- C4 H4 Ni O6.71 -","- C4 H4 Ni O6.708 -","- C96 H96 Ni24 O160.992 -","24","0.5","BT6205","Greve, Jan; Näther, Christian","Poly[[diaqua(μ~4~-squarato-<i>O,O</i>',<i>O</i>'',<i>O</i>''')nickel(II)] 0.71-hydrate]","Acta Crystallographica Section E","2002","58","11","m653","m655","10.1107/S1600536802018895","","","0.71073","MoKα","","0.0387","0.0244","","","0.0692","0.0766","","","","","","1.072","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201317","4.9089","0.0013","10.0072","0.0015","6.8535","0.0015","90","","91.11","0.03","90","","336.61","0.13","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","sodium selenite","","","- Na2 O3 Se -","- Na2 O3 Se -","- Na8 O12 Se4 -","4","1","","Wickleder, Mathias S.","Sodium selenite, Na~2~SeO~3~","Acta Crystallographica, Section E","2002","58","","i103","i104","10.1107/S1600536802019384","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2201318","11.7423","0.0016","11.905","0.0014","12.2458","0.0014","90","","91.816","0.012","90","","1711","0.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-(3-Cyano-2-oxo-2,5,6,7,8,9-hexahydro-1H-cyclohepta[b]pyridin-1- yl)-4-methylbenzenesulfonamide","","- C18 H19 N3 O3 S -","- C18 H19 N3 O3 S -","- C72 H76 N12 O12 S4 -","4","1","BT6207","Elgemeie, Galal H.; Mahmoud, Mahmoud A.; Jones, Peter G.","<i>N</i>-(3-Cyano-2-oxo-2,5,6,7,8,9-hexahydro-1<i>H</i>-cyclohepta[<i>b</i>]pyridin-1-yl)-4-methylbenzenesulfonamide","Acta Crystallographica Section E","2002","58","11","o1293","o1295","10.1107/S1600536802019177","","","0.71073","MoKα","","0.0541","0.0369","","","0.0918","0.0972","","","","","","1.024","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201319","17.633","0.004","8.8791","0.0018","19.831","0.004","90","","96.12","0.03","90","","3087.1","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Pentacyanoiron-m-cyano-triaquatetrakis(dimethylformamide)europium hydrate","","- C18 H36 Eu Fe N10 O8 -","- C18 H28 Eu Fe N10 O8 -","- C72 H112 Eu4 Fe4 N40 O32 -","4","1","BT6208","Jian-Rong Li; Li-Zhen Cai; Ru-Qiang Zou; Guo-Wei Zhou; Guo-Cong Guo; Xian-He Bu; Jin-Shun Huang","Pentacyanoferrate(III)-μ-cyano-triaquatetrakis(dimethylformamide)europium(III) hydrate","Acta Crystallographica Section E","2002","58","12","m686","m687","10.1107/S1600536802019578","","","0.71073","MoKα","","0.0435","0.0331","","","0.0875","0.0951","","","","","","1.012","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201320","7.4707","0.0003","16.3734","0.0007","7.2188","0.0003","90","","90","","90","","883.01","0.06","133","2","133","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Methyl 2-selenocyanatobenzoate","","- C9 H7 N O2 Se -","- C9 H7 N O2 Se -","- C36 H28 N4 O8 Se4 -","4","1","BT6209","Jones, Peter G.; Wismach, Cathleen; Mugesh, Govindasamy; du Mont, Wolf-Walther","Methyl 2-selenocyanatobenzoate","Acta Crystallographica Section E","2002","58","11","o1298","o1300","10.1107/S1600536802019323","","","0.71073","MoKα","","0.019","0.0177","","","0.0444","0.0448","","","","","","1.013","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201321","6.3586","0.0012","7.0047","0.001","13.529","0.002","88.463","0.011","77.165","0.008","68.056","0.009","543.91","0.16","180","2","180","2","","","","","","","","5","P -1","-P 1","2","CUmof-4","catena-poly[[[tetraaquacobalt(II)]-μ-1,2-bis(4-pyridyl)ethane-κ^2^N:N] 2,6-naphthalenedicarboxylate]","","- C24 H26 Co N2 O8 -","- C24 H26 Co N2 O8 -","- C24 H26 Co N2 O8 -","1","0.5","BT6210","Almeida Paz, Filipe A.; Bond, Andrew D.; Khimyak, Yaroslav Z.; Klinowski, Jacek","A one-dimensional Co^II^ coordination polymer exhibiting an unusual conformation for 1,2-bis(4-pyridyl)ethane","Acta Crystallographica Section E","2002","58","12","m691","m693","10.1107/S1600536802019888","","","0.7107","MoKα","","0.0551","0.042","","","0.0995","0.109","","","","","","1.196","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201322","8.8009","0.0006","8.7664","0.0006","19.084","0.0014","90","","100.262","0.003","90","","1448.82","0.18","133","2","133","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","trans-Diaquabis(2-pyridylethanol-N,O)nickel(II) disaccharinate","","- C28 H30 N4 Ni O10 S2 -","- C28 H30 N4 Ni O10 S2 -","- C56 H60 N8 Ni2 O20 S4 -","2","0.5","BT6211","Hamamci, Sevim; Yilmaz, Veysel T.; Thöne, Carsten","<i>trans</i>-Diaquabis(2-pyridylethanol-<i>N,O</i>)nickel(II) disaccharinate","Acta Crystallographica Section E","2002","58","12","m700","m701","10.1107/S160053680202007X","","","0.71073","MoKα","","0.0396","0.0322","","","0.0927","0.0961","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201323","8.8391","0.0006","8.791","0.0006","19.1564","0.0012","90","","100.876","0.003","90","","1461.8","0.17","133","2","133","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","trans-Diaquabis(2-pyridylethanol-N,O)cobalt(II) disaccharinate","","- C28 H30 Co N4 O10 S2 -","- C28 H30 Co N4 O10 S2 -","- C56 H60 Co2 N8 O20 S4 -","2","0.5","BT6212","Yilmaz, Veysel T.; Hamamci, Sevim; Thöne, Carsten","<i>trans</i>-Diaquabis(2-pyridylethanol-<i>N,O</i>)cobalt(II) disaccharinate","Acta Crystallographica Section E","2002","58","12","m702","m704","10.1107/S1600536802020081","","","0.71073","MoKα","","0.0297","0.0259","","","0.0717","0.0741","","","","","","1.043","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201324","13.602","0.002","10.1781","0.0017","23.565","0.004","90","","106.267","0.003","90","","3131.8","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ethyl 5-bromo-3-phenyl indole-2-carbamate","","- C17 H15 Br N2 O2 -","- C17 H15 Br N2 O2 -","- C136 H120 Br8 N16 O16 -","8","2","CF6180","Mruthyunjayaswamy, B. H. M.; Ijare, Omkar B.; Jadegoud, Y; Ray Chaudhuri, A.; Guru Row, T. N.","Ethyl <i>N</i>-(5-bromo-3-phenylindol-2-yl)carbamate","Acta Crystallographica Section E","2002","58","7","o738","o739","10.1107/S1600536802010176","","","0.71073","MoKα","","0.0711","0.0367","","","0.078","0.0841","","","","","","0.871","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201325","17.132","0.003","13.918","0.003","9.793","0.002","90","","102.87","0.03","90","","2276.4","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Terpy Copper(II) Salicylaldimine","","","- C28 H20 Cu N4 O2 -","- C28 H20 Cu N4 O2 -","- C112 H80 Cu4 N16 O8 -","4","0.5","CF6181","D. Scott Bohle; Daniel Stasko","[<i>N</i>-(2-Oxidophenyl)salicylaldiminato-κ^3^<i>N</i>,<i>O</i>,<i>O</i>'](2,2':6',2''-terpyridine-κ^3^<i>N</i>)copper(II)","Acta Crystallographica Section E","2002","58","7","m340","m341","10.1107/S1600536802010188","","","0.71073","MoKα","","0.08","0.0447","","","0.092","0.105","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201326","9.255","0.001","15.852","0.003","7.192","0.001","97.46","0.01","107.12","0.01","102.03","0.01","965.4","0.3","296.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H18 Co N2 O9 -","- C20 H18 Co N2 O9 -","- C40 H36 Co2 N4 O18 -","2","1","CF6182","Okabe, Nobuo; Muranishi, Yasunori","Bis(8-hydroxyquinoline-2-carboxylato-κ^3^<i>N,O,O</i>')cobalt(II) trihydrate","Acta Crystallographica Section E","2002","58","7","m352","m353","10.1107/S1600536802010814","","","0.7107","MoKα","","","0.0432","","","","0.1617","","","","","","0.853","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201327","11.8682","0.0002","11.8465","0.0003","22.1205","0.0004","90","","103.374","0.002","90","","3025.73","0.11","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Tris(1-lithio-4,7-dimethyl-1,4,7-triazacyclononane)","","- C24 H54 Li3 N9 -","- C24 H54 Li3 N9 -","- C96 H216 Li12 N36 -","4","1","CF6183","Dubberley, Stuart R.; Mountford, Philip; Adams, Nico","Tris(1-lithio-4,7-dimethyl-1,4,7-triazacyclononane)","Acta Crystallographica Section E","2002","58","7","m342","m343","10.1107/S160053680201019X","","","0.71073","MoKα","","","0.0577","","","","0.0711","","","","","","1.0324","","","","has coordinates","211332","2020-10-21","18:00:00",""
"2201328","5.9554","0.0002","6.9671","0.0003","31.8248","0.0013","90","","96.856","0.0017","90","","1311.03","0.09","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(Benzotriazol-1-yl)-p-nitropropiophenone","","- C15 H12 N4 O3 -","- C15 H12 N4 O3 -","- C60 H48 N16 O12 -","4","1","CF6184","Low, John Nicolson; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo; Cuervo, Paola Andrea; Abonia, Rodrigo","3-(Benzotriazol-1-yl)-<i>p</i>-nitropropiophenone: sheets built from weak three-centred C—H···O hydrogen bonds","Acta Crystallographica Section E","2002","58","7","o769","o771","10.1107/S1600536802010851","","","0.71073","MoKα","","0.1018","0.0578","","","0.1341","0.155","","","","","","0.998","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201329","10.868","0.002","5.742","0.001","17.19","0.002","90","","91.31","0.01","90","","1072.4","0.3","150","2","150","2","","","","","","","","3","P 1 21 1","P 2yb","4","(Trimethylsilyl)acetylene","","","- C5 H10 Si -","- C5 H10 Si -","- C30 H60 Si6 -","6","3","CF6185","Bond, Andrew D.; Davies, John E.","(Trimethylsilyl)acetylene","Acta Crystallographica Section E","2002","58","7","o777","o778","10.1107/S1600536802010875","","","0.7107","MoKα","","0.1091","0.0961","","","0.2587","0.2726","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201330","12.983","0.004","11.231","0.003","14.151","0.004","90","","101.76","0.02","90","","2020.1","1","296.2","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C14 H19 Ce N2 O14 -","- C14 H19 Ce N2 O14 -","- C56 H76 Ce4 N8 O56 -","4","1","CF6187","Okabe, Nobuo; Hasuyo Kyoyama; Ayumi Fujimoto","A polymeric cerium(III) complex of dipicolinic acid","Acta Crystallographica Section E","2002","58","7","m354","m356","10.1107/S1600536802010826","","","0.7107","MoKα","","","0.0547","","","","0.243","","","","","","1.458","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201331","11.3201","0.0018","14.422","0.002","17.073","0.003","90","","90","","90","","2787.3","0.8","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","bis(2-pyridylmethyl)ammonium perchlorate","","- C12 H14 Cl N3 O4 -","- C12 H14 Cl N3 O4 -","- C96 H112 Cl8 N24 O32 -","8","1","CF6188","Ray J. Butcher; Yilma Gultneh; A. Raza Khan","Bis(2-pyridylmethyl)ammonium perchlorate","Acta Crystallographica Section E","2002","58","8","o858","o859","10.1107/S1600536802012527","","","0.71073","MoKα","","0.0871","0.0554","","","0.1358","0.1559","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201332","10.883","0.002","9.44","0.002","11.21","0.002","90","","111.07","0.01","90","","1074.7","0.4","298","1","298","1","","","","","","","","4","P 1 21 1","P 2yb","4","","1-Benzyl-4,5-diphenyl-3-vinylimidazolium bromide","","- C24 H21 Br N2 -","- C24 H21 Br N2 -","- C48 H42 Br2 N4 -","2","1","CF6189","Robert T. Stibrany; Joseph A. Potenza; Harvey J. Schugar","1-Benzyl-4,5-diphenyl-3-vinylimidazolium bromide","Acta Crystallographica Section E","2002","58","8","o848","o850","10.1107/S1600536802012291","","","0.71073","MoKα","","0.0547","0.0426","","","0.1023","0.1055","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201333","3.73","0.004","7.486","0.004","11.019","0.005","90","","94.34","0.07","90","","306.8","0.4","172","2","172","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","3,5-Difluorobenzonitrile","","- C7 H3 F2 N -","- C7 H3 F2 N -","- C14 H6 F4 N2 -","2","0.5","CF6190","Britton, Doyle","3,5-Difluorobenzonitrile","Acta Crystallographica Section E","2002","58","8","o840","o841","10.1107/S1600536802012072","","","0.71073","MoKα","","0.049","0.041","","","0.111","0.12","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201334","12.4661","0.0002","14.124","0.0002","14.8507","0.0001","74.787","0.001","76.232","0.001","80.688","0.001","2436.84","0.06","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C28 H47 Mo3 N2 O9 P3 S10 -","- C28 H47 Mo3 N2 O9 P3 S10 -","- C56 H94 Mo6 N4 O18 P6 S20 -","2","1","CF6191","Yao Kang; Zhao-Ji Li; Ye-Yan Qin; Yu-Biao Chen; Rui-feng Hu; Yi-Hang Wen; Jian-Kai Cheng; Yuan-Gen Yao","A trinuclear molybdenum cluster coordinated by <i>N</i>-phenylanthranilate","Acta Crystallographica Section E","2002","58","8","m420","m422","10.1107/S1600536802012060","","","0.71073","MoKα","","0.0843","0.0576","","","0.1379","0.1628","","","","","","1.18","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201335","16.266","0.003","5.1024","0.0011","10.095","0.002","90","","90.73","0.01","90","","837.8","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","m-methoxyphenyl acetic acid","(3-methoxyphenyl) acetic acid","","- C9 H10 O3 -","- C9 H10 O3 -","- C36 H40 O12 -","4","1","CF6192","Choudhury, A. R; Guru Row, T. N.","(3-Methoxyphenyl)acetic acid","Acta Crystallographica Section E","2002","58","8","o889","o890","10.1107/S1600536802012102","","","0.71073","MoKα","","0.0512","0.0397","","","0.1103","0.117","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201336","8.6838","0.0015","9.713","0.002","11.566","0.003","80.62","0.02","81.09","0.02","88.82","0.02","950.9","0.4","178","2","178","2","","","","","","","","3","P -1","-P 1","2","","","","- C24 H30 Fe -","- C24 H30 Fe -","- C48 H60 Fe2 -","2","1","CF6193","Jones, Peter G.; Hopf, Henning; Hartig, Thorsten","(η^5^-Pentamethylcyclopentadienyl)(η^5^-5,6,7-trihydro-4,8-dimethyl-<i>s</i>-indacenyl)iron(II)","Acta Crystallographica Section E","2002","58","8","m412","m413","10.1107/S1600536802012084","","","0.71073","MoKα","","0.046","0.0383","","","0.0981","0.1026","","","","","","1.078","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201337","8.651","0.002","9.949","0.002","11.575","0.003","82.82","0.02","82.09","0.02","88.88","0.02","979","0.4","183","2","183","2","","","","","","","","3","P -1","-P 1","2","","","","- C24 H30 Ru -","- C24 H30 Ru -","- C48 H60 Ru2 -","2","1","CF6194","Jones, Peter G.; Hopf, Henning; Hartig, Thorsten","(η^5^-Pentamethylcyclopentadienyl)(η^5^-5,6,7-trihydro-4,8-dimethyl-<i>s</i>-indacenyl)ruthenium(II)","Acta Crystallographica Section E","2002","58","8","m414","m415","10.1107/S1600536802012096","","","0.71073","MoKα","","0.0347","0.0309","","","0.0775","0.0803","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201338","7.45","0.001","17.01","0.003","9.038","0.002","90","","114.32","0.03","90","","1043.7","0.4","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","(+)-Escholinine perchlorate","","","- C21 H26 Cl N O8 -","- C21 H26 Cl N O8 -","- C42 H52 Cl2 N2 O16 -","2","1","CF6195","Nečas, Marek; Dostál, Jiří; Slavík, Jiří","(+)-Escholinine perchlorate","Acta Crystallographica Section E","2002","58","9","o1023","o1024","10.1107/S160053680201512X","","","0.71073","MoKα","","0.0303","0.0282","","","0.0658","0.0667","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201339","5.8063","0.001","10.9254","0.0017","15.288","0.002","74.79","0.003","97.463","0.003","94.731","0.004","926.7","0.2","297","2","297","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H16 F3 N3 O2 S -","- C19 H16 F3 N3 O2 S -","- C38 H32 F6 N6 O4 S2 -","2","1","CF6196","Ming Yu; Jin-Ling Wang; Fang-Ming Miao","1,5-Dimethyl-4-{[(<i>E</i>)-3-oxo-3-(2-thienyl)-1-(trifluoromethyl)-1-propenyl]amino}-2-phenyl-1,2-dihydro-3<i>H</i>-pyrazol-3-one","Acta Crystallographica Section E","2002","58","11","o1182","o1184","10.1107/S1600536802017348","","","0.71073","MoKα","","0.0858","0.0565","","","0.1532","0.1725","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201340","9.2547","0.0004","16.2169","0.0008","12.2437","0.0007","90","","103.569","0.002","90","","1786.28","0.16","150","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,4-Bis(3,3-dimethyl-1-octylindolin-2-ylidenemethyl)cyclobutenediylio-1,3- diolate","","- C42 H56 N2 O2 -","- C42 H56 N2 O2 -","- C84 H112 N4 O4 -","2","0.5","CF6197","Lynch, Daniel E.","2,4-Bis(3,3-dimethyl-1-octylindolin-2-ylidenemethyl)cyclobutenediylio-1,3-diolate","Acta Crystallographica Section E","2002","58","9","o1025","o1027","10.1107/S1600536802015155","","","0.71073","MoKα","","0.1698","0.0696","","","0.1591","0.2076","","","","","","0.978","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201341","8.696","0.005","8.698","0.005","22.806","0.013","90","","90","","90","","1725","1.7","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H24 N4 -","- C20 H24 N4 -","- C80 H96 N16 -","4","1","CF6198","Jian-Feng Li; Lin-Hong Weng; Shu-Ping Huang; Hong-Bo Tong; Jian-Ping Guo; Dian-Sheng Liu","(1<i>R</i>,2<i>R</i>)-({-})-1,2-Dibenzamidino-cyclohexane","Acta Crystallographica Section E","2002","58","10","o1078","o1080","10.1107/S1600536802016045","","","0.71073","MoKα","","0.0705","0.0587","","","0.1142","0.119","","","","","","1.057","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201342","6.1886","0.0004","9.071","0.0006","24.5261","0.0015","90","","90","","90","","1376.82","0.15","150","1","150","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","4'-Hydroxyacetophenone","","- C8 H8 O2 -","- C8 H8 O2 -","- C64 H64 O16 -","8","2","CF6199","Kresge, A. Jerry; Lough, Alan J.; Zhu, Yu","A redetermination of 4'-hydroxyacetophenone","Acta Crystallographica Section E","2002","58","10","o1057","o1059","10.1107/S1600536802015581","","","0.71073","MoKα","","0.0388","0.0341","","","0.0837","0.0866","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201343","7.953","0.0004","8.4914","0.0006","10.885","0.0007","77.06","0.006","74.114","0.005","86.277","0.003","689.05","0.08","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","4-Methyl-2-(8-quinolyl)phthalazin-1-one","","- C18 H13 N3 O -","- C18 H13 N3 O -","- C36 H26 N6 O2 -","2","1","CF6200","Lynch, Daniel E.; Ian McClenaghan","4-Methyl-2-(8-quinolyl)phthalazin-1-one","Acta Crystallographica Section E","2002","58","10","o1051","o1052","10.1107/S1600536802015362","","","0.71073","MoKα","","0.1423","0.0557","","","0.1242","0.179","","","","","","0.969","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201344","8.769","0.001","20.073","0.004","11.928","0.002","90","","107.53","0.01","90","","2002.1","0.6","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Z)-4-(4-{4-[(Z)-1-Methyl-3-oxobut-1-enylamino]phenoxy}phenylamino)pent-3-en- 2-one","","- C22 H24 N2 O3 -","- C22 H24 N2 O3 -","- C88 H96 N8 O12 -","4","1","CF6201","Yanhua, Feng; Xianhong, Yin; Lin, Chen; Minyu, Tan; Kaibei, Yu","(<i>Z</i>)-4-(4-{4-[(<i>Z</i>)-1-Methyl-3-oxobut-1-enylamino]phenoxy}phenylamino)pent-3-en-2-one","Acta Crystallographica Section E","2002","58","10","o1154","o1156","10.1107/S1600536802017336","","","0.71073","MoKα","","0.0631","0.0383","","","0.0976","0.106","","","","","","0.982","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201345","24.758","0.004","24.758","0.004","4.6952","0.0009","90","","90","","90","","2878","0.9","150","2","150","2","","","","","","","","4","I -4","I -4","82","","2-phenylpyrrolo[2,3-h]quinoline dihydrate","","- C17 H16 N2 O2 -","- C17 H16 N2 O2 -","- C136 H128 N16 O16 -","8","1","CF6202","Daniel E. Lynch; Ian McClenaghan","2-Phenylpyrrolo[2,3-<i>h</i>]quinoline dihydrate","Acta Crystallographica Section E","2002","58","10","o1150","o1151","10.1107/S160053680201735X","","","0.71073","MoKα","","0.0955","0.0476","","","0.0811","0.0927","","","","","","1.049","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201346","6.2048","0.0009","10.398","0.0011","7.3089","0.001","90","","106.085","0.011","90","","453.09","0.11","173","2","173","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C4 H8 Cl3 Ga O -","- C4 H8 Cl3 Ga O -","- C8 H16 Cl6 Ga2 O2 -","2","0.5","CF6203","Scholz, Stefan; Lerner, Hans-Wolfram; Bolte, Michael","Trichloro(tetrahydrofuran)gallium(III)","Acta Crystallographica Section E","2002","58","10","m586","m587","10.1107/S1600536802016100","","","0.71073","MoKα","","0.0406","0.0352","","","0.0901","0.0933","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201347","24.106","0.002","20.763","0.002","11.8193","0.0007","90","","90","","90","","5915.7","0.8","294","","294","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C34 H36 B N O5 -","- C34 H36 B N O5 -","- C272 H288 B8 N8 O40 -","8","1","CF6204","Wolfgang Kliegel; Ute Schumacher; Brian O. Patrick; Steven J. Rettig; James Trotter","A diphenylboron chelate of an <i>N</i>-alkyl-2,2-diarylglycolohydroxamic acid","Acta Crystallographica Section E","2002","58","10","o1095","o1097","10.1107/S1600536802016124","","","0.71073","MoKα","","0.106","0.04","","0.038","","0.038","","","1.96","","","1.96","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201348","12.2304","0.0002","16.4299","0.0002","17.8325","0.0002","90","","93.999","0.001","90","","3574.61","0.08","183","2","183","2","","","","","","","","3","I 1 2/c 1","-I 2yc","15","","1-(2-Hydroxy-4,6-dimethoxy-3-methylphenyl)-3-(4-methoxyphenyl)- 2-methyl-1,3-propanedione","","- C20 H22 O6 -","- C20 H22 O6 -","- C160 H176 O48 -","8","1","CF6205","Stomberg, Rolf; Langer, Vratislav; Hauteville, Marcelle","1-(2-Hydroxy-4,6-dimethoxy-3-methylphenyl)-3-(4-methoxyphenyl)-2-methyl-1,3-propanedione","Acta Crystallographica Section E","2002","58","10","o1116","o1118","10.1107/S1600536802016136","","","0.71073","MoKα","","0.0799","0.049","","","0.1229","0.144","","","","","","0.993","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201349","14.136","0.004","14.244","0.004","22.383","0.008","77.92","0.02","78.49","0.02","60.26","0.02","3802","2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","2,6-dihexyloxy-9,10-bis(4,5-dimethyl-1,3-dithiolium)-anthracene bis-[2,4,7-trinitro-5-bromo-9-cyanofluorenide], 1,4-dioxane trisolvate","","- C76 H76 Br2 N8 O20 S4 -","- C76 H76 Br2 N8 O20 S4 -","- C152 H152 Br4 N16 O40 S8 -","2","1","CF6206","Batsanov, Andrei S.; Bryce, Martin R.; Lyubchik, Svetlana B.; Perepichka, Igor F.","An unexpected TTFAQ donor‒fluorene acceptor reaction resulting in a novel salt: 2,6-dihexyloxy-9,10-bis(4,5-dimethyl-1,3-dithiol-2-ylium)-anthracene bis(2,5,7-trinitro-4-bromo-9-cyanofluorenide) dioxane trisolvate","Acta Crystallographica Section E","2002","58","10","o1106","o1110","10.1107/S1600536802016239","","","0.71073","MoKα","","0.0807","0.0582","","","0.1622","0.1858","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201350","21.972","0.003","9.7717","0.0012","7.3036","0.0009","90","","105.562","0.002","90","","1510.6","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Hexaaqua zinc dihydrogen 1,2,4,5-benzenetetracarboxylate","","- C10 H16 O14 Zn -","- C10 H16 O14 Zn -","- C40 H64 O56 Zn4 -","4","0.5","CF6207","Yan-Qiong Sun; Jie Zhang; Guo-Yu Yang","Hexaaquazinc(II) dihydrogen-1,2,4,5-benzenetetracarboxylate","Acta Crystallographica Section E","2002","58","10","m548","m550","10.1107/S1600536802016240","","","0.71073","MoKα","","0.029","0.028","","","0.074","0.075","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201351","9.958","0.004","10.048","0.004","16.205","0.006","90.695","0.008","105.545","0.007","111.835","0.007","1438.7","1","273","2","273","2","","","","","","","","3","P -1","-P 1","2","","(E)-3,4',5-trimethoxystilbene","","- C17 H18 O3 -","- C17 H18 O3 -","- C68 H72 O12 -","4","2","CF6208","Yin, Qiang; Shi, Yun-Mei; Liu, Hui-Min; Li, Chun-Bao; Zhang, Wen-Qin","(<i>E</i>)-3,5,4'-Trimethoxystilbene","Acta Crystallographica Section E","2002","58","10","o1180","o1181","10.1107/S1600536802017646","","","0.71073","MoKα","","0.1407","0.0534","","","","0.1522","","","","","","0.961","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201352","11.651","0.005","10.835","0.005","11.029","0.005","90","","105.801","0.005","90","","1339.7","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1S(R),2S(R),3S(R),10S(R),12R(S),13R(S),14R(S),17S(R)-13-Bromo-11- oxapentacyclo[8.7.0.0^2,14^.0^4,9^.0^12,17^]heptadeca-4,6,8-trien-3-ol","","- C16 H17 Br O2 -","- C16 H17 Br O2 -","- C64 H68 Br4 O8 -","4","1","CF6209","Çoruh, Ufuk; García-Granda, Santiago; Menzek, Abdullah; Altundaş, Aliye; Akbulut, Nihat; Erdönmez, Ahmet","1<i>S</i>(<i>R</i>),2<i>S</i>(<i>R</i>),3<i>S</i>(<i>R</i>),10<i>S</i>(<i>R</i>),12<i>R</i>(<i>S</i>),13<i>R</i>(<i>S</i>),14<i>R</i>(<i>S</i>),17<i>S</i>(<i>R</i>)-13-Bromo-11-oxapentacyclo[8.7.0.0^2,14^.0^4,9^.0^12,17^]heptadeca-4,6,8-trien-3-ol","Acta Crystallographica Section E","2002","58","11","o1234","o1236","10.1107/S1600536802018160","","","1.5418","CuKα","","0.0479","0.0434","","","0.1131","0.1178","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201353","12.6087","0.0014","13.7214","0.0012","17.056","0.002","92.76","0.01","103.57","0.01","111.6","0.01","2637.3","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4,8,9,10-Tetraphenyl-1,3-diazaadamantan-6-one acetone solvate","","- C67 H62 N4 O3 -","- C67 H62 N4 O3 -","- C134 H124 N8 O6 -","2","1","CF6210","Subha Nandhini, M.; Krishnakumar, R. V.; Narasimhamurthy, T.; Vijayakumar, V.; Sundaravadivelu, M.; Natarajan, S.","4,8,9,10-Tetraphenyl-1,3-diazaadamantan-6-one acetone hemisolvate","Acta Crystallographica Section E","2002","58","11","o1210","o1212","10.1107/S1600536802017658","","","1.5418","CuKα","","0.0679","0.0511","","","0.1284","0.1472","","","","","","1.113","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201354","10.181","0.004","6.766","0.002","11.114","0.004","90","","100.02","0.01","90","","753.9","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-amino-5-propyl-1,3,4-thiadiazole","","- C5 H9 N3 S -","- C5 H9 N3 S -","- C20 H36 N12 S4 -","4","1","CF6211","Roy Choudhury, Angshuman; Mruthyunjayaswamy, B. H. M.; Ijare, Omkar B.; Jadegoud, Y; Guru Row, T. N.","2-Amino-5-propyl-1,3,4-thiadiazole","Acta Crystallographica Section E","2002","58","11","o1237","o1238","10.1107/S1600536802018147","","","0.71073","MoKα","","0.0872","0.0659","","","0.1745","0.1913","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201355","7.2803","0.0001","9.9479","0.0001","9.9572","0.0001","75.682","0.001","87.494","0.001","88.79","0.001","698.03","0.014","183","2","183","2","","","","","","","","5","P -1","-P 1","2","","1,6-hexamethylenediammonium tetrachlorocobaltate(II)","","- C6 H18 Cl4 Co N2 -","- C6 H18 Cl4 Co N2 -","- C12 H36 Cl8 Co2 N4 -","2","1","CF6212","Mahmoudkhani, Amir H.; Langer, Vratislav","The lamellar architecture of 1,6-hexamethylenediammonium tetrachlorocobaltate(II)","Acta Crystallographica Section E","2002","58","10","m592","m594","10.1107/S1600536802017464","","","0.71073","MoKα","","0.027","0.023","","","0.058","0.061","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201356","10.191","0.002","6.954","0.0014","20.544","0.004","90","","93.77","0.03","90","","1452.8","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(C4 H12 N5) [Tl Br4]","1,1-Dimethylbiguanidium Tetrabromide-thallium(III)","","- C4 H12 Br4 N5 Tl -","- C4 H12 Br4 N5 Tl -","- C16 H48 Br16 N20 Tl4 -","4","1","CF6213","He, Zhenliang; Zhu, Miaoli; Ma, Guibin","1,1-Dimethylbiguanidium tetrabromothallate(III)","Acta Crystallographica Section E","2002","58","11","m647","m649","10.1107/S1600536802017853","","","0.71073","MoKα","","0.083","0.0522","","","0.1039","0.1101","","","","","","1.008","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201357","12.31","0.001","22.089","0.002","10.965","0.001","90","","108.26","0.01","90","","2831.4","0.5","294","","294","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H35 B N O4 -","- C31 H35 B N O4 -","- C124 H140 B4 N4 O16 -","4","1","CF6214","Wolfgang Kliegel; Ute Schumacher; Brian O. Patrick; Steven J. Rettig; James Trotter","Diphenylboron chelate of an 3-hydroxy-<i>N</i>-(2-hydroxyalkyl)hydroxamic acid","Acta Crystallographica Section E","2002","58","11","o1215","o1217","10.1107/S1600536802018172","","","0.71073","MoKα","","0.158","0.051","","0.054","","0.054","","","1.96","","","1.96","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201358","15.334","0.002","10.604","0.002","12.465","0.002","90","","104.96","0.01","90","","1958.1","0.6","180","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H23 N Si2 -","- C19 H23 N Si2 -","- C76 H92 N4 Si8 -","4","1","CF6215","Kahn, Muhammed S.; Ahrens, Birte; Male, Louise; Raithby, Paul R.","5,8-Bis(trimethylsilylethynyl)quinoline","Acta Crystallographica Section E","2002","58","11","o1220","o1221","10.1107/S1600536802018184","","","0.71073","MoKα","","","0.0829","","","","0.2245","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201359","6.862","0.001","7.335","0.001","13.323","0.003","80.73","0.01","85.3","0.01","86.6","0.01","658.9","0.2","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","Methoxycarbonylmethyl 2-methoxycarbonyl-3-Hydroxybenzo[b]furan-6-carboxylate","","- C14 H12 O8 -","- C14 H12 O8 -","- C28 H24 O16 -","2","1","CF6216","Batsanov, Andrei S.; Perepichka, Dmitrii F.","Methoxycarbonylmethyl 3-hydroxy-2-(methoxycarbonyl)benzo[<i>b</i>]furan-6-carboxylate","Acta Crystallographica Section E","2002","58","11","o1227","o1228","10.1107/S1600536802018524","","","0.71073","MoKα","","0.1627","0.0662","","","0.1295","0.1708","","","","","","0.986","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201360","7.267","0.004","11.15","0.006","13.822","0.008","111.794","0.009","92.21","0.011","105.987","0.01","987.2","1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4-[(2-Hydroxyphenylamino)phenylmethylene]-5-methyl-2-phenyl-2H-pyrazol-3(4H)- one","","- C23 H19 N3 O2 -","- C23 H19 N3 O2 -","- C46 H38 N6 O4 -","2","1","CF6217","Jin-Ling Wang; Shu-Ming Zhang; Fang-Ming Miao","4-[(2-Hydroxyphenylamino)phenylmethylene]-5-methyl-2-phenyl-2<i>H</i>-pyrazol-3(4<i>H</i>)-one","Acta Crystallographica Section E","2002","58","12","o1365","o1366","10.1107/S1600536802020299","","","0.71073","MoKα","","0.0989","0.051","","","0.1179","0.1411","","","","","","0.975","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201361","10.031","0.001","10.165","0.001","18.991","0.0019","93.36","0.03","90.37","0.03","103.69","0.03","1877.8","0.4","293","","293","","","","","","","","","6","P -1","-P 1","2","","trans-Carbonylchlorobis(tribenzylphosphine)rhodium(I)","","- C43 H42 Cl O P2 Rh -","- C43 H42 Cl O P2 Rh -","- C86 H84 Cl2 O2 P4 Rh2 -","2","1","CF6218","Muller, Alfred; Roodt, Andreas; Otto, Stefanus; Oskarsson, Åke; Yong, Shen","<i>trans</i>-Carbonylchlorobis(tribenzylphosphine)rhodium(I)","Acta Crystallographica Section E","2002","58","12","m715","m717","10.1107/S1600536802019980","","","0.71073","MoKα","","0.1463","0.0477","","0.1218","0.0913","0.0913","","","","","","0.88","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2201362","20.7037","0.0012","8.687","0.0005","15.2487","0.0009","90","","95.643","0.001","90","","2729.2","0.3","110","2","110","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C26 H27 Au B N4 P S2 -","- C26 H27 Au B N4 P S2 -","- C104 H108 Au4 B4 N16 P4 S8 -","4","1","CF6221","Mohamed, Ahmed A.; Rabinovich, Daniel; Fackler, John P. Jr","[Bis(2-mercapto-1-methylimidazol-3-yl)borato](triphenylphosphine)gold(I)","Acta Crystallographica Section E","2002","58","12","m726","m727","10.1107/S1600536802020512","","","0.71073","MoKα","","0.0535","0.0409","","","0.1007","0.1098","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201363","10.8664","0.0008","9.832","0.0005","23.3279","0.0017","90","","95.838","0.009","90","","2479.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Tricarbonyl(methyl)(η^5^-1,2,4-tricyclohexylcyclopentadienyl)molybdenum","","- C27 H38 Mo O3 -","- C27 H38 Mo O3 -","- C108 H152 Mo4 O12 -","4","1","CF6222","Sitzmann, Helmut; Walter, Marc D.; Wolmershäuser, Gotthelf","Tricarbonyl(methyl)(η^5^-1,2,4-tricyclohexylcyclopentadienyl)molybdenum","Acta Crystallographica Section E","2002","58","12","m777","m778","10.1107/S1600536802020615","","","0.71073","MoKα","","0.0753","0.034","","","0.0573","0.0623","","","","","","0.804","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201364","10.3159","0.001","22.606","0.003","10.8926","0.001","90","","95.375","0.006","90","","2529","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H22 N4 O8 Zn -","- C26 H22 N4 O8 Zn -","- C104 H88 N16 O32 Zn4 -","4","1","CF6226","Necefoğlu, Hacali; Hökelek, Tuncer; Ersanlı, Cem Cüneyt; Erdönmez, Ahmet","Bis(4-hydroxybenzoato-κ<i>O</i>)bis(nicotinamide-κ<i>N</i>)zinc(II)","Acta Crystallographica Section E","2002","58","12","m758","m761","10.1107/S1600536802021712","","","0.71073","MoKα","","0.0538","0.0332","","","0.0875","0.095","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201365","8.105","0.003","11.065","0.002","14.163","0.004","111.17","0.03","95.85","0.04","102.97","0.03","1130.6","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-(2-Methoxyphenylhydrazono)-3-oxo-butanoic acid","","- C11 H12 N2 O4 -","- C11 H12 N2 O4 -","- C44 H48 N8 O16 -","4","2","CI6118","Rani, Asha; Saha, Ajay Prakash; Prasad, Satya Murti","2-(2-Methoxyphenylhydrazono)-3-oxobutanoic acid","Acta Crystallographica Section E","2002","58","8","o805","o806","10.1107/S1600536802010255","","","0.71073","MoKα","","0.113","0.046","","","0.111","0.122","","","","","","0.88","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201366","15.5427","0.0001","15.2483","0.0001","19.4582","0.0002","90","","107.643","0.001","90","","4394.68","0.07","183","2","183","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C82 H86 Cl6 O20 U2 -","- C82 H86 Cl6 O20 U2 -","- C164 H172 Cl12 O40 U4 -","2","0.5","CI6125","Hoong-Kun Fun; S. Kannan; Suchada Chantrapromma; Ibrahim Abdul Razak; Anwar Usman","Bis[aquabis(1,3-diphenylpropane-1,3-dionato-κ^2^<i>O,O</i>')dioxouranium(VI)] dicyclohexyl-18-crown-6-ether chloroform disolvate","Acta Crystallographica Section E","2002","58","8","m463","m465","10.1107/S160053680201320X","","","0.71073","MoKα","","0.0686","0.0458","","","0.1096","0.1158","","","","","","0.954","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201367","8.29","0.002","9.646","0.003","11.715","0.003","81.54","0.02","81.74","0.02","71.59","0.02","874.4","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","4-2(2'-Benzoylhydrazino-4'-thiazolyl)-3-phenylsydnone","4-2(2'-Benzoylhydrazino-4'-thiazolyl)-3-phenylsydnone","","- C18 H13 N5 O3 S -","- C18 H13 N5 O3 S -","- C36 H26 N10 O6 S2 -","2","1","CI6128","A. Abdul Ajees; S. Karthikeyan; C. V. Yelamaggad; B. V. Badami","4-(2-Benzoylhydrazinothiazol-4-yl)-3-phenylsydnone","Acta Crystallographica Section E","2002","58","7","o784","o786","10.1107/S1600536802010668","","","1.5418","CuKα","","0.048","0.043","","","0.122","0.129","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201368","8.416","0.006","11.288","0.003","12.097","0.003","85.39","0.03","73.97","0.04","83.31","0.04","1095.6","0.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4-(N,N-dimethylaminomethylene)-2-phenyl-2-oxazolin-5-one","","- C12 H12 N2 O2 -","- C12 H12 N2 O2 -","- C48 H48 N8 O8 -","4","2","CI6129","Vasuki, G.; Thamotharan, S.; Ramamurthi, K.; Ambika, S.; Singh, R. M.","4-(<i>N,N</i>-Dimethylaminomethylene)-2-phenyl-2-oxazolin-5-one","Acta Crystallographica Section E","2002","58","7","o740","o741","10.1107/S1600536802009832","","","0.71073","MoKα","","0.083","0.055","","","0.136","0.163","","","","","","1.13","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201369","6.991","0.001","11.674","0.002","13.528","0.002","79.327","0.01","76.866","0.013","78.438","0.014","1042","0.3","293","2","293","2","","","","","","","","4","P 1","P 1","1","","16-(2-Pyridylmethylene)-androst-4-ene-3,17-dione","","- C25 H29 N O2 -","- C25 H29 N O2 -","- C50 H58 N2 O4 -","2","2","CI6130","Vasuki, G.; Thamotharan, S.; Parthasarathi, V.; Ramamurthi, K.; Dubey, S.; Jindal, D. P.","16-(2-Pyridylmethylene)androst-4-ene-3,17-dione","Acta Crystallographica Section E","2002","58","7","o753","o755","10.1107/S1600536802009844","","","1.5418","CuKα","","0.038","0.036","","","0.098","0.102","","","","","","0.93","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201370","26.0725","0.0004","9.5836","0.0001","19.7483","0.0001","90","","103.658","0.001","90","","4794.94","0.09","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C45.5 H55 Cl2 N6 O8 Zn2 -","- C45.5 H55 Cl2 N6 O8 Zn2 -","- C182 H220 Cl8 N24 O32 Zn8 -","4","1","CI6131","Wanida Wongratchasee; Suchada Chantrapromma; Hoong-Kun Fun; Anwar Usman; Chatchanok Karalai; Chanita Ponglimanont; Kan Chantrapromma","Ring contraction in a dinuclear zinc(II) complex of a Robson macrocycle","Acta Crystallographica Section E","2002","58","7","m344","m346","10.1107/S160053680201036X","","","0.71073","MoKα","","0.09","0.056","","","0.14","0.154","","","","","","0.97","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201371","5.1263","0.0008","9.461","0.001","10.322","0.002","88.138","0.005","76.447","0.004","89.745","0.005","486.42","0.13","293","2","293","2","","","","","","","","5","P 1","P 1","1","L-argininium chloride","L-argininium chloride","","- C6 H15 Cl N4 O2 -","- C6 H15 Cl N4 O2 -","- C12 H30 Cl2 N8 O4 -","2","2","CI6132","B. Sridhar; N. Srinivasan; Bjoern Dalhus; R. K. Rajaram","A triclinic polymorph of <small>L</small>-argininium chloride","Acta Crystallographica Section E","2002","58","7","o747","o749","10.1107/S160053680201022X","","","0.71074","MoKα","","0.045","0.042","","","0.134","0.136","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201372","13.5899","0.0014","14.344","0.004","15.667","0.003","90","","110.174","0.013","90","","2866.7","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-chloro-2-(4-chlorophenyl)-1-formyl-1,2-dihydroquinoline","","- C16 H11 Cl2 N O -","- C16 H11 Cl2 N O -","- C128 H88 Cl16 N8 O8 -","8","1","CI6133","S. Thinagar; D. Velmurugan; V. Rajakannan; Il-Hwan Suh; S. Akila","4-Chloro-2-(4-chlorophenyl)-1-formyl-1,2-dihydroquinoline","Acta Crystallographica Section E","2002","58","8","o893","o895","10.1107/S1600536802012588","","","0.71073","MoKα","","0.1059","0.0487","","","0.0938","0.1135","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201373","8.338","0.001","28.339","0.004","17.045","0.002","90","","108.18","0.01","90","","3826.5","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1-N-methyl-2-spiro-3""-oxindole-3-spiro-9'-anthrone-pyrrolidine","1'-Methylindole-3-spiro-2'-pyrrolidine-3'-spiro-9''-anthracene-2,10''-dione","","- C25 H20 N2 O2 -","- C25 H20 N2 O2 -","- C200 H160 N16 O16 -","8","2","CI6134","A. Abdul Ajees; S. Manikandan; R. Raghunathan","Indole-3-spiro-<i>N</i>-methyl-2'-pyrrolidine-3'-spiro-9''-anthracene-2,10''-dione","Acta Crystallographica Section E","2002","58","8","o802","o804","10.1107/S1600536802010863","","","1.5418","CuKα","","0.051","0.044","","","0.118","0.124","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201374","9.242","0.005","19.232","0.012","10.319","0.005","90","","105.8","0.04","90","","1764.8","1.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-Benzylidene-[N-(2,6-dichlorophenyl)-indolin-2-one]","","- C21 H13 Cl2 N O -","- C21 H13 Cl2 N O -","- C84 H52 Cl8 N4 O4 -","4","1","CI6135","Thamotharan, S.; Parthasarathi, V.; Vijayalakshmi, L.; Anuradha, B.; Bhavik Desai; Anamik Shah","3-Benzylidene-1-(2,6-dichlorophenyl)indolin-2-one","Acta Crystallographica Section E","2002","58","8","o885","o886","10.1107/S160053680201111X","","","0.71073","MoKα","","0.066","0.0418","","","0.0916","0.1073","","","","","","1.111","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201375","12.4191","0.0003","8.8571","0.0002","17.6617","0.0003","90","","96.313","0.001","90","","1930.96","0.07","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(N,N-Dimethylamino)-3-(2,2-diphenylethenyl)coumarin","","- C25 H21 N O2 -","- C25 H21 N O2 -","- C100 H84 N4 O8 -","4","1","CI6136","Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Bao-Guo Zhao; Jian-Hua Xu","4-(<i>N,N</i>-Dimethylamino)-3-(2,2-diphenylethenyl)coumarin","Acta Crystallographica Section E","2002","58","7","o756","o757","10.1107/S1600536802010322","","","0.71073","MoKα","","0.079","0.054","","","0.132","0.141","","","","","","0.9","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201376","8.6711","0.0003","23.2413","0.0007","10.0129","0.0003","90","","112.744","0.001","90","","1860.97","0.1","213","2","213","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Methyl 3-benzoyl-3-(6-methyl-2-pyridyl)-2-phenylacrylate","","- C23 H19 N O3 -","- C23 H19 N O3 -","- C92 H76 N4 O12 -","4","1","CI6137","Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Yun Li; Jian-Hua Xu","Methyl 3-benzoyl-3-(6-methyl-2-pyridyl)-2-phenylacrylate","Acta Crystallographica Section E","2002","58","7","o790","o791","10.1107/S1600536802011078","","","0.71073","MoKα","","0.111","0.062","","","0.133","0.148","","","","","","0.84","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201377","14.1314","0.0002","15.0764","0.0001","10.9229","0.0002","90","","102.015","0.001","90","","2276.15","0.06","213","2","213","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3-Acetyl-1-phenyl-2-pentene-1,4-dione","","- C13 H12 O3 -","- C13 H12 O3 -","- C104 H96 O24 -","8","2","CI6138","Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Yun Li; Jian-Hua Xu","3-Acetyl-1-phenyl-2-pentene-1,4-dione","Acta Crystallographica Section E","2002","58","7","o797","o798","10.1107/S1600536802011091","","","0.71073","MoKα","","0.075","0.054","","","0.121","0.127","","","","","","0.91","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201378","6.769","0.002","12.109","0.001","12.606","0.001","90","","95.73","0.01","90","","1028.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N-(p-tolyl)-maleamic acid","N-(p-tolyl)-maleamic acid","","- C11 H11 N O3 -","- C11 H11 N O3 -","- C44 H44 N4 O12 -","4","1","CI6139","Prasad, Satya Murti; Sinha, R. B. P.; Mandal, Deo Kumar; Rani, Asha","<i>N</i>-(<i>p</i>-Tolyl)maleamic acid","Acta Crystallographica Section E","2002","58","8","o891","o892","10.1107/S1600536802012023","","","1.5418","CuKα","","0.105","0.0542","","","0.1438","0.1775","","","","","","1.036","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201379","11.501","0.001","7.5319","0.0007","14.958","0.002","90","","99.25","0.01","90","","1278.9","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,4-Dicholoro-1,4-diphenyl-2,3-diazabuta-1,3-diene","","- C14 H10 Cl2 N2 -","- C14 H10 Cl2 N2 -","- C56 H40 Cl8 N8 -","4","1","CI6140","Tandon, Vishnu K.; Sharon, Ashoke; Bandichhor, Rakeshawar; Maulik, Prakas R.","1,4-Dichloro-1,4-diphenyl-2,3-diazabuta-1,3-diene","Acta Crystallographica Section E","2002","58","8","o869","o870","10.1107/S1600536802012370","","","0.71073","MoKα","","0.0365","0.0313","","","0.086","0.0897","","","","","","1.063","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201380","7.2006","0.0006","7.711","0.001","24.06","0.003","90","","90","","90","","1335.9","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Bis(L-proline) H+ nitrate","Bis(L-proline) hydrogen nitrate","","- C10 H19 N3 O7 -","- C10 H19 N3 O7 -","- C40 H76 N12 O28 -","4","1","CI6141","S. Pandiarajan; B. Sridhar; R. K. Rajaram","Bis(<small>L</small>-proline) hydrogen nitrate","Acta Crystallographica Section E","2002","58","8","o862","o864","10.1107/S1600536802012394","","","0.71073","MoKα","","0.0524","0.0469","","","0.1165","0.1212","","","","","","1.16","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201381","10.682","0.002","5.577","0.002","16.829","0.006","90","","100.92","0.02","90","","984.4","0.5","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","L-methioninium nitrate","","","- C5 H12 N2 O5 S -","- C5 H12 N2 O5 S -","- C20 H48 N8 O20 S4 -","4","2","CI6142","S. Pandiarajan; B. Sridhar; R. K. Rajaram","<small>L</small>-Methioninium nitrate","Acta Crystallographica Section E","2002","58","8","o882","o884","10.1107/S1600536802012461","","","0.71073","MoKα","","0.0561","0.0473","","","0.1232","0.1313","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201382","7.635","0.002","12.1814","0.0015","20.175","0.004","90","","90","","90","","1876.4","0.7","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,6-dimethyl-3,5-(3-chlorophenyl)-4-formyl-cyclohexan-1-one","","- C21 H20 Cl2 O2 -","- C21 H20 Cl2 O2 -","- C84 H80 Cl8 O8 -","4","1","CI6143","Sarangarajan, Thanjavur Ramabhadran; Panchanatheswaran, Krishnaswamy; Thanikachalam, Kanagasabapathy; Jeyaraman, Ramasubbu","3,5-Bis(3-chlorophenyl)-4-formyl-2,6-dimethylcyclohexan-1-one","Acta Crystallographica Section E","2002","58","10","o1053","o1054","10.1107/S1600536802015283","","","0.71069","MoKα","","0.073","0.0422","","","0.0815","0.1001","","","","","","1.15","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201383","27.195","0.003","12.602","0.001","19.747","0.002","90","","104.51","0.01","90","","6551.7","1.1","293","2","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H98 Fe2 N30 Ni3 O10 -","- C36 H78 Fe2 N30 Ni3 O10 -","- C144 H312 Fe8 N120 Ni12 O40 -","4","0.5","CI6144","Muga, Iñaki; Vitoria, Pablo; Gutiérrez-Zorrilla, Juan M.; Luque, Antonio; Román, Pascual","Tris[bis(diethylenetriamine)nickel(II)] bis[hexacyanoferrate(III)] decahydrate","Acta Crystallographica Section E","2002","58","10","m524","m526","10.1107/S160053680201591X","","","0.71073","MoKα","","0.0977","0.0513","","","0.1534","0.1775","","","","","","1.038","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201384","14.1644","0.0012","11.0663","0.0015","17.82","0.002","90","","97.226","0.008","90","","2771.1","0.5","293","2","566","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","μ-Ferrio-bis{carbonyl[μ-2,2',2''-nitrilotriethanethiolato(3-)- N,S,S',S'':S,S']iron(II)} benzene solvate","","- C20 H30 Fe3 N2 O2 S6 -","- C20 H30 Fe3 N2 O2 S6 -","- C80 H120 Fe12 N8 O8 S24 -","4","1","CI6145","Davies, Sian C.; Smith, Matt C.; Hughes, David L.; Evans, David J.","μ-Ferrio-bis{carbonyl[μ-2,2',2''-nitrilotriethanethiolato(3-)-<i>N,S,S</i>',<i>S</i>'':<i>S,S</i>']iron(II)} benzene solvate","Acta Crystallographica Section E","2002","58","11","m658","m660","10.1107/S1600536802018573","","","0.71069","MoKα","","0.1395","0.0572","","","0.1033","0.1438","","","","","","0.984","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201385","7.433","0.001","8.117","0.001","9.646","0.001","71.43","0.01","72.43","0.01","71.36","0.01","509.61","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Pyrazolo[3,4-d]pyrimidine","1,1'-(butane-1,4-diyl)bis(5-methyl-6-methylthio-4,5-dihydro-1H-pyrazolo[3,4-d] pyrimidin-4-one","","- C18 H22 N8 O2 S2 -","- C18 H22 N8 O2 S2 -","- C18 H22 N8 O2 S2 -","1","0.5","CI6146","Avasthi, Kamlakar; Farooq, Sheikh M.; Sharon, Ashoke; Maulik, Prakas R.","Disappearance of inter- and intramolecular stacking due to one-atom addition in `propylene-linker' in a pyrazolo[3,4-<i>d</i>]pyrimidine-based flexible molecule","Acta Crystallographica Section E","2002","58","8","o940","o941","10.1107/S1600536802013211","","","0.71073","MoKα","","0.0443","0.0363","","","0.0953","0.1008","","","","","","1.046","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201386","13.176","0.004","7.125","0.002","11.859","0.004","90","","105.936","0.006","90","","1070.5","0.6","293","2","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-amino-3,5-bis(4-pyridyl)-1,2,4-triazole","","- C12 H10 N6 -","- C12 H10 N6 -","- C48 H40 N24 -","4","1","CI6147","Ya-Mei Guo; Miao Du","4-Amino-3,5-bis(4-pyridyl)-1,2,4-triazole","Acta Crystallographica Section E","2002","58","9","o966","o968","10.1107/S1600536802013521","","","0.71073","MoKα","","0.1353","0.0544","","","0.1223","0.1801","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201387","6.9138","0.001","21.309","0.002","7.0783","0.001","90","","108.917","0.01","90","","986.5","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","3-Oxo-2-(phenylhydrazono)butanoic acid","3-Oxo-2-(phenylhydrazono)butanoic acid","","- C10 H10 N2 O3 -","- C10 H10 N2 O3 -","- C40 H40 N8 O12 -","4","1","CI6148","Rani, Asha; Saha, Ajay Prakash; Prasad, Satya Murti","3-Oxo-2-(phenylhydrazono)butanoic acid","Acta Crystallographica Section E","2002","58","9","o1001","o1002","10.1107/S1600536802014757","","","1.5418","CuKα","","0.0917","0.0584","","","0.1641","0.1829","","","","","","1.081","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201388","7.4093","0.0011","9.0987","0.0011","12.161","0.002","88.477","0.013","82.986","0.017","80.079","0.012","801.5","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(2-pyridylethyl)ammonium perchlorate","","- C14 H18 Cl N3 O4 -","- C14 H18 Cl N3 O4 -","- C28 H36 Cl2 N6 O8 -","2","1","CI6150","Ray J. Butcher; Yilma Gultneh; A. Raza Khan","Bis(2-pyridylethyl)ammonium perchlorate","Acta Crystallographica Section E","2002","58","11","o1204","o1206","10.1107/S1600536802017117","","","0.71073","MoKα","","0.0878","0.0526","","","0.135","0.1583","","","","","","1.021","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201389","8.6789","0.0008","8.7858","0.001","15.1139","0.0015","105.984","0.008","94.188","0.008","99.581","0.009","1083.8","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Bis[2-(2-pyridinio)ethyl]ammonium triperchlorate","Bis[2-(2-pyridinio)ethyl]ammonium triperchlorate","","- C14 H20 Cl3 N3 O12 -","- C14 H20 Cl3 N3 O11.996 -","- C28 H40 Cl6 N6 O23.992 -","2","1","CI6151","Ray J. Butcher; Yilma Gultneh; A. Raza Khan","Bis[2-(2-pyridinio)ethyl]ammonium triperchlorate","Acta Crystallographica Section E","2002","58","11","o1207","o1209","10.1107/S1600536802017130","","","0.71073","MoKα","","0.0619","0.0433","","","0.103","0.1133","","","","","","1.048","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201390","5.797","0.006","26.074","0.007","11.722","0.003","90","","100.72","0.05","90","","1740.9","1.9","298.2","","298.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Venlafaxine hydrocloride","(±)‒N,N‒dimethyl‒2‒(1‒hydroxycyclohex‒1‒yl)‒2‒(4‒methoxyphenyl) ethylamine hydrochloride (±)‒1‒[2‒(Dimethylamino)‒1‒(4‒methoxyphenyl)ethyl] cyclohexanol hydrochloride 1-(2-(1-Hydroxycyclohexyl)-2-(4-methoxyphenyl)ethyl)dimethylammonium chloride","","- C17 H28 Cl N O2 -","- C17 H28 Cl N O2 -","- C68 H112 Cl4 N4 O8 -","4","1","CI6152","A. Sivalakshmidevi; K. Vyas; S. Mahender Rao; G. Om Reddy","A monoclinic polymorph of venlafaxine hydrochloride","Acta Crystallographica Section E","2002","58","10","o1072","o1074","10.1107/S160053680201588X","","","1.5418","CuKα","","0.149","0.068","","0.0808","","0.068","","","1.286","","","1.476","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201391","6.6473","0.0005","7.0748","0.0005","11.2317","0.0008","76.686","0.002","77.66","0.002","89.525","0.002","501.67","0.06","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Ethylenediammonium 4-nitroanthranilate dihydrate","","","- C16 H24 N6 O10 -","- C16 H24 N6 O10 -","- C16 H24 N6 O10 -","1","0.5","CI6153","Graham Smith; Urs D. Wermuth; Jonathan M. White","Ethylenediammonium 4-nitroanthranilate dihydrate","Acta Crystallographica Section E","2002","58","10","o1088","o1090","10.1107/S160053680201601X","","","0.71073","MoKα","","0.0488","0.0453","","","0.1332","0.1369","","","","","","1.069","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2201392","13.8474","0.0012","6.883","0.0006","16.8328","0.0015","90","","99.273","0.003","90","","1583.4","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,2,3,4-tetrahydroquinoline 1,3,5-trinitrobenzene adduct","1,2,3,4-tetrahydroquinoline‒1,3,5-trinitrobenzene (1:1)","","- C15 H14 N4 O6 -","- C15 H14 N4 O6 -","- C60 H56 N16 O24 -","4","1","CI6154","Graham Smith; Urs D. Wermuth; Jonathan M. White","The 1:1 adduct of 1,3,5-trinitrobenzene with 1,2,3,4-tetrahydroquinoline","Acta Crystallographica Section E","2002","58","10","o1130","o1132","10.1107/S1600536802016550","","","0.71073","MoKα","","0.0695","0.0549","","","0.1621","0.1735","","","","","","1.068","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201393","4.1824","0.0006","22.191","0.002","12.767","0.001","90","","93.26","0.01","90","","1183","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-(2'-Nitrophenyl)-4,5-benz-1,3-oxazin-6-one","2-(2'-Nitrophenyl)-4,5-benz-1,3-oxazin-6-one","","- C14 H8 N2 O4 -","- C14 H8 N2 O4 -","- C56 H32 N8 O16 -","4","1","CI6155","Yadav, Bishwa Nath; Prasad, Shambhu; Prasad, Satya Murti","2-(2-Nitrophenyl)-4,5-benz-1,3-oxazin-6-one","Acta Crystallographica Section E","2002","58","10","o1111","o1112","10.1107/S1600536802016148","","","1.5418","CuKα","","0.0499","0.0378","","","0.095","0.105","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201394","9.633","0.004","13.852","0.004","11.301","0.003","90","","106.94","0.02","90","","1442.5","0.8","296","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H9 Cr O3 S6 -","- C6 H9 Cr O3 S6 -","- C24 H36 Cr4 O12 S24 -","4","1","CI6156","Tetsuzo Ito","Tris(<i>O</i>-methyldithiocarbonato)chromium(III)","Acta Crystallographica Section E","2002","58","10","m517","m518","10.1107/S1600536802015775","","","0.7107","MoKα","","","0.033","","","","0.022","","","","","","1.66","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201395","7.046","0.002","19.566","0.006","8.743","0.002","90","","90","0.02","90","","1205.3","0.6","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","Satranidazole","3-(1-Methyl-5-nitroimidazol-2-yl)-1-methylsulfonyl-imidazolidin-2-one","","- C8 H11 N5 O5 S -","- C8 H11 N5 O5 S -","- C32 H44 N20 O20 S4 -","4","1","CI6157","Lakshminarasimhan Damodharan; Vasantha Pattabhi; Kuppuswamy Nagarajan","3-(1-Methyl-5-nitroimidazol-2-yl)-1-(methylsulfonyl)imidazolidin-2-one","Acta Crystallographica Section E","2002","58","10","o1136","o1138","10.1107/S1600536802016902","","","1.5418","CuKα","","0.0696","0.0599","","","0.1603","0.1764","","","","","","1.112","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201396","6.9716","0.0014","8.9866","0.0018","9.986","0.002","70.04","0.03","89.2","0.03","69.6","0.03","547.2","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","8-Hydrazinoquinoline dihydrochloride hydrate","","- C9 H13 Cl2 N3 O -","- C9 H13 Cl2 N3 O -","- C18 H26 Cl4 N6 O2 -","2","1","CI6158","Daniel E. Lynch; Ian M^c^Clenaghan","8-Hydrazinoquinoline dihydrochloride hydrate","Acta Crystallographica Section E","2002","58","10","o1070","o1071","10.1107/S1600536802015878","","","0.71073","MoKα","","0.0442","0.038","","","0.0996","0.1038","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201397","11.815","0.002","9.837","0.002","18.311","0.004","90","","101.05","0.03","90","","2088.7","0.7","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bisquinolinium tetrachlorocopper(II) dihydrate","","- C18 H20 Cl4 Cu N2 O2 -","- C18 H20 Cl4 Cu N2 O2 -","- C72 H80 Cl16 Cu4 N8 O8 -","4","0.5","CI6159","Daniel E. Lynch; Ian MClenaghan","Bisquinolinium tetrachlorocuprate dihydrate","Acta Crystallographica Section E","2002","58","10","m551","m553","10.1107/S1600536802016537","","","0.71073","MoKα","","0.0447","0.0366","","","0.0936","0.0996","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201398","11.523","0.002","15.279","0.004","15.409","0.006","90","","90","","90","","2712.9","1.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3β,17β-Diacetoxy-16-(3-pyridylmethylene)androst-5-ene monohydrate","","- C29 H39 N O5 -","- C29 H37 N O5 -","- C116 H148 N4 O20 -","4","1","CI6161","Vasuki, G.; .; Parthasarathi, V.; Ramamurthi, K.; Dubey, S.; Jindal, D. P.","3β,17β-Diacetoxy-16-(3-pyridylmethylene)androst-5-ene monohydrate","Acta Crystallographica Section E","2002","58","11","o1224","o1226","10.1107/S1600536802017932","","","0.71073","MoKα","","0.0982","0.0616","","","0.1549","0.1808","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201399","12.3964","0.0017","4.961","0.004","21.33","0.004","90","","90","","90","","1311.8","1.1","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","2-(1H-indol-3-ylmethylene)indane-1-one","","- C18 H13 N O -","- C18 H13 N O -","- C72 H52 N4 O4 -","4","1","CI6162","Vasuki, G.; Parthasarathi, V.; Ramamurthi, K.; Mohane Coumar, S.; Jindal, D. P.","2-(1<i>H</i>-Indol-3-ylmethylene)indane-1-one","Acta Crystallographica Section E","2002","58","11","o1222","o1223","10.1107/S1600536802017774","","","0.71073","MoKα","","0.0913","0.0431","","","0.0738","0.0987","","","","","","1.185","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201400","10.538","0.002","12.068","0.003","15.747","0.003","87.31","0.01","71.24","0.02","65.66","0.02","1719.1","0.7","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","2,2',2''-Nitrilotris(ethylammonium) tris(pyridine-2,6-dicarboxylato-κ^3^O,N,O')terbate(III) hexahydrate","","- C27 H42 N7 O18 Tb -","- C27 H33 N7 O18 Tb -","- C54 H66 N14 O36 Tb2 -","2","1","CI6163","Chen, Lin; Yin, Xian-Hong; Tan, Min-Yu; Xia, Chun-Gu; Yu, Kai-Bei","2,2',2''-Nitrilotris(ethylammonium) tris(pyridine-2,6-dicarboxylato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')terbate(III) hexahydrate","Acta Crystallographica Section E","2002","58","11","m666","m668","10.1107/S1600536802018536","","","0.71073","MoKα","","0.0359","0.0327","","","0.0876","0.0885","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201401","12.3288","0.0009","8.41","0.0008","19.441","0.002","90","","106.296","0.007","90","","1934.8","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-Bromo-N-[3-bromo-N-(phenylsulfonyl)indol-2-ylmethyl]aniline","","- C21 H16 Br2 N2 O2 S -","- C21 H16 Br2 N2 O2 S -","- C84 H64 Br8 N8 O8 S4 -","4","1","CI6164","Govind, M. M.; Govindaraj, J.; Rajakannan, V.; Velmurugan, D.; Moon-Jib Kim; Srinivasan, P. C.; Kannadasan, S.","2-Bromo-<i>N</i>-[3-bromo-<i>N</i>-(phenylsulfonyl)indol-2-ylmethyl]aniline","Acta Crystallographica Section E","2002","58","11","o1241","o1243","10.1107/S1600536802018457","","","0.71073","MoKα","","0.2404","0.0601","","","0.1344","0.194","","","","","","0.872","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201402","8.4671","0.0004","8.7971","0.0005","11.6748","0.0006","112.096","0.004","90.354","0.003","110.549","0.002","744.84","0.07","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","trans-Bis(2-amino-5-methyl-1,3,4-thiadiazole-N)-bis(benzene-1-carboxylato-O- 3,5-dicarboxylic acid)copper(II) dihydrate","","- C24 H24 Cu N6 O14 S2 -","- C24 H24 Cu N6 O14 S2 -","- C24 H24 Cu N6 O14 S2 -","1","0.5","CI6165","Daniel E. Lynch","<i>trans</i>-Bis(2-amino-5-methyl-1,3,4-thiadiazole-κ<i>N</i>)bis(3,5-dicarboxybenzoato-κ<i>O</i>)copper(II) dihydrate","Acta Crystallographica Section E","2002","58","10","m577","m579","10.1107/S1600536802017166","","","0.71073","MoKα","","0.0754","0.0487","","","0.121","0.1332","","","","","","1.06","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201403","14.5526","0.0012","7.9438","0.0009","14.2666","0.0008","90","","93.48","0.006","90","","1646.2","0.2","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,6-Bis(N,N'-benzotriazol-1-ylmethyl)pyridine","","- C19 H15 N7 -","- C19 H15 N7 -","- C76 H60 N28 -","4","1","CI6166","Selvanayagam, S.; Rajakannan, V.; Velmurugan, D.; Dhanasekaran, M.; Rajakumar, P.; Moon, Jib-Kim","2,6-Bis(<i>N,N</i>'-benzotriazol-1-ylmethyl)pyridine","Acta Crystallographica Section E","2002","58","11","o1190","o1192","10.1107/S1600536802017567","","","0.71073","MoKα","","0.0655","0.0355","","","0.0888","0.0995","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201404","10.072","0.001","12.371","0.002","11.275","0.001","90","","99.62","0.02","90","","1385.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Methyl 2-(2-chlorobenzamido)benzoate","Methyl 2-(2-chlorobenzamido)benzoate","","- C15 H12 Cl N O3 -","- C15 H12 Cl N O3 -","- C60 H48 Cl4 N4 O12 -","4","1","CI6167","Yadav, Bishwa Nath; Prasad, Shambhu; Prasad, Satya Murti","Methyl 2-(2-chlorobenzamido)benzoate","Acta Crystallographica Section E","2002","58","11","o1198","o1199","10.1107/S160053680201807X","","","0.71069","MoKα","","0.1486","0.0653","","","0.1355","0.1741","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201405","7.9336","0.0005","10.3841","0.0006","12.4407","0.0007","105.158","0.001","104.077","0.001","100.4","0.001","926.35","0.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","6-(4-Methoxyphenyl)-4-phenyl-2-(pyrrolidin-1-yl)nicotinonitrile","","- C23 H21 N3 O -","- C23 H21 N3 O -","- C46 H42 N6 O2 -","2","1","CI6168","S. Thinagar; D. Velmurugan; S. Shanmuga Sundara Raj; Hoong-Kun Fun; V. Raghukumar","6-(4-Methoxyphenyl)-4-phenyl-2-(pyrrolidin-1-yl)nicotinonitrile","Acta Crystallographica Section E","2002","58","11","o1261","o1263","10.1107/S1600536802018627","","","0.71073","MoKα","","0.1009","0.0637","","","0.1563","0.1768","","","","","","0.939","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201406","10.2443","0.0003","10.4161","0.0003","11.419","0.0003","65.064","0.001","89.772","0.001","65.707","0.001","985.65","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","cis-3-(p-bromostyryl)-2-methyl-N-(phenylsulfonyl)indole","","- C23 H18 Br N O2 S -","- C23 H18 Br N O2 S -","- C46 H36 Br2 N2 O4 S2 -","2","1","CI6170","S. Thinagar; D. Velmurugan; S. Banumathi; S. Shanmuga Sundara Raj; Hoong-Kun Fun; S. Kannadasan","<i>cis</i>-3-(<i>p</i>-Bromostyryl)-2-methyl-<i>N</i>-(phenylsulfonyl)indole","Acta Crystallographica Section E","2002","58","11","o1264","o1266","10.1107/S1600536802018639","","","0.71073","MoKα","","0.0525","0.0394","","","0.105","0.1123","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201407","12.311","0.003","14.7","0.002","15.205","0.003","90","","98.79","0.02","90","","2719.4","0.9","301.2","","301.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H16 Cl2 N6 O8 S6 -","- C18 H16 Cl2 N6 O8 S6 -","- C72 H64 Cl8 N24 O32 S24 -","4","0.5","CI6171","Chan, Kannie Wai Yan; Yang, Chi; Szeto, Lap","<i>cyclo</i>-Bis[2-methylsulfanyl-6-([1,3,4]thiadiazol-2-ylsulfanylmethyl)pyridinium] diperchlorate","Acta Crystallographica Section E","2002","58","11","o1277","o1279","10.1107/S1600536802019050","","","0.7107","MoKα","","","0.0796","","","","0.0505","","","","","","1.398","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201408","7.306","0.003","11.765","0.004","12.828","0.004","90","","116.09","0.04","90","","990.3","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","N-(p-chlorophenyl)maleamic acid","N-(p-chlorophenyl)maleamic acid","","- C10 H8 Cl N O3 -","- C10 H8 Cl N O3 -","- C40 H32 Cl4 N4 O12 -","4","1","CI6173","Prasad, Satya Murti; Sinha, R. B. P.; Mandal, Deo Kumar; Rani, Asha","<i>N</i>-(<i>p</i>-Chlorophenyl)maleamic acid","Acta Crystallographica Section E","2002","58","11","o1296","o1297","10.1107/S1600536802019293","","","0.71069","MoKα","","0.0823","0.0543","","","0.1338","0.1397","","","","","","0.924","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201409","7.358","0.002","12.635","0.002","20.596","0.01","90","","90","","90","","1914.8","1.1","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","17a-Allyl-17a-aza-D-homoandrost-4-en-3-one","","- C22 H33 N O -","- C22 H33 N O -","- C88 H132 N4 O4 -","4","1","CI6175","Vasuki, G.; Parthasarathi, V.; Ramamurthi, K.; Piplani, P.; Jindal, D. P.","17<i>a</i>-Allyl-17<i>a</i>-aza-<small>D</small>-homoandrost-4-en-3-one","Acta Crystallographica Section E","2002","58","12","o1361","o1362","10.1107/S160053680201992X","","","0.71073","MoKα","","0.087","0.0458","","","0.1011","0.1195","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201410","11.4545","0.0012","12.207","0.002","14.784","0.003","90","","90","","90","","2067.2","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","16-(3-Pyridylmethylene) androst-4-ene-3,17-dione","","- C25 H29 N O2 -","- C25 H29 N O2 -","- C100 H116 N4 O8 -","4","1","CI6176","Vasuki, G.; .; Parthasarathi, V.; .; Ramamurthi. K.; Dubey, S.; Jindal, D. P.","16-(3-Pyridylmethylene)androst-4-ene-3,17-dione","Acta Crystallographica Section E","2002","58","12","o1359","o1360","10.1107/S1600536802019906","","","0.71073","MoKα","","0.064","0.0407","","","0.0898","0.1082","","","","","","1.116","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201411","13.5826","0.0002","10.6063","0.0002","14.326","0.0003","90","","90","","90","","2063.82","0.07","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-methoxybenzaldehyde thiosemicarbazone","","- C9 H11 N3 O S -","- C9 H11 N3 O S -","- C72 H88 N24 O8 S8 -","8","1","CI6177","S. Selvanayagam; M. Yogavel; V. Rajakannan; D. Velmurugan; S. Shanmuga Sundara Raj; Hoong-Kun Fun","2-Methoxybenzaldehyde thiosemicarbazone","Acta Crystallographica Section E","2002","58","12","o1336","o1338","10.1107/S160053680201961X","","","0.71073","MoKα","","0.0694","0.0436","","","0.1153","0.1259","","","","","","0.984","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201412","5.335","0.009","9.242","0.008","13.969","0.009","89.27","0.01","82.68","0.01","86.47","0.01","681.8","1.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","6,6'-Dichloro-3,3'-(butane-1,4-diyldioxy)diflavone","","- C34 H24 Cl2 O6 -","- C34 H24 Cl2 O6 -","- C34 H24 Cl2 O6 -","1","0.5","CI6178","S. Thinagar; D. Velmurugan; S. C. Gupta; H. Merazig; S. Bouacida","6,6'-Dichloro-3,3'-(butane-1,4-diyldioxy)diflavone","Acta Crystallographica Section E","2002","58","12","o1441","o1443","10.1107/S1600536802021645","","","0.71073","MoKα","","0.2878","0.0564","","","0.1034","0.1589","","","","","","0.905","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201413","11.149","0.0001","13.733","0.0001","14.6666","0.0001","100.487","0.001","93.24","0.001","107.014","0.001","2097","0.03","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","6-(4-Chlorophenyl)-4-[4-(dimethylamino)phenyl]-2-(pyrrolidin-1- yl)nicotinonitrile","","- C24 H23 Cl N4 -","- C24 H23 Cl N4 -","- C96 H92 Cl4 N16 -","4","2","CI6179","S. Thinagar; D. Velmurugan; S. Shanmuga Sundara Raj; Hoong-Kun Fun; V. Raghukumar","6-(4-Chlorophenyl)-4-[4-(dimethylamino)phenyl]-2-(pyrrolidin-1-yl)nicotinonitrile","Acta Crystallographica Section E","2002","58","12","o1452","o1454","10.1107/S1600536802019931","","","0.71073","MoKα","","0.0792","0.0538","","","0.1459","0.1604","","","","","","0.973","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201414","7.9526","0.0009","8.0441","0.001","9.1229","0.0011","90.953","0.002","101.247","0.002","93.647","0.002","570.99","0.12","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-(6-Methylpyridin-2-yl)-2-phenylethanedione","","- C14 H11 N O2 -","- C14 H11 N O2 -","- C28 H22 N2 O4 -","2","1","CI6181","Yun Li; Anwar Usman; Yan Zhang; Hoong-Kun Fun; Jian-Hua Xu","1-(6-Methylpyridin-2-yl)-2-phenylethanedione","Acta Crystallographica Section E","2002","58","12","o1400","o1401","10.1107/S1600536802021086","","","0.71073","MoKα","","0.0868","0.0664","","","0.1428","0.1528","","","","","","1.15","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201415","11.67","0.0018","11.93","0.003","11.108","0.003","90","","98.005","0.018","90","","1531.4","0.6","183","2","183","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-thioxo-1,3-dihydro-1H-2λ^5^-naphtho[2,3-d][1,3,2] diaza-phosphole-2-thiolate","","- C15 H14 N3 P S2 -","- C15 H14 N3 P S2 -","- C60 H56 N12 P4 S8 -","4","1","CM6008","Janča, Michal; Nečas, Marek; Příhoda, Jiří","Pyridinium 2-thioxo-2,3-dihydro-1<i>H</i>-naphtho[2,3-<i>d</i>]-1,3,2λ^5^-diazaphosphole-2-thiolate","Acta Crystallographica Section E","2002","58","7","o772","o773","10.1107/S1600536802010620","","","0.71069","MoKα","","0.0366","0.0279","","","0.0755","0.0786","","","","","","1.051","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201416","8.827","0.0006","8.7748","0.0006","19.1473","0.001","90","","100.833","0.003","90","","1456.63","0.16","133","2","133","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","trans-Diaquabis[2-(2-pyridyl)ethanol-κ^2^N,O]zinc(II) disaccharinate","","- C28 H30 N4 O10 S2 Zn -","- C28 H30 N4 O10 S2 Zn -","- C56 H60 N8 O20 S4 Zn2 -","2","0.5","CM6009","Hamamci, Sevim; Yilmaz, Veysel T.; Thöne, Carsten","<i>trans</i>-Diaquabis[2-(2-pyridyl)ethanol-κ^2^<i>N,O</i>]zinc(II) disaccharinate","Acta Crystallographica Section E","2002","58","7","m369","m371","10.1107/S1600536802010887","","","0.71073","MoKα","","0.0255","0.0238","","","0.0678","0.0688","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201417","7.9246","0.0013","12.543","0.002","16.015","0.003","90","","90","","90","","1591.9","0.5","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","2,5-dihydro-3,4-dimethyl-5-oxo-1H-pyrazole-1-carbothioamide","","- C6 H9 N3 O S -","- C6 H9 N3 O S -","- C48 H72 N24 O8 S8 -","8","1","CM6010","Carballo, Rosa; Casas, J. Sergio; García-Martínez, Emilia; Pereiras-Gabián, Gumersindo; Sánchez, Agustín; Sordo, José; Vázquez-López, Ezequiel M.","2,5-Dihydro-3,4-dimethyl-5-oxo-1<i>H</i>-pyrazole-1-carbothioamide","Acta Crystallographica Section E","2002","58","7","o787","o789","10.1107/S160053680201098X","","","0.71073","MoKα","","0.0581","0.0464","","","0.1251","0.1319","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201418","30.1575","0.0013","6.3341","0.0003","15.9844","0.0009","90","","96.772","0.002","90","","3032","0.3","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Tetrasodium tetrahydrofuran-trans-cis-trans-tetracarboxylate pentahydrate","","- C8 H14 Na4 O14 -","- C8 H14 Na4 O14 -","- C64 H112 Na32 O112 -","8","1","CM6011","Barnes, John C.","Tetrasodium tetrahydrofuran-<i>trans</i>-<i>cis</i>-<i>trans</i>-tetracarboxylate pentahydrate","Acta Crystallographica Section E","2002","58","7","m378","m380","10.1107/S1600536802011297","","","0.71073","MoKα","","0.0937","0.0517","","","0.1255","0.1445","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201419","10.1825","0.0014","14.863","0.002","15.396","0.002","90","","92.009","0.002","90","","2328.6","0.5","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","{(2,6-Di-o-anisol-phenyl)(μ-Li)[μ-Li(tetrahydrofuran)I]}~2~","","- C48 H50 I2 Li4 O6 -","- C48 H50 I2 Li4 O6 -","- C96 H100 I4 Li8 O12 -","2","0.5","CM6012","Rabe, Gerd W.; Zhang-Presse, Mei; Yap, Glenn P. A.","Bis(μ-2,2''-dimethoxy-<i>m</i>-terphenyl)di-μ~3~-iodo-bis(tetrahydrofuran)tetralithium(I)","Acta Crystallographica Section E","2002","58","8","m434","m435","10.1107/S1600536802012345","","","0.71073","MoKα","","0.1594","0.0677","","","0.0965","0.12","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201420","6.271","0.002","27.205","0.003","9.871","0.002","90","","97.29","0.01","90","","1670.4","0.7","122","1","122","1","","","","","","","","7","I 1 m 1","I -2y","8","","","","- C0.73 H47.19 Cl2.27 N15 O18 Rh3 S6 -","- C0.73 H45 Cl2.27 N15 O18 Rh3 S6 -","- C1.46 H90 Cl4.54 N30 O36 Rh6 S12 -","2","0.5","CM6013","Harris, Pernille; Kofod, Pauli","A methyl-coordinated Rh^<b>III^</b> ion in methylpentaamminerhodium(III)‒chloropentaamminerhodium(III)‒dithionate (0.73/2.27/3)","Acta Crystallographica Section E","2002","58","8","m460","m462","10.1107/S1600536802013466","","","0.71073","MoKα","","0.0374","0.0361","","","0.1002","0.102","","","","","","1.069","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201421","21.815","0.003","10.464","0.002","11.222","0.002","90","","108.55","0.01","90","","2428.6","0.7","293","3","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","Triethylammonium 8-Acetyl-3-methyl-9-phenyl-7-oxo-2-azaspiro [4.5]dec-2-en-4-nitronate","","- C23 H33 N3 O5 -","- C23 H33 N3 O5 -","- C92 H132 N12 O20 -","4","1","CM6016","Mauro F.A. Adamo; Stefano Chimichi; Donato Donati; Piero Sarti-Fantoni","Triethylammonium 8-acetyl-3-methyl-9-phenyl-7-oxo-2-azaspiro[4.5]dec-2-ene-4-nitronate","Acta Crystallographica Section E","2002","58","10","o1125","o1127","10.1107/S1600536802016598","","","0.71073","MoKα","","0.0607","0.0432","","","0.1129","0.1248","","","","","","0.995","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201422","7.6086","0.0004","10.664","0.001","14.0482","0.0006","90","","93.98","0.006","90","","1137.1","0.13","293","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","(+)-(3S,4R)-cis-4-amino-5-chloro-2-methoxy-N-(3-methoxypiperidin-1-ium-4-yl) benzamide hydrogen (2R,3R)-dihydroxybutanedioate monohydrate","","- C18 H28 Cl N3 O10 -","- C18 H28 Cl N3 O10 -","- C36 H56 Cl2 N6 O20 -","2","1","CM6017","Peeters, Oswald M.; Blaton, Norbert M.","(+)-(3<i>S</i>,4<i>R</i>)-Norcisapride hydrogen (2<i>R</i>,3<i>R</i>)-tartrate monohydrate","Acta Crystallographica Section E","2002","58","10","o1169","o1171","10.1107/S1600536802017683","","","1.54178","CuKα","","0.0381","0.0371","","0.1068","","0.1068","","","1.064","","","1.064","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2201423","4.0299","0.0003","10.2866","0.0007","11.9615","0.0009","104.87","0.006","96.745","0.006","95.831","0.006","471.42","0.06","295","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C8 H7 N3 O3 S -","- C8 H7 N3 O3 S -","- C16 H14 N6 O6 S2 -","2","1","CM6019","Özbey, Süheyla; Tozkoparan, Birsen","Methyl 2-methyl-7-oxo-1,2,4-triazolo[3,2-<i>b</i>]-1,3-thiazine-5-carboxylate","Acta Crystallographica Section E","2002","58","11","o1193","o1194","10.1107/S1600536802018056","","","0.71073","MoKα","","","0.0433","","","","0.1252","","","","","","1.085","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201424","6.6315","0.0001","9.8478","0.0002","20.9769","0.0005","90","","90","","90","","1369.91","0.05","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2(S)-N-tert-Butoxycarbonylamino-N-methoxy-N-methyl-butanamide","","- C11 H22 N2 O4 -","- C11 H22 N2 O4 -","- C44 H88 N8 O16 -","4","1","CM6021","Sawatzki, Peter; Mikeska, Thomas; Nieger, Martin; Hupfer, Heike; Kolter, Thomas","2(<i>S</i>)-<i>N</i>-<i>tert</i>-Butoxycarbonylamino-<i>N</i>-methoxy-<i>N</i>-methylbutanamide","Acta Crystallographica Section E","2002","58","12","o1415","o1417","10.1107/S1600536802020974","","","0.71073","MoKα","","0.0387","0.034","","","0.0877","0.0901","","","","","","1.074","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201425","12.184","0.0004","15.783","0.0004","14.855","0.0003","90","","115.176","0.0016","90","","2585.25","0.12","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 B F4 I N2 -","- C10 H10 B F4 I N2 -","- C80 H80 B8 F32 I8 N16 -","8","2","CM6022","Álvarez-Rúa, Carmen; García-Granda, Santiago; Ballesteros, Alfredo; Francisco González-Bobes; González, José M.","Bis(pyridine)iodonium(I) tetrafluoroborate","Acta Crystallographica Section E","2002","58","12","o1381","o1383","10.1107/S1600536802020639","","","1.5418","CuKα","","0.0551","0.0359","","","0.1121","0.1414","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201426","8.6073","0.0002","11.2146","0.0001","15.784","0.0001","90","","92.751","0.001","90","","1521.83","0.04","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Bis{[μ-η^5^:η^1^-2-(cyclopentadienyl)ethoxy](1,2-dimethoxyethane-O) (η^5^-cyclopentadienyl)yttrium}","","","- C32 H46 O6 Y2 -","- C32 H46 O6 Y2 -","- C64 H92 O12 Y4 -","2","0.5","CM6023","Schumann, Herbert; Dechert, Sebastian; Pestova, Irina I.; Bochkarev, Mikhail N.","Bis[μ-η^5^:η^1^-2-(cyclopentadienyl)ethoxy]bis[(η^5^-cyclopentadienyl)(1,2-dimethoxyethane-κ<i>O</i>)yttrium]","Acta Crystallographica Section E","2002","58","12","m707","m709","10.1107/S1600536802020159","","","0.71073","MoKα","","0.0779","0.0446","","","0.0785","0.0877","","","","","","1.007","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201427","7.058","0.004","7.126","0.003","11.311","0.006","77.05","0.03","86.35","0.04","78.47","0.05","543.1","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","3-Oxo-2-(p-bromophenylhydrazono)-butanoic acid","2-(p-Bromophenylhydrazono)-3-oxobutanoic acid","","- C10 H9 Br N2 O3 -","- C10 H9 Br N2 O3 -","- C20 H18 Br2 N4 O6 -","2","1","CM6024","Prasad, Satya Murti; Gupta, Satish Chandra; Rani, Asha","2-(<i>p</i>-Bromophenylhydrazono)-3-oxobutanoic acid","Acta Crystallographica Section E","2002","58","12","o1446","o1448","10.1107/S160053680202189X","","","1.5418","CuKα","","0.0862","0.0709","","","0.1802","0.1857","","","","","","0.902","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201428","8.5646","0.0013","19.985","0.003","9.7854","0.0013","90","","104.96","0.011","90","","1618.1","0.4","300","1","300","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Aqua[(±)-lactate-O,O'](1,10-phenanthroline-κ^2^N,N')copper(II) nitrate","","- C15 H15 Cu N3 O7 -","- C15 H15 Cu N3 O7 -","- C60 H60 Cu4 N12 O28 -","4","1","CM6025","Medina, Gerardo; Gasque, Laura; Bernès, Sylvain","Aqua[(±)-lactate-<i>O,O</i>'](1,10-phenanthroline-κ^2^<i>N,N</i>')copper(II) nitrate","Acta Crystallographica Section E","2002","58","12","m765","m767","10.1107/S1600536802021591","","","0.71073","MoKα","","0.0449","0.0365","","","0.0938","0.0985","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201429","17.805","0.004","37.831","0.014","19.3318","0.0018","90","","90","","90","","13022","6","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","tris[bis(diphenylphosphino)methane]rhenium(I) perrhenate","","- C75 H66 O4 P6 Re2 -","- C75 H66 O4 P6 Re2 -","- C600 H528 O32 P48 Re16 -","8","1","CV6110","Kenton H. Whitmire; Daniel R. Derringer; Kimberly R. Kongkasuwan","Tris[bis(diphenylphosphino)methane-κ^2^<i>P,P</i>']rhenium(I) perrhenate","Acta Crystallographica Section E","2002","58","7","m363","m365","10.1107/S1600536802010838","","","0.71069","MoKα","","0.0874","0.0455","","","0.0974","0.1148","","","","","","1.108","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201430","14.4165","0.0003","18.9655","0.0004","21.9088","0.0002","90","","90","","90","","5990.22","0.19","136","2","136","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C24 H15 Br3 -","- C24 H15 Br3 -","- C288 H180 Br36 -","12","3","CV6114","Lianne M. C. Beltran; Chunming Cui; Dennis H. Leung; Jide Xu; Frederick J. Hollander","1,3,5-Tris(<i>p</i>-bromophenyl)benzene","Acta Crystallographica Section E","2002","58","7","o782","o783","10.1107/S1600536802010401","","","0.71073","MoKα","","0.0728","0.0354","","","0.0626","0.0703","","","","","","0.742","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201431","10.38","0.002","19.091","0.003","9.947","0.002","90","","112.17","0.02","90","","1825.4","0.6","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","Trimethoprim trifluoroacetate","2,4-diamino-5-(3,4,5-trimethoxybenzyl)pyrimidinium trifluoroacetate","","- C16 H19 F3 N4 O5 -","- C16 H19 F3 N4 O5 -","- C64 H76 F12 N16 O20 -","4","1","CV6116","Savarimuthu Francis; Packianathan Thomas Muthiah; Gabriele Bocelli; Lara Righi","Hydrogen-bonding patterns in trimethoprim trifluoroacetate","Acta Crystallographica Section E","2002","58","7","o717","o719","10.1107/S1600536802009509","","","0.71069","MoKα","","0.1198","0.059","","","0.1645","0.1879","","","","","","0.972","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201432","10.6273","0.0008","9.0102","0.0008","11.337","0.0007","90","","93.749","0.006","90","","1083.24","0.14","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","α-Ammonium-α-methylpropionoate","","- C4 H9 N O2 -","- C4 H9 N O2 -","- C32 H72 N8 O16 -","8","1","CV6117","Daniel E. Lynch; Ian McClenaghan","Redetermination of α-ammonio-α-methylpropionoate","Acta Crystallographica Section E","2002","58","7","o706","o707","10.1107/S1600536802009662","","","0.71073","MoKα","","0.0881","0.0449","","","0.1122","0.1302","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201433","8.198","0.002","5.43","0.001","19.592","0.005","90","","91.35","0.006","90","","871.9","0.3","120","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Benzocaine","Ethyl 4-aminobenzoate","","- C9 H11 N O2 -","- C9 H11 N O2 -","- C36 H44 N4 O8 -","4","1","CV6118","Daniel E. Lynch; Ian McClenaghan","Monoclinic form of ethyl 4-aminobenzoate (benzocaine)","Acta Crystallographica Section E","2002","58","7","o708","o709","10.1107/S1600536802009674","","","0.71073","MoKα","","0.1521","0.0652","","","0.1425","0.1808","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201434","10.2375","0.0004","3.946","0.0002","35.075","0.002","90","","91.979","0.002","90","","1416.09","0.12","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 4-phenyl-2-(N-pyrrole)-1,3-thiazole-5-carboxylate","","- C16 H14 N2 O2 S -","- C16 H14 N2 O2 S -","- C64 H56 N8 O8 S4 -","4","1","CV6119","Daniel E. Lynch; Ian McClenaghan","Ethyl 4-phenyl-2-(<i>N</i>-pyrrolyl)-1,3-thiazole-5-carboxylate","Acta Crystallographica Section E","2002","58","7","o745","o746","10.1107/S1600536802010206","","","0.71073","MoKα","","0.1218","0.0801","","","0.1818","0.2064","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201435","7.58","0.004","20.065","0.005","10.606","0.002","90","","109.51","0.03","90","","1520.5","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","diaquadinitratothiabendazolecopper(II)","","","- C10 H11 Cu N5 O8 S -","- C10 H11 Cu N5 O8 S -","- C40 H44 Cu4 N20 O32 S4 -","4","1","CV6120","Sethuraman, Velusamy; Stanley, Nithianantham; Thomas Muthiah, Packianathan; Karunakaran, Chandran","Supramolecular self-assembly <i>via</i> inter-ligands hydrogen bonds in [Cu(H~2~O)~2~(NO~3~)~2~(tb)] (tb is thiabendazole)","Acta Crystallographica Section E","2002","58","8","m392","m395","10.1107/S1600536802011054","","","0.71073","MoKα","","0.0511","0.0294","","","0.0691","0.0769","","","","","","1.097","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201436","9.3429","0.0003","15.8543","0.0002","10.6022","0.0003","90","","104.45","0.03","90","","1520.8","0.2","213","2","213","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-Cyano-N-diphenylmethylenebenzenamine","","- C20 H14 N2 -","- C20 H14 N2 -","- C80 H56 N8 -","4","1","CV6121","Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Jing-Zhi Tian; Yan Zhang; Jian-Hua Xu","2-Cyano-<i>N</i>-(diphenylmethylene)benzenamine","Acta Crystallographica Section E","2002","58","7","o792","o793","10.1107/S1600536802011066","","","0.71073","MoKα","","0.1453","0.0588","","","0.1165","0.1391","","","","","","0.805","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201437","9.5854","0.0015","10.8061","0.0017","12.484","0.002","79.059","0.013","89.44","0.015","82.372","0.014","1258.2","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","pyrimethamine","","","- C12 H13 Cl N4 -","- C12 H13 Cl N4 -","- C48 H52 Cl4 N16 -","4","2","CV6122","Sethuraman, Velusamy; Thomas Muthiah, Packianathan","Hydrogen-bonded supramolecular ribbons in the antifolate drug pyrimethamine","Acta Crystallographica Section E","2002","58","8","o817","o818","10.1107/S1600536802011133","","","0.71069","MoKα","","0.058","0.0539","","","0.1365","0.1424","","","","","","1.161","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201438","14.607","0.018","11.679","0.015","16.2","0.02","90","","107.57","0.02","90","","2635","6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dichlorobis(trans-2-styrylbenzoxazole-N,N')cobalt(II)","","- C30 H22 Cl2 Co N2 O2 -","- C30 H22 Cl2 Co N2 O2 -","- C120 H88 Cl8 Co4 N8 O8 -","4","1","CV6125","Liu, Hui-min; Zhuang, Jun-Peng; Zhang, Wei; Zhang, Wen-Qin","Dichlorobis(<i>trans</i>-2-styrylbenzoxazole-κ^2^<i>N,N</i>')cobalt(II)","Acta Crystallographica Section E","2002","58","8","m426","m428","10.1107/S1600536802012059","","","0.71073","MoKα","","0.1195","0.0515","","","","0.2162","","","","","","0.964","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201439","17.756","0.004","15.986","0.002","11.924","0.002","90","","116.31","0.02","90","","3034","1.1","293","2","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Diethyl N,N'-o-phenylenedioxamate","","- C14 H16 N2 O6 -","- C14 H16 N2 O6 -","- C112 H128 N16 O48 -","8","1","CV6126","Martín, Susana; Beitia, Javier I.; Ugalde, Maria; Vitoria, Pablo; Cortés, Roberto","Diethyl <i>N,N</i>'-<i>o</i>-phenylenedioxamate","Acta Crystallographica Section E","2002","58","8","o913","o915","10.1107/S1600536802012849","","","0.71069","MoKα","","0.1915","0.0578","","","","0.1554","","","","","","0.884","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201440","11.672","0.004","5.3982","0.0019","12.413","0.004","90","","105.02","0.005","90","","755.4","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Trans-s,s'-2-butene-1,4-diylbis(L-cysteine) dihydrate","","- C10 H22 N2 O6 S2 -","- C10 H22 N2 O6 S2 -","- C20 H44 N4 O12 S4 -","2","1","CV6127","Shi, Yun-Mei; Gu, Feng-Cai; Zhuang, Jun-Peng; Zhang, Wen-Qin","<i>trans</i>-<i>S</i>,<i>S</i>'-(But-2-ene-1,4-diyl)bis(<small>L</small>-cysteine) dihydrate","Acta Crystallographica Section E","2002","58","9","o975","o977","10.1107/S1600536802013442","","","0.71073","MoKα","","0.0568","0.0414","","","","0.0894","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201441","14.892","0.002","9.375","0.003","17.119","0.007","90","","99.18","0.02","90","","2359.4","1.3","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","20-Oxopregn-5-ene-3β,16α-diyl diacetate","","- C25 H36 O5 -","- C25 H36 O5 -","- C100 H144 O20 -","4","2","CV6128","Andrade, L. C. R.; Paixão, J. A.; de Almeida, M. J. M.; Cruz Silva, M. M.; Moreno, M. J. S. M; Sá e Melo, M. L.; Campos Neves, A. S.","20-Oxopregn-5-ene-3β,16α-diyl diacetate","Acta Crystallographica Section E","2002","58","8","o898","o900","10.1107/S1600536802012862","","","1.5418","CuKα","","0.0474","0.0434","","","0.1185","0.1236","","","","","","1.048","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201442","9.48","0.002","26.303","0.005","14.437","0.004","90","","102.9","0.02","90","","3509","1.4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","tri(2-sulfidopyridine N-oxide-O,S)-Cobalt(III)","","- C15 H12 Co N3 O3 S3 -","- C15 H12 Co N3 O3 S3 -","- C120 H96 Co8 N24 O24 S24 -","8","2","CV6129","Yue-Ping Fang; Chun-long Chen; Xiu-jian Wang; Bei-sheng Kang; Kaibei Yu; Cheng-yong Su","Tris(2-sulfidopyridine <i>N</i>-oxide-κ^2^<i>O,S</i>)cobalt(III)","Acta Crystallographica Section E","2002","58","9","m480","m481","10.1107/S1600536802014745","","","0.71073","MoKα","","0.092","0.0398","","","0.0519","0.0593","","","","","","0.801","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201443","15.2751","0.0014","15.498","0.002","16.835","0.002","90","","90","","90","","3985.4","0.8","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Tris(propane-1,3-diamine)nickel(II) tetrafluoroborate.","","- C9 H30 B2 F8 N6 Ni -","- C9 H30 B2 F8 N6 Ni -","- C72 H240 B16 F64 N48 Ni8 -","8","1","CV6130","Roger D. Willett; Firas F. Awwadi","Tris(propane-1,3-diamine)nickel(II) bis(tetrafluoroborate)","Acta Crystallographica Section E","2002","58","9","m471","m472","10.1107/S1600536802014113","","","0.71073","MoKα","","0.1529","0.0594","","","0.1088","0.1392","","","","","","1.002","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201444","9.5746","0.0009","11.347","0.001","29.241","0.003","90","","92.546","0.002","90","","3173.7","0.5","93","2","113","2","","","","","","","","4","P 1 21 1","P 2yb","4","TNBO","4,4,8,8-Tetranitro-2,6-dioxabicyclo[3.3.0]octane","","- C6 H6 N4 O10 -","- C6 H6 N4 O10 -","- C72 H72 N48 O120 -","12","6","CV6131","Flippen-Anderson, Judith L.; Deschamps, Jeffrey R.; George, Clifford; Gilardi, Richard D.","4,4,8,8-Tetranitro-2,6-dioxabicyclo[3.3.0]octane","Acta Crystallographica Section E","2002","58","9","o1018","o1020","10.1107/S1600536802014101","","","0.71073","MoKα","","0.061","0.049","","","0.121","0.13","","","","","","0.89","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201445","9.224","0.0008","15.2406","0.0009","9.2898","0.0008","90","","90","","90","","1305.95","0.18","213","2","213","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","10-Acetonyl-10-hydroxyphenanthren-9(10H)-one","","- C17 H14 O3 -","- C17 H14 O3 -","- C68 H56 O12 -","4","1","CV6132","Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Yan Zhang; Jian-Hua Xu","10-Acetonyl-10-hydroxyphenanthren-9(10<i>H</i>)-one","Acta Crystallographica Section E","2002","58","8","o956","o958","10.1107/S160053680201351X","","","0.71073","MoKα","","0.07","0.0551","","","0.1108","0.1168","","","","","","0.988","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201446","33.3452","0.0004","10.5753","0.0001","17.1597","0.0003","90","","110.05","","90","","5684.38","0.13","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(Acetylacetonato)bis(1,10'-phenanthroline-N,N')manganese(II) perchlorate","","- C29 H23 Cl Mn N4 O6 -","- C29 H23 Cl Mn N4 O6 -","- C232 H184 Cl8 Mn8 N32 O48 -","8","1","CV6133","Zhang, Xiaofeng; Huang, Deguang; Ma, Chengbing; Chen, Changneng; Liu, Qiutian","(Acetylacetonato)bis(1,10'-phenanthroline-<i>N</i>,<i>N</i>')manganese(II) perchlorate","Acta Crystallographica Section E","2002","58","9","m473","m475","10.1107/S1600536802014484","","","0.71073","MoKα","","0.11","0.064","","","0.155","0.191","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201447","5.282","0.004","11.241","0.003","22.588","0.006","79.65","0.02","89.67","0.04","76.58","0.03","1282.4","1.1","130","2","130","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H15 N O3 S -","- C13 H15 N O3 S -","- C52 H60 N4 O12 S4 -","4","2","CV6134","Gainsford, Graeme J.; Woolhouse, Anthony D.","<i>endo</i>-4-Phenyl-7-<i>n</i>-propyl-2-oxa-6-thia-3-azabicyclo[3.2.0^1,4^]hept-3-ene 6,6-dioxide","Acta Crystallographica Section E","2002","58","10","o1043","o1044","10.1107/S1600536802014666","","","0.71073","MoKα","","0.089","0.057","","","0.107","0.121","","","","","","1.16","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201448","13.261","0.005","7.185","0.002","9.735","0.003","90","","90","","90","","927.6","0.5","178","2","178","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Mesityldifluorophosphine","","- C9 H11 F2 P -","- C9 H11 F2 P -","- C36 H44 F8 P4 -","4","0.5","CV6135","Jones, Peter G.; Heuer, Lutz; Schmutzler, Reinhard","Difluoro(mesityl)phosphine","Acta Crystallographica Section E","2002","58","9","o999","o1000","10.1107/S160053680201423X","","","0.71073","MoKα","","0.0349","0.0299","","","0.0828","0.0873","","","","","","1.087","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201449","9.84","0.003","10.089","0.005","14.967","0.006","77.9","0.03","84.43","0.03","68.02","0.03","1347","1","178","2","178","2","","","","","","","","6","P -1","-P 1","2","","(Tetraphenyldiphosphinmonosulfide-P)pentacarbonylchromium(0)","","- C29 H20 Cr O5 P2 S -","- C29 H20 Cr O5 P2 S -","- C58 H40 Cr2 O10 P4 S2 -","2","1","CV6136","Jones, Peter G.; Fischer, Axel K.; Farkens, Michael; Schmutzler, Reinhard","Pentacarbonyl(tetraphenyldiphosphine monosulfide-<i>P</i>)chromium(0)","Acta Crystallographica Section E","2002","58","9","m478","m479","10.1107/S1600536802014125","","","0.71073","MoKα","","0.0594","0.0404","","","0.0967","0.108","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201450","14.4125","0.0007","7.4776","0.0004","20.3189","0.0007","90","","99.787","0.002","90","","2157.92","0.17","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(N,N-Dimethylamino)-4-[2,2-di(4-fluorophenyl)ehtenyl]-N-phenylmaleimide","","- C26 H20 F2 N2 O2 -","- C26 H20 F2 N2 O2 -","- C104 H80 F8 N8 O8 -","4","1","CV6137","Bao-Guo Zhao; Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Jian-Hua Xu","4-[2,2-Bis(4-fluorophenyl)ethenyl]-3-(<i>N,N</i>-dimethylamino)-<i>N</i>-phenylmaleimide","Acta Crystallographica Section E","2002","58","9","o1028","o1030","10.1107/S1600536802014769","","","0.71073","MoKα","","0.1387","0.0621","","","0.1326","0.1806","","","","","","0.889","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201451","13.1513","0.0004","9.7358","0.0003","16.996","0.0005","90","","95.859","0.001","90","","2164.77","0.11","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Benzoyl-3-(1,2-dioxo-2-phenylethyl)-3-phenyl-2-(pyridin-2-yl)oxirane","","- C28 H19 N O4 -","- C28 H19 N O4 -","- C112 H76 N4 O16 -","4","1","CV6138","Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Yun Li; Yan Zhang; Jian-Hua Xu","2-Benzoyl-3-(1,2-dioxo-2-phenylethyl)-3-phenyl-2-(pyridin-2-yl)oxirane","Acta Crystallographica Section E","2002","58","10","o1060","o1061","10.1107/S1600536802015350","","","0.71073","MoKα","","0.0965","0.066","","","0.1452","0.1555","","","","","","0.794","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201452","11.036","0.002","12.26","0.002","9.5764","0.0018","90","","113.851","0.004","90","","1185","0.4","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-Ethyl 3-acetamido-2-hexenoate","","- C10 H17 N O3 -","- C10 H17 N O3 -","- C40 H68 N4 O12 -","4","1","CV6140","Chen, Xuanhua; Guo, Rongwei; Zhou, Zhongyuan","(<i>E</i>)-Ethyl 3-acetamido-2-hexenoate","Acta Crystallographica Section E","2002","58","10","o1091","o1092","10.1107/S160053680201615X","","","0.71073","MoKα","","0.1345","0.0582","","","0.1402","0.1656","","","","","","1.092","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201453","11.555","0.002","15.3","0.003","11.072","0.002","90","","91.97","0.03","90","","1956.3","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","poly[Ammonium Zinc-μ-benzene-1,2,4,5- tetracarboxylato-octahydrate","","- C10 H26 N2 O16 Zn -","- C10 H10 N2 O16 Zn -","- C40 H40 N8 O64 Zn4 -","4","0.5","CV6141","Yan-Qiong Sun; Jie Zhang; Guo-Yu Yang","A nanoporous three-dimensional metal coordination polymer {(NH~4~)~2~Zn[C~6~H~2~(COO)~4~]·8H~2~O}~<i>n~</i>","Acta Crystallographica Section E","2002","58","10","m540","m542","10.1107/S1600536802015994","","","0.71073","MoKα","","0.0366","0.0324","","","0.0944","0.0974","","","","","","0.977","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201454","7.4455","0.0007","15.31","0.003","29.487","0.003","90","","90","","90","","3361.2","0.8","295","2","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C17 H16 Cl2 F N3 O2 -","- C17 H16 Cl2 F N3 O2 -","- C136 H128 Cl16 F8 N24 O16 -","8","1","CV6142","Özbey, Süheyla; Kaynak, F. Betül; Kus̨, Canan; Göker, Hakan","2-(2,4-Dichlorophenyl)-5-fluoro-6-morpholin-4-yl-1<i>H</i>-benzimidazole monohydrate","Acta Crystallographica Section E","2002","58","10","o1062","o1064","10.1107/S1600536802015842","","","0.71073","MoKα","","","0.0382","","","","0.1064","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201455","13.527","0.0003","16.1781","0.0003","16.3616","0.0004","90","","102.381","0.0009","90","","3497.32","0.13","291","1","291","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 N2 -","- C20 H20 N2 -","- C160 H160 N16 -","8","2","CV6143","Kolev, Tsonko; Yancheva, Denitsa; Schürmann, Markus; Kleb, Dirk-Christian; Preut, Hans; Spiteller, Michael","2-[5,5-Dimethyl-3-(2-<i>p</i>-tolyl-vinyl)-cyclohex-2-enylidene]-malononitrile","Acta Crystallographica Section E","2002","58","10","o1093","o1094","10.1107/S1600536802015891","","","0.71073","MoKα","","0.1838","0.0427","","","0.0708","0.0819","","","","","","0.96","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201456","8.89","0.001","10.97","0.002","17.714","0.001","90","","90.41","0.01","90","","1727.5","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3,5-dimethyl-2H-pyrazol-1-ium phosphonic acid diphenyl ester","","- C17 H19 N2 O4 P -","- C17 H19 N2 O4 P -","- C68 H76 N8 O16 P4 -","4","1","CV6144","Małecka, Magdalena; Rybarczyk-Pirek, Agnieszka; Grabowski, Sławomir J.; Malinowska, Katarzyna; Ochocki, Justyn","3,5-Dimethyl-2<i>H</i>-pyrazol-1-ium diphenylphosphate","Acta Crystallographica Section E","2002","58","10","o1113","o1115","10.1107/S1600536802016501","","","1.54178","CuKα","","0.0734","0.0481","","","0.1237","0.1297","","","","","","0.865","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201457","13.6624","0.001","5.6452","0.001","20.678","0.004","90","","93.46","0.04","90","","1591.9","0.4","183","2","183","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Erythro-2-piperidinyl-1,2-diphenyl ethanol","","- C19 H23 N O -","- C19 H23 N O -","- C76 H92 N4 O4 -","4","1","CV6145","Ocak, Nazan; Kazak, Canan; Öztürk, Sema; Zerrin, Caliskan; Arsu, Nergis; Fun, Hoong-Kun; Erdönmez, Ahmet","<i>erythro</i>-2-Piperidinyl-1,2-diphenylethanol","Acta Crystallographica Section E","2002","58","10","o1119","o1120","10.1107/S1600536802016513","","","0.71073","MoKα","","0.0816","0.0581","","","0.1273","0.1363","","","","","","0.81","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201458","8.893","0.001","7.478","0.001","16.582","0.002","90","","105.13","0.01","90","","1064.5","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","tetraaquomesaconatebarium(II)","","- C5 H12 Ba O8 -","- C5 H12 Ba O8 -","- C20 H48 Ba4 O32 -","4","1","CV6146","Alexander Briceño; José Miguel Delgado; Graciela Díaz de Delgado","The two-dimensional coordination polymer tetraaquamesaconatobarium(II), [Ba(C~5~H~4~O~4~)(OH~2~)~4~]~<i>n~</i>","Acta Crystallographica Section E","2002","58","10","m602","m605","10.1107/S1600536802017099","","","0.7107","MoKα","","0.0542","0.0464","","","0.1215","0.1325","","","","","","1.184","","","","has coordinates","189185","2020-10-21","18:00:00",""
"2201459","37.325","0.006","5.214","0.0006","7.8782","0.001","90","","96.073","0.013","90","","1524.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-Bromophenyl 2,3,4,5,6-pentabromophenyl ether","","- C12 H4 Br6 O -","- C12 H4 Br6 O -","- C48 H16 Br24 O4 -","4","1","CV6147","Eriksson, Lars; Hu, Jiwei","4-Bromophenyl 2,3,4,5,6-pentabromophenyl ether","Acta Crystallographica Section E","2002","58","10","o1147","o1149","10.1107/S1600536802016926","","","1.54184","CuKα","","0.127","0.065","","","0.0847","0.0924","","","","","","1.162","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201460","8.3607","0.0008","10.685","0.002","16.922","0.001","90.32","0.01","95.86","0.02","100.79","0.01","1476.8","0.3","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C20 H48 Co3 K4 Mo8 N4 O54 -","- C20 H48 Co3 K4 Mo8 N4 O54 -","- C20 H48 Co3 K4 Mo8 N4 O54 -","1","0.5","CV6148","Lee, Uk; Joo, Hea-Chung; Cho, Mi-Ae","Hexaaquacobalt(II) tetrapotassium diethylenediaminetetraacetato(4‒)cobaltate(III) β-octamolybdate hexahydrate","Acta Crystallographica Section E","2002","58","10","m599","m601","10.1107/S1600536802017385","","","0.71069","MoKα","","0.0557","0.0364","","","0.074","0.0852","","","","","","1.147","","","","has coordinates,has Fobs","189124","2020-10-21","18:00:00",""
"2201461","8.6832","0.0016","9.5662","0.0013","11.3595","0.0016","104.967","0.011","107.547","0.013","94.12","0.014","857.6","0.3","295","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H20 Cl N3 O -","- C18 H20 Cl N3 O -","- C36 H40 Cl2 N6 O2 -","2","1","CV6149","Özbey, Süheyla; Kendi, Engin; Karakurt, Arzu; Dalkara, Sevim","2-(Imidazol-1-yl)-1-(2-naphthyl)ethanone <i>O</i>-propyloxime hydrochloride","Acta Crystallographica Section E","2002","58","11","o1269","o1271","10.1107/S1600536802018962","","","0.71073","MoKα","","","0.0316","","","","0.0901","","","","","","1.015","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201462","8.057","0.001","11.145","0.002","11.408","0.001","68.918","0.007","71.859","0.008","70.345","0.009","878.8","0.2","295","2","295","2","","","","","","","","3","P -1","-P 1","2","","Methyl [5-methoxy-4-(3-methoxyphenyl)isochroman-3-yl]acetate","","- C20 H22 O5 -","- C20 H22 O5 -","- C40 H44 O10 -","2","1","CV6150","Palusiak, Marcin; Małecka, Magdalena; Grabowski, Sławomir J.; Epsztajn, Jan; Bieniek, Adam; Kowalska, Justyna A.","Methyl [5-methoxy-4-(3-methoxyphenyl)isochroman-3-yl]acetate","Acta Crystallographica Section E","2002","58","11","o1188","o1189","10.1107/S1600536802017919","","","1.54178","CuKα","","0.1062","0.0547","","","0.1455","0.157","","","","","","0.871","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201463","17.181","0.003","15.313","0.003","26.386","0.005","90","","90","","90","","6942","2","293","2","293","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","Bis[μ-bis(diphenylphosphino)amine-κP:P']bis[acetonitrilesiliver(I)] tris(cis-1,2-dicyanoethylene 1,2-dithiolate)molybdenate(IV)","","- C64 H48 Ag2 Mo N10 P4 S6 -","- C64 H48 Ag2 Mo N10 P4 S6 -","- C256 H192 Ag8 Mo4 N40 P16 S24 -","4","0.5","CV6151","Xu, Hong-Wu; Chen, Zhong-Ning; Wu, Ji-Gui","Bis[μ-bis(diphenylphosphino)amine-κ<i>P</i>:<i>P</i>']bis[acetonitrilesilver(I)] tris(<i>cis</i>-1,2-dicyanoethylene-1,2-dithiolate)molybdate(IV)","Acta Crystallographica Section E","2002","58","11","m631","m633","10.1107/S1600536802018408","","","0.71073","MoKα","","0.1322","0.063","","","0.1092","0.135","","","","","","1.165","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2201464","21.372","0.003","14.705","0.004","7.211","0.002","90","","90","","90","","2266.2","0.9","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C11 H13 N3 O2 -","- C11 H13 N3 O2 -","- C88 H104 N24 O16 -","8","1","CV6152","Shang Shan; Duan-Jun Xu; Jing-Yun Wu; Michael Y. Chiang","Cyclopentanone 4-nitrophenylhydrazone","Acta Crystallographica Section E","2002","58","11","o1218","o1219","10.1107/S160053680201841X","","","0.71073","MoKα","","0.1762","0.0492","","","0.141","0.1972","","","","","","0.997","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201465","5.9625","0.0012","8.0026","0.0016","11.388","0.002","99.24","0.03","102.01","0.03","94.91","0.03","520.6","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","[Pt(μ-Cl)Ph(dmso)]~2~","trans-Di-μ-chloro-bis[(dimethyl sulfoxideκO)phenylplatinum(II)]","","- C16 H22 Cl2 O2 Pt2 S2 -","- C16 H22 Cl2 O2 Pt2 S2 -","- C16 H22 Cl2 O2 Pt2 S2 -","1","0.5","CV6153","Patrik Nilsson; Ola F. Wendt","<i>trans</i>-Di-μ-chloro-bis[(dimethyl sulfoxide-κ<i>S</i>)phenylplatinum(II)]","Acta Crystallographica Section E","2002","58","11","m639","m640","10.1107/S1600536802018421","","","0.71073","MoKα","","0.0593","0.0467","","","0.1136","0.1198","","","","","","0.996","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201466","10.3827","0.0001","14.5395","0.0002","17.3675","0.0001","105.145","0.001","102.943","0.001","98.9522","0.0005","2401.69","0.05","183","2","183","2","","","","","","","","4","P -1","-P 1","2","","1,3,3,4,4-Pentaphenyl-β-lactam","","- C33 H25 N O -","- C33 H25 N O -","- C132 H100 N4 O4 -","4","2","CV6154","Anwar Usman; Hoong-Kun Fun; Jing-Zhi Tian; Yan Zhang; Jian-Hua Xu","1,3,3,4,4-Pentaphenyl-β-lactam","Acta Crystallographica Section E","2002","58","11","o1318","o1320","10.1107/S1600536802018974","","","0.71073","MoKα","","0.1361","0.105","","","0.2463","0.266","","","","","","0.961","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201467","11.282","0.002","11.482","0.002","11.702","0.002","114.22","0.01","97.44","0.01","101.93","0.01","1313","0.4","150","2","150","2","","","","","","","","3","P -1","-P 1","2","2-norbornene-exo-cis-5,6-dicarboxylic acid","bicyclo[2.2.1]hept-2-ene-exo-cis-5,6-dicarboxylic acid","","- C9 H10 O4 -","- C9 H9.94667 O4 -","- C54 H59.68 O24 -","6","3","CV6155","Batsanov, Andrei S.; Hesselink, Joanna L.","2-Norbornene-<i>exo</i>-<i>cis</i>-5,6-dicarboxylic acid","Acta Crystallographica Section E","2002","58","11","o1272","o1274","10.1107/S1600536802018986","","","0.71073","MoKα","","0.0674","0.0487","","","0.0908","0.1023","","","","","","1.122","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201468","10.289","0.002","15.723","0.003","11.59","0.002","90","","90","","90","","1875","0.6","293","2","293","2","","","","","","","","5","C c c a :2","-C 2a 2ac","68","","","","- C6 H17 Cl N O0.5 -","- C6 H17 Cl N O0.5 -","- C48 H136 Cl8 N8 O4 -","8","0.5","CV6156","Guido J. Reiß; Brigitte Koppelhuber-Bitschnau","Diisopropylammonium chloride hemihydrate, a combined single-crystal and powder diffraction study","Acta Crystallographica Section E","2002","58","11","o1309","o1311","10.1107/S1600536802019347","","","0.71073","MoKα","","0.0595","0.0433","","","0.0954","0.0995","","","","","","1.094","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201469","15.327","0.002","11.503","0.002","10.643","0.002","90","","107.57","0.01","90","","1788.9","0.5","295","2","295","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","norbornane-exo-cis-2,3-dicarboxylic acid","bicyclo[2.2.1]heptane-exo-cis-2,3-dicarboxylic acid","","- C9 H12 O4 -","- C9 H12 O4 -","- C72 H96 O32 -","8","1","CV6157","Batsanov, Andrei S.; Hesselink, Joanna L.","Norbornane-<i>exo</i>-<i>cis</i>-2,3-dicarboxylic acid","Acta Crystallographica Section E","2002","58","11","o1275","o1276","10.1107/S1600536802019086","","","0.71073","MoKα","","0.0588","0.0444","","","0.1004","0.1131","","","","","","1.101","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201470","20.737","0.005","9.31","0.002","9.003","0.002","90","","92.59","0.01","90","","1736.4","0.7","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","norbornane-endo-cis-2,3-dicarboxylic acid","bicyclo[2.2.1]heptane-endo-cis-2,3-dicarboxylic acid","","- C9 H12 O4 -","- C9 H12 O4 -","- C72 H96 O32 -","8","2","CV6158","Batsanov, Andrei S.; Hesselink, Joanna L.; née Megson","Norbornane-<i>endo</i>-<i>cis</i>-2,3-dicarboxylic acid","Acta Crystallographica Section E","2002","58","12","o1325","o1327","10.1107/S1600536802019736","","","0.71073","MoKα","","0.0711","0.0487","","","0.1065","0.1232","","","","","","1.143","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201471","12.698","0.001","5.3906","0.0003","12.153","0.001","90","","92.56","0.01","90","","831.04","0.11","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2-norbornene-trans-5,6-dicarboxylic acid","bicyclo[2.2.1]hept-2-ene-trans-5,6-dicarboxylic acid","","- C9 H10 O4 -","- C9 H10 O4 -","- C36 H40 O16 -","4","1","CV6159","Batsanov, Andrei S.; Hesselink, Joanna L.; née Megson","2-Norbornene-<i>exo,endo</i>-5,6-dicarboxylic acid","Acta Crystallographica Section E","2002","58","12","o1328","o1329","10.1107/S1600536802019761","","","0.71073","MoKα","","0.0605","0.0449","","","0.0952","0.1057","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201472","12.152","0.001","19.192","0.002","13.797","0.001","90","0.001","95.961","0.001","90","0.001","3200.4","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H32 Cl2 N8 Ni O4 -","- C24 H32 Cl2 N8 Ni O4 -","- C96 H128 Cl8 N32 Ni4 O16 -","4","1","DN6030","Sbai, F.; Chkirate, K.; Regragui, R.; Essassi, E. M.; Pierrot, M.","Diaquabis{2-[(5-méthylpyrazol-3-yl)méthyl]benzimidazole}nickel(II) dichloride dihydrate","Acta Crystallographica Section E","2002","58","7","m337","m339","10.1107/S1600536802009868","","","0.71073","MoKα","","0.0397","0.0349","","","0.1119","0.1157","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201473","15.334","0.003","5.606","0.002","20.45","0.002","90","0.01","107.2","0.02","90","0.01","1679.3","0.7","293","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","N',N'-Dibenzylsulfamide-N-(2-bromoethyl)","","- C16 H19 Br N2 O2 S -","- C16 H19 Br N2 O2 S -","- C64 H76 Br4 N8 O8 S4 -","4","1","DN6032","Benali-Cherif, Nourredine; Dokhane, Sohere; Abdaoui, Mohamed","<i>N</i>',<i>N</i>'-Dibenzyl-<i>N</i>-(2-bromoéthyl)sulfamide","Acta Crystallographica Section E","2002","58","7","o723","o725","10.1107/S1600536802009492","","","0.71073","Mokα","","0.1789","0.0392","","","0.0809","0.108","","","","","","0.911","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201474","8.514","0.003","15.212","0.005","10.26","0.003","90","","99.31","0.03","90","","1311.3","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(2-isopropyl-1-methyl-cyclopropanesulfonyl)-benzene","","- C13 H18 O2 S -","- C13 H18 O2 S -","- C52 H72 O8 S4 -","4","1","DN6033","Guido J. Reiß; Marek Masnyk","(2-Isopropyl-1,1-methylcyclopropanesulfonyl)benzene","Acta Crystallographica Section E","2002","58","7","o799","o801","10.1107/S1600536802011108","","","0.71073","MoKα","","0.0546","0.0501","","","0.0869","0.0895","","","","","","1.02","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201475","13.8685","0.001","8.6075","0.001","25.233","0.002","90","","90","","90","","3012.1","0.5","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","2-(2,4-Dibromophenylamino)-7-nitrobenzisoselenazol-3-one","","- C13 H7 Br2 N3 O3 Se -","- C13 H7 Br2 N3 O3 Se -","- C104 H56 Br16 N24 O24 Se8 -","8","1","DN6034","Dupont, Léon; Messali, Mouslim; Christiaens, Léon; Evrard, Guy","2-(2,4-Dibromophenylamino)-7-nitrobenzisoselenazol-3-one","Acta Crystallographica Section E","2002","58","8","o828","o830","10.1107/S1600536802011716","","","1.54178","CuKα","","0.0422","0.0329","","","0.081","0.085","","","","","","1.103","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2201476","5.481","0.0002","8.286","0.0005","25.535","0.0001","90","0.02","90","0.01","90","0.01","1159.69","0.08","293","","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","L-histidinium binitrate","","","- C6 H11 N5 O8 -","- C6 H11 N5 O8 -","- C24 H44 N20 O32 -","4","1","DN6035","Benali-Cherif, Nourredine; Benguedouar, Lamia; Cherouana, Aouatef; Bendjeddou, Lamia; Merazig, Hocine","<small>L</small>-Histidinium dinitrate","Acta Crystallographica Section E","2002","58","8","o822","o824","10.1107/S1600536802011625","","","0.71073","MoKα","","0.0409","0.0364","","","0.0869","0.0905","","","","","","1.086","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201477","6.72","0.001","6.72","0.001","54.33","0.009","90","","90","","120","","2124.8","0.6","293","2","293","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","Bis(2-methyl-2-propanammonium) chromate","","- C8 H24 Cr N2 O4 -","- C8 H24 Cr N2 O4 -","- C48 H144 Cr6 N12 O24 -","6","0.166667","DN6036","Chebbi, Hammouda; Driss, Ahmed","Bis(2-methyl-2-propanammonium) chromate","Acta Crystallographica Section E","2002","58","9","m494","m496","10.1107/S1600536802012412","","","0.71073","MoKα","","0.065","0.0363","","","0.0837","0.0905","","","","","","1.371","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201478","9.6492","0.0008","16.4487","0.0009","21.6012","0.0017","90","","92.583","0.01","90","","3425","0.4","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","undecacarbonyl-tri-μ-hydrido-(tricyclohexylphosphine)trirutheniumcobalt","","- C29 H36 Co O11 P Ru3 -","- C29 H36 Co O11 P Ru3 -","- C116 H144 Co4 O44 P4 Ru12 -","4","1","DN6037","Lozano Diz, Enrique; Therrien, Bruno; Süss-Fink, Georg","A new heteronuclear trirutheniumcobalt cluster containing a bulky phosphine ligand, [CoRu~3~(μ-H)~3~(μ-CO)(CO)~10~(PCy~3~)]","Acta Crystallographica Section E","2002","58","8","m451","m453","10.1107/S1600536802013387","","","0.71073","MoKα","","0.0487","0.0356","","","0.0865","0.0907","","","","","","0.917","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2201479","10.733","0.0005","12.6853","0.0005","14.0824","0.0005","90","","105.875","0.003","90","","1844.21","0.13","298","","298","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H17 N3 O3 -","- C21 H17 N3 O3 -","- C84 H68 N12 O12 -","4","2","DN6038","Evain, Michel; Pauvert, Mickaël; Collet, Sylvain; Guingant, Andre","A chiral oxazolidin-2-one-derived Reissert compound","Acta Crystallographica Section E","2002","58","10","o1121","o1122","10.1107/S1600536802016677","","","0.71069","MoKα","","0.0426","0.0352","","","0.0824","0.0848","","","","","","1.57","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201480","6.1205","0.0001","16.1195","0.0004","22.9272","0.0006","90","","90","","90","","2261.98","0.09","150","","150","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H26 N2 O7 S -","- C22 H26 N2 O7 S -","- C88 H104 N8 O28 S4 -","4","1","DN6039","Evain, Michel; Collet, Sylvain; Guingant, Andre","A chiral 3,4-dihydro-2<i>H</i>-thiopyran compound","Acta Crystallographica Section E","2002","58","10","o1123","o1124","10.1107/S1600536802016689","","","0.71069","MoKα","","0.0668","0.0426","","","0.0804","0.0877","","","","","","1.23","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201481","9.825","0.001","10.999","0.001","12.095","0.001","91.56","0.01","109.22","0.01","109.37","0.01","1150.6","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N-Éthyl-N-[2-(3-phénylisoxazol-5-ylméthylamino)phényl]benzylacétamide","","- C27 H27 N3 O2 -","- C27 H27 N3 O2 -","- C54 H54 N6 O4 -","2","1","DN6040","Essassi, E. M.; Tene Ghomsi, J. N.; Ahabchane, N. H.; Pierrot, M.","<i>N</i>-Éthyl-<i>N</i>-[2-(3-phénylisoxazol-5-ylméthylamino)phényl]benzylacétamide","Acta Crystallographica Section E","2002","58","11","o1304","o1305","10.1107/S1600536802019426","","","0.71073","MoKα","","0.0913","0.0717","","","0.1679","0.1847","","","","","","1.074","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201482","8.935","0.0004","10.277","0.0003","21.764","0.0003","90","0.003","90","0.002","90","0.002","1998.48","0.11","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Diglycinium sulfate","","","- C4 H12 N2 O8 S -","- C4 H12 N2 O8 S -","- C32 H96 N16 O64 S8 -","8","1","DN6041","Cherouana, Aouatef; Benali-Cherif, Nourredine; Bendjeddou, Lamia; Merazig, Hocine","Diglycinium sulfate","Acta Crystallographica Section E","2002","58","12","o1351","o1353","10.1107/S1600536802019785","","","0.71073","MoKα","","0.0368","0.0341","","","0.0975","0.0975","","","","","","1.097","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201483","6.634","0.0004","11.98","0.0005","15.804","0.0003","90","","91.01","0.02","90","","1255.83","0.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Guaninium dinitrate dihydrate","","","- C5 H11 N7 O9 -","- C5 H11 N7 O9 -","- C20 H44 N28 O36 -","4","1","DN6043","Bouchouit, Karim; Benali-Cherif, Nourredine; Benguedouar, Lamia; Bendheif, Leulmi; Merazig, Hocine","Guaninium dinitrate dihydrate","Acta Crystallographica Section E","2002","58","12","o1397","o1399","10.1107/S1600536802020676","","","0.71073","MoKα","","0.0527","0.045","","","0.118","0.1241","","","","","","1.074","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201484","7.7607","0.0002","8.9488","0.0002","14.7723","0.0004","75.4549","0.001","79.0465","0.0011","69.9378","0.0011","926.68","0.04","291","1","291","1","","","","","","","","4","P -1","-P 1","2","","","","- C21 H22 N2 O2 -","- C21 H22 N2 O2 -","- C42 H44 N4 O4 -","2","1","FL6000","Kolev, Tsonko; Schürmann, Markus; Kleb, Dirk-Christian; Preut, Hans; Spiteller, Michael","2-{3-[2-(2,4-Dimethoxyphenyl)vinyl]-5,5-dimethylcyclohex-2-enylidene}malononitrile","Acta Crystallographica Section E","2002","58","10","o1172","o1173","10.1107/S1600536802017622","","","0.71073","MoKα","","0.1157","0.0407","","","0.088","0.1028","","","","","","0.865","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201485","12.311","0.002","6.788","0.002","14.222","0.002","90","","90","","90","","1188.5","0.4","299","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C12 H11 Cl N2 O2 -","- C12 H11 Cl N2 O2 -","- C48 H44 Cl4 N8 O8 -","4","0.5","FL6001","Ohba, Shigeru; Matsuura, Keisuke; Suzuki, Tamotsu; Chida, Noritaka","2-Chloro-4-(4-methoxybenzyloxy)pyrimidine","Acta Crystallographica Section E","2002","58","11","o1200","o1201","10.1107/S160053680201797X","","","0.7107","MoKα","","","0.1412","","","","0.417","","","","","","1.785","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201486","7.276","0.002","11.808","0.002","10.317","0.002","90","","94.99","0.03","90","","883","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","trans-Dibromobis(1,3,5-triaza-7-phosphaadamantane)palladium(II)","","- C12 H24 Br2 N6 P2 Pd -","- C12 H24 Br2 N6 P2 Pd -","- C24 H48 Br4 N12 P4 Pd2 -","2","0.5","FL6002","Meij, Anna M. M.; Stefanus Otto; Andreas Roodt","<i>trans</i>-Dibromobis(1,3,5-triaza-7-phosphaadamantane-κ<i>P</i>)palladium(II)","Acta Crystallographica Section E","2002","58","11","m644","m646","10.1107/S1600536802018330","","","0.71073","MoKα","","0.0779","0.0392","","","0.0758","0.0843","","","","","","0.942","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201487","10.5187","0.001","11.668","0.0015","11.402","0.001","90","","99.793","0.011","90","","1379","0.3","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","[RuCl~2~(η^6^-indane)]~2~ dichloroform solvate","","- C20 H22 Cl10 Ru2 -","- C20 H22 Cl10 Ru2 -","- C40 H44 Cl20 Ru4 -","2","0.5","FL6003","Vieille-Petit, Ludovic; Therrien, Bruno; Süss-Fink, Georg","Bis[dichloro-η^6^-indaneruthenium(II)] dichloroform solvate","Acta Crystallographica Section E","2002","58","11","m656","m657","10.1107/S1600536802018676","","","0.71073","MoKα","","0.0381","0.0315","","","0.0761","0.0885","","","","","","1.107","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2201488","13.3711","0.001","6.3641","0.0005","14.5826","0.0011","90","","95.535","0.002","90","","1235.12","0.16","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H13 Hg N S2 -","- C11 H13 Hg N S2 -","- C44 H52 Hg4 N4 S8 -","4","1","FL6004","Lai, Chian Sing; Tiekink, Edward R. T.","Phenyl(pyrrolinedithiocarbamato)mercury(II)","Acta Crystallographica Section E","2002","58","11","m674","m675","10.1107/S1600536802019372","","","0.71069","MoKα","","0.047","0.042","","","0.104","0.108","","","","","","1.04","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201489","6.0194","0.0007","7.2183","0.0008","42.384","0.004","85.527","0.005","88.81","0.004","87.88","0.004","1834.4","0.3","91","2","91","2","","","","","","","","5","P -1","-P 1","2","dioxazocanium iodide","2,6-Dimethyl-6-tetradecyl-2-tetradecyloxy-[1,3,6]dioxazocan-6-ium iodide","","- C35 H72 I N O3 -","- C35 H72 I N O3 -","- C70 H144 I2 N2 O6 -","2","1","FL6005","Marilyn M. Olmstead; Kolbot By; Michael H. Nantz","A long thin molecule, 2,6-dimethyl-6-tetradecyl-2-tetradecyloxy-1,3,6-dioxazocan-6-ium iodide","Acta Crystallographica Section E","2002","58","11","o1323","o1324","10.1107/S1600536802019554","","","0.71073","MoKα","","0.0475","0.0375","","","0.0808","0.0838","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201490","20.99","0.01","10.14","0.005","20.24","0.01","90","","114.215","0.007","90","","3929","3","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15 H26 N2 O7 V -","- C15 H26 N2 O7 V -","- C120 H208 N16 O56 V8 -","8","1","FL6006","Sara L. Raishbrook; Peter Turner; Rachel Codd","A potential synthon for models of vanadium haloperoxidase: (3,5-dimethylpyrazole)bis[2-hydroxy-2-methylbutanoato(1‒)]oxovanadium(IV)","Acta Crystallographica Section E","2002","58","12","m737","m739","10.1107/S1600536802020937","","","0.71073","MoKα","","0.0668","0.0539","","","0.1359","0.144","","","","","","1.485","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201491","6.4729","0.0013","7.0928","0.0014","7.2643","0.0014","115.138","0.004","94.921","0.004","109.954","0.004","273.16","0.09","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C10 H10 F4 Ge N2 -","- C10 H10 F4 Ge N2 -","- C10 H10 F4 Ge N2 -","1","0.5","FL6007","Tran, Dat T.; Zavalij, Peter Y.; Oliver, Scott R. J.","Tetrafluorodipyridinegermanium, [GeF~4~(C~5~H~5~N)~2~]","Acta Crystallographica Section E","2002","58","12","m742","m743","10.1107/S1600536802020408","","","0.71073","MoKα","","0.0517","0.0386","","","0.0492","0.0515","","","","","","0.769","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201492","12.3595","0.0001","12.3595","0.0001","31.1411","0.0004","90","","90","","120","","4119.71","0.07","150","1","150","1","","","","","","","","4","P 31","P 31","144","","(1R*,2R*)-2-(Methylphenylamino)-1,2-dihydronaphthalen-1-ol‒water (4/1)","","- C68 H70 N4 O5 -","- C68 H70 N4 O5 -","- C204 H210 N12 O15 -","3","1","FL6009","Fagnou, Keith; Lautens, Mark; Lough, Alan J.","(1<i>R</i>*,2<i>R</i>*)-2-(Methylphenylamino)-1,2-dihydronaphthalen-1-ol‒water (4/1)","Acta Crystallographica Section E","2002","58","12","o1449","o1451","10.1107/S1600536802021608","","","0.71073","MoKα","","0.044","0.0368","","","0.0864","0.0901","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201493","9.3592","0.0013","11.8691","0.0018","12.6669","0.0017","79.393","0.017","87.314","0.017","68.106","0.016","1282.9","0.4","160","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H22 O9 Ru3 Si -","- C20 H22 O9 Ru3 Si -","- C40 H44 O18 Ru6 Si2 -","2","1","LH6000","Delgado, E.; Donnadieu, B.; Hernandez, E.; Paz Martin, M.; Zamora, F.","Nonacarbonyl-μ-hydrido-(μ^3^,η^2^-triisopropylsilylethynyl)triruthenium","Acta Crystallographica Section E","2002","58","10","m571","m573","10.1107/S1600536802016768","","","0.71069","MoKα","","","0.0199","","","","0.0541","","","","","","1.132","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201494","3.893","0.0002","10.8743","0.0005","20.6378","0.0008","90","","91.335","0.004","90","","873.44","0.07","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Amino-6-nitrobenzo-1,3-thiazole hydrate","","- C7 H7 N3 O3 S -","- C7 H7 N3 O3 S -","- C28 H28 N12 O12 S4 -","4","1","LH6001","Lynch, Daniel E.","2-Amino-6-nitrobenzo-1,3-thiazole hydrate","Acta Crystallographica Section E","2002","58","10","o1139","o1141","10.1107/S1600536802016938","","","0.71073","MoKα","","0.0498","0.0391","","","0.0986","0.1053","","","","","","1.135","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201495","13.228","0.003","11.754","0.006","18.659","0.005","90","","119.05","0.02","90","","2536.2","1.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-Sulfonylbis(2-benzoyl-3-phenyloxirane)","","- C30 H22 O6 S -","- C30 H22 O6 S -","- C120 H88 O24 S4 -","4","1","LH6002","Krishnakumar, R. V.; Subha Nandhini, M.; Renuga, S.; Natarajan, S.; Selvaraj, S.; Perumal, S.","2,2'-Sulfonylbis(2-benzoyl-3-phenyloxirane)","Acta Crystallographica Section E","2002","58","10","o1174","o1176","10.1107/S1600536802017634","","","1.5418","CuKα","","0.1291","0.0842","","","0.1863","0.2212","","","","","","1.118","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201496","10.9572","0.0005","11.5226","0.0006","12.0697","0.0011","96.159","0.005","96.421","0.007","113.044","0.004","1374.33","0.17","198","2","198","2","","","","","","","","6","P -1","-P 1","2","","Bis[μ-bis(4-nitrophenyl) phosphate-κ^2^O:O]bis[(4,4'-dimethyl-2,2'-bipyridine)nitratocopper(II)]","","- C48 H40 Cu2 N10 O22 P2 -","- C48 H40 Cu2 N10 O22 P2 -","- C48 H40 Cu2 N10 O22 P2 -","1","0.5","LH6003","Deschamps, Jeffrey R.; Hartshorn, Christopher M.; Chang, Eddie L.","Bis[μ-bis(4-nitrophenyl) phosphato-κ^2^<i>O</i>:<i>O</i>]bis[(4,4'-dimethyl-2,2'-bipyridine)nitratocopper(II)]","Acta Crystallographica Section E","2002","58","10","m606","m608","10.1107/S1600536802017671","","","1.54178","CuKα","","0.0439","0.0359","","","0.0906","0.0958","","","","","","1.069","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201497","8.71","0.004","9.92","0.005","12.385","0.005","102.35","0.03","108.33","0.02","96.68","0.03","972.7","0.8","150","2","150","2","","","","","","","","4","P -1","-P 1","2","paracetamol‒morpholine (1/2.5)","N-(4-hydroxyphenyl)acetamide‒morpholine (1/2.5)","","- C18 H31.5 N3.5 O4.5 -","- C18 H31.5 N3.5 O4.5 -","- C36 H63 N7 O9 -","2","1","LH6004","Oswald, Iain D. H.; Motherwell, W. D. Sam; Parsons, Simon; Pulham, Colin R.","A paracetamol‒morpholine adduct","Acta Crystallographica Section E","2002","58","11","o1290","o1292","10.1107/S1600536802018111","","","1.54184","CuKα","","0.1159","0.0538","","","0.1455","0.1782","","","","","","1.031","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2201498","12.7798","0.0009","14.4877","0.001","16.5149","0.0012","66.858","0.002","86.916","0.002","85.396","0.002","2801.8","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","N-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-N-(2,4,6- trimethylbenzyl)-p-toluenesulfonamide","","- C29 H36 B N O4 S -","- C29 H36 B N O4 S -","- C116 H144 B4 N4 O16 S4 -","4","2","LH6005","Decken, Andreas; Singh, Ameet; Vogels, Christopher M.; Westcott, Stephen A.","A novel sulfonamide containing a boronate ester group","Acta Crystallographica Section E","2002","58","11","o1213","o1214","10.1107/S1600536802018123","","","0.71073","MoKα","","0.0907","0.0533","","","0.141","0.1541","","","","","","0.953","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201499","5.3906","0.001","5.3906","0.001","40.964","0.015","90","","90","","120","","1030.9","0.5","293","2","293","2","","","","","","","","5","P 32 2 1","P 32 2""","154","","S,S'-(But-2-yne-1,4-diyl)bis(L-cysteine) monohydrate","","- C10 H18 N2 O5 S2 -","- C10 H18 N2 O5 S2 -","- C30 H54 N6 O15 S6 -","3","0.5","LH6006","Shi, Yun-Mei; Zhang, Wen-Qin","<i>S,S</i>'-(But-2-yne-1,4-diyl)bis(<small>L</small>-cysteine) monohydrate","Acta Crystallographica Section E","2002","58","12","o1455","o1457","10.1107/S1600536802021487","","","0.71073","MoKα","","0.0611","0.0428","","","","0.0941","","","","","","0.985","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201500","6.592","0.004","12.029","0.007","8.326","0.005","90","","96.114","0.011","90","","656.5","0.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C4 H14 Br4 N2 Sn -","- C4 H14 Br4 N2 Sn -","- C8 H28 Br8 N4 Sn2 -","2","0.5","LH6007","Ritter III, Cole; Groy, Thomas L.; Kouvetakis, John","<i>trans</i>-Tetrabromobis(dimethylamine)tin","Acta Crystallographica Section E","2002","58","11","m684","m685","10.1107/S160053680201927X","","","0.71073","MoKα","","0.0302","0.0255","","","0.0633","0.0651","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201501","10.567","0.001","11.053","0.001","15.438","0.001","105.559","0.002","97.496","0.002","101.637","0.002","1668.5","0.2","168","2","168","2","","","","","","","","6","P -1","-P 1","2","","Aquatriphenyl(trifluoroacetato)tin‒2,4,6-tris(2-pyridyl)-1,3,5-triazine (1/1)","","- C38 H29 F3 N6 O3 Sn -","- C38 H29 F3 N6 O3 Sn -","- C76 H58 F6 N12 O6 Sn2 -","2","1","LH6008","Chee, Chin Fei; Lo, Kong Mun; Ng, Seik Weng","Aquatriphenyl(trifluoroacetato)tin‒2,4,6-tris(2-pyridyl)-1,3,5-triazine (1/1)","Acta Crystallographica Section E","2002","58","11","m661","m662","10.1107/S1600536802019001","","","0.71073","MoKα","","0.059","0.04","","","0.092","0.095","","","","","","0.93","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201502","9.8277","0.0001","12.0717","0.0003","12.6885","0.0001","90","","93.162","0.002","90","","1503.03","0.04","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H14 Cl2 N2 O2 Pd -","- C13 H14 Cl2 N2 O2 Pd -","- C52 H56 Cl8 N8 O8 Pd4 -","4","1","LH6009","Jian-Kai Cheng; Zhao-Ji Li; Yao Kang; Yu-Biao Chen; Ye-Yan Qin; Yi-Hang Wen; Yuan-Gen Yao","Dichloro[2,2'-hydroxy(ethoxy)methylenedipyridine-κ^2^<i>N,N</i>']palladium(II)","Acta Crystallographica Section E","2002","58","12","m768","m769","10.1107/S1600536802021281","","","0.71073","MoKα","","0.0406","0.0321","","","0.0724","0.0783","","","","","","1.147","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201503","6.8104","0.0013","7.1777","0.0014","12.458","0.003","74.713","0.003","78.365","0.004","67.939","0.003","540.8","0.2","153","2","153","2","","","","","","","","3","P -1","-P 1","2","","Methyl 4-oxahept-1,6-diene-2,6-dicarboxylate","","- C10 H14 O5 -","- C10 H14 O5 -","- C20 H28 O10 -","2","1","LH6010","Flörke, Ulrich; Röder, Thorsten; Kramer, Thomas","Methyl 4-oxahepta-1,6-diene-2,6-dicarboxylate","Acta Crystallographica Section E","2002","58","12","o1343","o1344","10.1107/S1600536802019839","","","0.71073","MoKα","","0.0465","0.039","","","0.1102","0.1155","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201504","7.447","0.002","13.657","0.004","9.642","0.002","90","","94.19","0.01","90","","978","0.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Dicyanodurene‒p-tetrafluorodiiodobenzene (1/1)","2,3,5,6-tetramethyl-1,4-benzodicarbonitrile‒2,3,5,6-tetrafluoro-1,4- diiodobenzene (1/1)","","- C18 H12 F4 I2 N2 -","- C18 H12 F4 I2 N2 -","- C36 H24 F8 I4 N4 -","2","0.5","LH6011","Britton, Doyle; Gleason, William B.","Dicyanodurene‒<i>p</i>-tetrafluorodiiodobenzene (1/1)","Acta Crystallographica Section E","2002","58","12","o1375","o1377","10.1107/S1600536802019943","","","0.71073","MoKα","","0.034","0.026","","","0.069","0.073","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201505","7.439","0.001","24.387","0.004","9.196","0.001","90","","105.76","0.01","90","","1605.6","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Di-μ-chloro-bis[(2,2':6,2''-terpyridine)copper(II)] diperchlorate","","- C30 H22 Cl4 Cu2 N6 O8 -","- C30 H22 Cl4 Cu2 N6 O8 -","- C60 H44 Cl8 Cu4 N12 O16 -","2","0.5","LH6012","Valdés-Martínez, Jesús; Salazar-Mendoza, Domingo; Toscano, Rubén A.","Di-μ-chloro-bis[(2,2':6,2''-terpyridine)copper(II)] diperchlorate","Acta Crystallographica Section E","2002","58","12","m712","m714","10.1107/S1600536802020470","","","0.71073","MoKα","","0.1045","0.0602","","","0.142","0.1726","","","","","","1.072","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201506","9.424","0.001","9.482","0.001","9.668","0.001","97.08","","93.7","","93.36","","853.61","0.16","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","Ammine[2-hydroxy-1-naphthaldehyde 4-piperidylthiosemicarbazonato]nickel(II)","","- C17 H20 N4 Ni O S -","- C17 H20 N4 Ni O S -","- C34 H40 N8 Ni2 O2 S2 -","2","1","LH6013","Valdés-Martínez, Jesús; Hernández-Ortega, Simón; Bautista Jimenez, Victor","Ammine[2-hydroxy-1-naphthaldehyde 4-piperidylthiosemicarbazonato]nickel(II)","Acta Crystallographica Section E","2002","58","12","m710","m711","10.1107/S1600536802020184","","","0.71073","MoKα","","0.0581","0.0417","","","0.0999","0.1099","","","","","","1.004","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201507","12.7116","0.0003","12.4934","0.0003","14.3478","0.0003","90","","90","","90","","2278.59","0.09","291","1","291","1","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C11 H32 Cl2 N3 O P Sn2 -","- C11 H32 Cl2 N3 O P Sn2 -","- C44 H128 Cl8 N12 O4 P4 Sn8 -","4","0.5","LH6014","Mandolesi,Sandra; Schürmann, Markus; Preut, Hans; Mitchell, Terence","A 1:1 adduct between bis(chlorodimethylstannyl)methane and hexamethylphosphoric acid triamide (HMPA)","Acta Crystallographica Section E","2002","58","12","m740","m741","10.1107/S1600536802021001","","","0.71073","MoKα","","0.052","0.0275","","","0.057","0.0629","","","","","","0.963","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201508","12.091","0.003","7.658","0.001","13.784","0.002","90","","108.57","0.01","90","","1209.9","0.4","293","2","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C11 H14 O7 -","- C11 H14 O7 -","- C44 H56 O28 -","4","1","LH6015","Luck, Rudy L.; Mendenhall, G. David","(2-Ethoxycarbonyl-3,5-dihydroxyphenyl)acetic acid monohydrate, an intermediate in the Pechmann reaction","Acta Crystallographica Section E","2002","58","12","o1387","o1388","10.1107/S1600536802020627","","","0.71073","MoKα","","","0.045","","","","0.113","","","","","","1.008","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201509","5.79","0.001","16.655","0.003","15.782","0.003","90","","98.07","0.02","90","","1506.8","0.5","293","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H18 Li O3 P -","- C16 H18 Li O3 P -","- C64 H72 Li4 O12 P4 -","4","1","LH6016","Kongprakaiwoot, Natcharee; Luck, Rudy L.; Urnezius, Eugenijus","Polymeric (diphenylphosphinato)tetrahydrofuranlithium","Acta Crystallographica Section E","2002","58","12","m735","m736","10.1107/S1600536802020986","","","0.71069","MoKα","","","0.05","","","","0.13","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201510","9.591","0.001","10.086","0.001","16.659","0.002","88.22","0.01","76.84","0.01","88","0.01","1567.8","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H21 N9 S4 Zn -","- C30 H21 N9 S4 Zn -","- C60 H42 N18 S8 Zn2 -","2","1","LH6017","Heng Xu; Jingli Xie; Xiaoming Ren; Youcun Chen","The bis(maleonitriledithiolato)zincate(II) complex of the monoprotonated 4,4'-bipyridine cation","Acta Crystallographica Section E","2002","58","12","m750","m752","10.1107/S1600536802021293","","","0.71073","MoKα","","0.06","0.041","","","0.084","0.088","","","","","","1.008","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201511","7.243","0.0001","10.0455","0.0002","10.0831","0.0002","85.47","","73.306","0.001","69.401","0.001","657.59","0.02","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","2a',8a'-Dichloro-3,8-dioxo-1',2',2a',8a'-tetrahydrodispiro[cyclopropane- 1,1'- cyclobuta[b]napthalene-2',1""-cyclopropane]","","- C16 H12 Cl2 O2 -","- C16 H12 Cl2 O2 -","- C32 H24 Cl4 O4 -","2","1","LH6019","Anwar Usman; Hoong-Kun Fun; Lei Wang; Yan Zhang; Jian-Hua Xu","2a',8a'-Dichloro-3,8-dioxo-1',2',2a',8a'-tetrahydrodispiro[cyclopropane-1,1'-cyclobuta[<i>b</i>]naphthalene-2',1''-cyclopropane]","Acta Crystallographica Section E","2002","58","12","o1463","o1465","10.1107/S1600536802021785","","","0.71073","MoKα","","0.0819","0.0782","","","0.195","0.1988","","","","","","1.073","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201512","8.9277","0.0001","19.4774","0.0003","5.3946","0.0001","90","","99.6283","0.0007","90","","924.84","0.02","297","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C3 K O10 U -","- C3 K O10 U -","- C12 K4 O40 U4 -","4","1","MG6007","Zoltán Szabó; Andreas Fischer","Redetermination of dipotassium diuranyl tris(oxalate) tetrahydrate","Acta Crystallographica Section E","2002","58","7","i56","i58","10.1107/S1600536802009455","","","0.71073","MoKα","","0.0229","0.0174","","","0.0412","0.0423","","","","","","1.131","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201513","9.6824","0.0005","11.0733","0.0007","11.8967","0.0007","94.546","0.002","101.557","0.002","114.193","0.002","1121.17","0.12","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H50 As6 N4 O38 V4 -","- C12 H50 As6 N4 O38 V4 -","- C12 H50 As6 N4 O38 V4 -","1","0.5","MG6010","Bremner, Colin A.; Harrison, William T. A.","Bis(dabconium) vanadium arsenate octahydrate, (N~2~C~6~H~14~)~2~[V~4~As~6~O~30~H~6~]·8H~2~O","Acta Crystallographica Section E","2002","58","7","m319","m321","10.1107/S1600536802009546","","","0.71073","MoKα","","0.0362","0.0277","","","0.0684","0.0706","","","","","","0.967","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2201514","6.862","0.002","10.293","0.003","11.54","0.003","90","","104.296","0.006","90","","789.8","0.4","100","1","100","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Tetramethylphosphonium hydrogen carbonate","","- C5 H13 O3 P -","- C5 H13 O3 P -","- C20 H52 O12 P4 -","4","1","MG6011","Dietzel, Pascal D. C.; Jansen, Martin","Tetramethylphosphonium hydrogen carbonate","Acta Crystallographica Section E","2002","58","9","o1003","o1004","10.1107/S1600536802013168","","","0.71073","MoKα","","0.071","0.0404","","","0.0796","0.0872","","","","","","0.889","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201515","7.9018","0.0005","8.2096","0.001","9.1877","0.001","70.521","0.007","73.142","0.006","81.66","0.005","536.98","0.1","120","2","120","2","","","","","","","","4","P -1","-P 1","2","Cerium trichloride heptahydrate","Di-mu-chloro-bis[heptaaquacerium(III)] tetrachloride","","- Ce2 Cl6 H28 O14 -","- Ce2 Cl6 H28 O14 -","- Ce2 Cl6 H28 O14 -","1","0.5","MG6012","Levason, William; Webster, Michael","Di-μ-chloro-bis[heptaaquacerium(III)] tetrachloride","Acta Crystallographica Section E","2002","58","9","i76","i78","10.1107/S1600536802014794","","","0.71073","MoKα","","0.0318","0.0303","","","0.0791","0.0796","","","","","","1.166","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201516","9.813","0.002","10.9387","0.0018","16.36","0.004","90","","102.86","0.03","90","","1712.1","0.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","dysprosium thiosilicate","","","- Dy4 S12 Si3 -","- Dy4 S12 Si3 -","- Dy16 S48 Si12 -","4","1","","Hatscher, Stephan T.; Urland, Werner","Dysprosium thiosilicate, Dy~4~(SiS~4~)~3~","Acta Crystallographica, Section E","2002","58","","i74","i75","10.1107/S1600536802014137","","","","","","","","","","","","","","","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201517","11.2351","0.0008","8.7244","0.0005","14.0518","0.0009","90","","90.493","0.006","90","","1377.3","0.15","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","barium dihydrogen phosphite hemihydrate","barium dihydrogen phosphite hemihydrate","","- Ba H5 O6.5 P2 -","- Ba H3 O6.5 P2 -","- Ba8 H24 O52 P16 -","8","2","MG6016","Ouarsal, Rachid; Alaoui Tahiri, Aziz; Lachkar, Mohammed; Slimani, Zineb; El Bali, Brahim; Bolte, Michael","Barium dihydrogen phosphite hemihydrate","Acta Crystallographica Section E","2002","58","9","i72","i73","10.1107/S1600536802013569","","","0.71073","MoKα","","0.0481","0.0355","","","0.0825","0.0858","","","","","","0.929","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201518","11.449","0.007","19.829","0.01","13.688","0.014","90","","101.43","0.07","90","","3046","4","298","2","298","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","potassium trihydrogenhexatungstoplatinate(IV) hexahydrate","pentapotassium trihydrogenhexatungstoplatinate(IV) hexahydrate","","- H15 K5 O30 Pt W6 -","- K5 O30 Pt W6 -","- K20 O120 Pt4 W24 -","4","0.5","MG6017","Lee, Uk","Pentapotassium trihydrogenhexatungstoplatinate(IV) hexahydrate, K~5~[H~3~PtW~6~O~24~]·6H~2~O","Acta Crystallographica Section E","2002","58","12","i130","i132","10.1107/S1600536802021505","","","0.71069","MoKα","","0.0646","0.0527","","","0.1467","0.1604","","","","","","1.111","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201519","13.9593","0.0002","24.3433","0.0003","26.9406","0.0004","90","","92.1511","0.0005","90","","9148.4","0.2","150","","150","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","silver[tris(2,3,5,6)-tetraphenylphenoxy)germanium(II) silver(I) trifluorormethanesulfonate] tetrabenzene","tris[μ-2,6-diphenylphenoxy(1-)-1:3κ^2^O,1κC^2^](trifluoromethylsulfonato- 2κO)disilvergermanium (Ag‒Ge) tetrabenzene solvate","","- C115 H87 Ag2 F3 Ge O6 S -","- C115 H87 Ag2 F3 Ge O6 S -","- C460 H348 Ag8 F12 Ge4 O24 S4 -","4","1","MG6018","Charles S. Weinert; Phillip E. Fanwick; Ian P. Rothwell","A germanium‒silver complex containing aGe—Ag bond, Ag[Ge(OC~6~HPh~4~-2,3,5,6)~3~(AgOSO~2~CF~3~)]·4C~6~H~6~","Acta Crystallographica Section E","2002","58","12","m718","m720","10.1107/S1600536802020585","","","0.71073","MoKα","","","0.039","","","","0.074","","","","","","0.912","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201520","8.3031","0.0008","5.3377","0.0005","10.8485","0.0011","90","","108.659","0.002","90","","455.53","0.08","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Tricadmium(II) bis(selenite(IV)) selenate(VI)","","- Cd3 O10 Se3 -","- Cd3 O10 Se3 -","- Cd6 O20 Se6 -","2","1","MG6019","Weil, Matthias","Cd~3~Se~3~O~10~, isotypic with its mercury analogue","Acta Crystallographica Section E","2002","58","12","i127","i129","10.1107/S160053680202161X","","","0.71073","MoKα","","0.019","0.0182","","","0.0438","0.0439","","","","","","0.997","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201521","5.1851","0.0001","10.503","0.0003","10.955","0.0004","96.99","0.001","101.135","0.001","101.786","0.003","564.91","0.03","120","2","150","2","","","","","","","","4","P -1","-P 1","2","","3-(4-(Methylsulfonyl)benzoyl)propionic acid","","- C11 H12 O5 S -","- C11 H12 O5 S -","- C22 H24 O10 S2 -","2","1","NA6163","Daniel E. Lynch; Ian McClenaghan","3-[4-(Methylsulfonyl)benzoyl]propionic acid","Acta Crystallographica Section E","2002","58","7","o729","o730","10.1107/S160053680200990X","","","0.71073","MoKα","","0.0532","0.0422","","","0.129","0.1377","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201522","7.847","0.002","7.904","0.002","19.551","0.004","90.2","0.03","100.92","0.03","90.61","0.03","1190.6","0.5","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","5-(4-Fluorophenyl)-1-phenylpyrazole","","- C15 H11 F N2 -","- C15 H11 F N2 -","- C60 H44 F4 N8 -","4","2","NA6165","Daniel E. Lynch; Ian McClenaghan","5-(4-Fluorophenyl)-1-phenylpyrazole","Acta Crystallographica Section E","2002","58","7","o731","o732","10.1107/S1600536802009911","","","0.71073","MoKα","","0.1057","0.0816","","","0.2276","0.2382","","","","","","1.17","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201523","10.5315","0.0016","11.5313","0.0017","9.0821","0.0013","90","","90","","90","","1102.9","0.3","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","[silver(4,4'-bipyridine)(nitrate)]~n~ [Ag(bpy)(NO~3~)]~n~(bpy = 4,4'-bipydine)","","- C10 H8 Ag N3 O3 -","- C5 H4 Ag0.5 N1.5 O1.5 -","- C40 H32 Ag4 N12 O12 -","8","1","NA6166","Bi, Wenhua; Sun, Daofeng; Cao, Rong; Hong, Maochun","Chain structure of {[Ag(bpy)]NO~3~}~<i>n~</i> (bpy = 4,4'-bipyridine)","Acta Crystallographica Section E","2002","58","7","m324","m325","10.1107/S1600536802009601","","","0.71073","MoKα","","","0.0377","","","0.0695","0.081","","","","","","1.175","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201524","6.1186","0.0008","9.3865","0.0009","11.977","0.002","103.473","0.004","97.274","0.005","93.32","0.01","660.82","0.15","120","2","150","2","","","","","","","","6","P -1","-P 1","2","","2-(N,N-Dimethylaminomethyl)-4-hydroxy-4-phenyl-2-thiazoline","","- C12 H15 Cl N2 O S -","- C12 H15 Cl N2 O S -","- C24 H30 Cl2 N4 O2 S2 -","2","1","NA6167","Daniel E. Lynch; Ian McClenaghan","2-(<i>N,N</i>-Dimethylaminomethyl)-4-hydroxy-4-(4-chlorophenyl)thiazoline","Acta Crystallographica Section E","2002","58","7","o710","o711","10.1107/S1600536802009613","","","0.71073","MoKα","","0.0645","0.0441","","","0.1297","0.1474","","","","","","1.009","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201525","6.6094","0.0014","17.251","0.003","13.91","0.003","90","","97.272","0.016","90","","1573.2","0.6","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","[2.2]basketenoparacyclophane 18,20-dicarbonitrile","","- C22 H18 N2 -","- C22 H18 N2 -","- C88 H72 N8 -","4","1","NA6168","Jones, Peter G.; Witulski, Bernhard; Hopf, Henning","[2.2]Basketenoparacyclophane 18,20-dicarbonitrile","Acta Crystallographica Section E","2002","58","7","o726","o728","10.1107/S1600536802009480","","","0.71073","MoKα","","0.0562","0.0403","","","0.1055","0.1167","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201526","6.1391","0.0004","9.9755","0.0006","28.248","0.002","90","","90","","90","","1729.9","0.2","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Ethyl 4-tert-butyl-2-(3-phenylureido)-1,3-thiazole-5-carboxylate","","- C17 H21 N3 O3 S -","- C17 H21 N3 O3 S -","- C68 H84 N12 O12 S4 -","4","1","NA6169","Daniel E. Lynch; Ian McClenaghan","Ethyl 4-<i>tert</i>-butyl-2-(3-phenylureido)-1,3-thiazole-5-carboxylate","Acta Crystallographica Section E","2002","58","7","o733","o734","10.1107/S1600536802009923","","","0.71073","MoKα","","0.079","0.0501","","","0.1177","0.1363","","","","","","0.794","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201527","4.1031","0.0004","12.1158","0.0012","10.4553","0.001","90","","95.171","0.006","90","","517.64","0.09","291","1","291","1","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C11 H10 N2 O3 -","- C11 H10 N2 O3 -","- C22 H20 N4 O6 -","2","0.5","NA6171","Kolev, Tsonko; Yancheva, Denitsa; Schürmann, Markus; Kleb, Dirk-Christian; Preut, Hans; Spiteller, Michael","4-Dimethylaminopyridinium-1-squarate","Acta Crystallographica Section E","2002","58","11","o1267","o1268","10.1107/S1600536802018640","","","0.71073","MoKα","","0.1266","0.0374","","","0.0753","0.086","","","","","","0.909","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201528","6.605","0.005","25.23","0.008","6.87","0.005","90","","113.22","0.05","90","","1052.1","1.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(S,S)-N-cyclohexyl-3,4-dihydroxypyrrolidine","","- C10 H19 N O2 -","- C10 H19 N O2 -","- C40 H76 N4 O8 -","4","2","NA6172","Matos Beja, A.; Paixão, J. A.; Ramos Silva, M.; Elisa S. Serra, M.; Rocha Gonsalves, A. M. d'A.; Silva, V. F.","(<i>S,S</i>)-<i>N</i>-Cyclohexyl-3,4-dihydroxypyrrolidine","Acta Crystallographica Section E","2002","58","11","o1285","o1287","10.1107/S1600536802019049","","","1.5418","CuKα","","0.0442","0.0401","","","0.0934","0.0968","","","","","","1.091","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201529","9.7462","0.0005","10.2277","0.0006","34.099","0.002","90","","90","","90","","3399","0.3","150","1","150","1","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","dicarbonyltrichloro(chlorodiphenylsilyl)ruthenium(II) bis[di-η^5^-cyclopentadienylcobalt(I)]","","- C34 H30 Cl4 Co2 O2 Ru Si -","- C34 H30 Cl4 Co2 O2 Ru Si -","- C136 H120 Cl16 Co8 O8 Ru4 Si4 -","4","1","NA6174","Berenbaum, Andrea; Lough, Alan J.; Manners, Ian","Bis[di-η^5^-cyclopentadienylcobalt(I)] dicarbonyltrichloro(chlorodiphenylsilyl)ruthenium(II)","Acta Crystallographica Section E","2002","58","11","m679","m680","10.1107/S1600536802019153","","","0.71073","MoKα","","0.1288","0.064","","","0.1075","0.1275","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201530","4.5039","0.0006","10.5391","0.0014","17.048","0.002","90","","96.399","0.003","90","","804.18","0.18","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Paracetamol monohydrate","4-hydroxyacetanilide hydrate","","- C8 H11 N O3 -","- C8 H11 N O3 -","- C32 H44 N4 O12 -","4","1","NA6176","Andrew Parkin; Simon Parsons; Colin R. Pulham","Paracetamol monohydrate at 150K","Acta Crystallographica Section E","2002","58","12","o1345","o1347","10.1107/S1600536802019840","","","0.71073","MoKα","","0.0808","0.0621","","","0.1433","0.1527","","","","","","0.967","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2201531","11.7669","0.0001","16.03","0.0002","18.4544","0.0002","90","","116.089","0.001","90","","3126.27","0.06","183","2","183","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C60 H56 F24 N4 O4 P4 -","- C60 H56 F24 N4 O4 P4 -","- C120 H112 F48 N8 O8 P8 -","2","0.5","NA6177","T. Ravishankar; K. Chinnakali; K. Srinivasan; P. Rajakumar; Anwar Usman; Hoong-Kun Fun","<i>cyclo</i>-Bis(paraquat-<i>m</i>-terphenylene) tetrakis(hexafluorophosphate) tetrahydrate","Acta Crystallographica Section E","2002","58","12","o1356","o1358","10.1107/S1600536802020068","","","0.71073","MoKα","","0.1127","0.0625","","","0.1351","0.1491","","","","","","0.914","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201532","8.266","0.005","8.515","0.004","20.614","0.007","87.08","0.03","86.56","0.03","78.32","0.03","1417.2","1.2","220","2","220","2","","","","","","","","4","P -1","-P 1","2","","carbamoylmethyl 3,4,5-trihydroxybenzoate hydrate","","- C9 H9.67 N O6.33 -","- C9 H9.66667 N O6.33333 -","- C54 H58 N6 O38 -","6","3","NA6179","Andrew Parkin; Simon Parsons; Johanna H. Robertson; Peter A. Tasker","A hydrate of carbamoylmethyl 3,4,5-trihydroxybenzoate with three different molecular conformations","Acta Crystallographica Section E","2002","58","12","o1348","o1350","10.1107/S1600536802020147","","","1.54178","CuKα","","0.0514","0.0427","","","0.1157","0.1221","","","","","","1.032","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2201533","12.1514","0.001","12.312","0.0011","17.114","0.002","88.164","0.011","88.103","0.012","62.816","0.006","2275.9","0.4","148","2","148","2","","","","","","","","3","P -1","-P 1","2","","3-phenylpyrazole","","- C9 H8 N2 -","- C9 H8 N2 -","- C108 H96 N24 -","12","6","NA6180","Haghiri, Alireza; Lerner, Hans-Wolfram; Wagner, Matthias; Bats, Jan W.","3-Phenylpyrazole, a pseudosymmetric structure with <i>Z</i>' = 6","Acta Crystallographica Section E","2002","58","12","o1378","o1380","10.1107/S1600536802020445","","","0.71073","MoKα","","0.0762","0.0494","","","0.1076","0.1238","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201534","9.3597","0.0001","14.7896","0.0002","14.9199","0.0001","90","","128.66","0.005","90","","1612.73","0.12","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[rac-5RS,7RS,8SR]-Spiro-{7-methoxycarbonyl-1-aza-3-thia-bicyclo[3.3.0] octane-8,1'-acenaphthylene}-2'-one","","- C19 H17 N O3 S -","- C19 H17 N O3 S -","- C76 H68 N4 O12 S4 -","4","1","NA6181","Sundar, T. V.; Parthasarathi, V.; Álvarez-Rúa. C.; García-Granda. S.; Saxena, A.; Pardasani, P.; Pardasani, R. T.","(<i>rac</i>-5<i>RS</i>,7<i>RS</i>,8S<i>R</i>)-Spiro[7-methoxycarbonyl-1-aza-3-thiabicyclo[3.3.0]octane-8,1'-acenaphthylen]-2'-one","Acta Crystallographica Section E","2002","58","12","o1405","o1407","10.1107/S1600536802020846","","","1.5418","CuKα","","0.0435","0.038","","","0.0996","0.1039","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201535","6.0031","0.0015","10.0697","0.0015","17.028","0.003","90","","90","","90","","1029.3","0.4","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-Chloro-1,3-dioxa-2σ^3^λ^3^-phosphaanthracen-4-one","","- C11 H6 Cl O3 P -","- C11 H6 Cl O3 P -","- C44 H24 Cl4 O12 P4 -","4","1","NA6183","Jones, Peter G.; Kunze, Christine; Thönnessen, Holger; Schmutzler, Reinhard","2-Chloro-1,3-dioxa-2σ^3^λ^3^-phosphaanthracen-4-one","Acta Crystallographica Section E","2002","58","12","o1432","o1433","10.1107/S1600536802021189","","","0.71073","MoKα","","0.0438","0.0353","","","0.0773","0.0828","","","","","","1.063","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201536","7.1026","0.0006","8.3633","0.0008","10.1786","0.001","103.794","0.003","102.52","0.003","113.39","0.003","504.96","0.08","143","2","143","2","","","","","","","","5","P -1","-P 1","2","","2-Chloro-1,3-dioxa-2σ^3^λ^3^-phosphaphenanthren-4-one","","- C11 H6 Cl O3 P -","- C11 H6 Cl O3 P -","- C22 H12 Cl2 O6 P2 -","2","1","NA6184","Jones, Peter G.; Kunze, Christine; Freytag, Matthias; Schmutzler, Reinhard","2-Chloro-1,3-dioxa-2σ^3^λ^3^-phosphaphenanthren-4-one","Acta Crystallographica Section E","2002","58","12","o1434","o1435","10.1107/S1600536802021220","","","0.71073","MoKα","","0.0333","0.0306","","","0.0863","0.0884","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201537","7.0993","0.0015","10.183","0.002","10.1298","0.0015","90","","102.417","0.01","90","","715.2","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Nitrobenzamide","","- C7 H6 N2 O3 -","- C7 H6 N2 O3 -","- C28 H24 N8 O12 -","4","1","NA6185","Jones, Peter G.; Thönnessen, Holger; Schmutzler, Reinhard; Fischer, Axel K.","A second polymorph of <i>p</i>-nitrobenzamide","Acta Crystallographica Section E","2002","58","12","o1436","o1438","10.1107/S1600536802021244","","","0.71073","MoKα","","0.0634","0.0492","","","0.1099","0.1201","","","","","","1.085","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201538","12.661","0.005","19.247","0.007","11.01","0.004","90","","107.273","0.007","90","","2562","1.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","r-1,c-2,t-3,t-4-1-(2-benzoxazolyl)-2-biphenyl-4-phenyl-3- pyridinylcyclobutane","","- C34 H26 N2 O -","- C34 H26 N2 O -","- C136 H104 N8 O4 -","4","1","OB6119","Zhuang, Jun-Peng; Zheng, Yan; Zhang, Wen-Qin","<i>r</i>-1,<i>c</i>-2,<i>t</i>-3,<i>t</i>-4-1-(2-Benzoxazolyl)-2-biphenyl-4-phenyl-3-pyridinylcyclobutane","Acta Crystallographica Section E","2002","58","7","o720","o722","10.1107/S1600536802009418","","","0.71073","MoKα","","0.1533","0.0465","","","","0.1147","","","","","","0.98","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201539","13.6069","0.0015","7.7759","0.0008","12.6586","0.0014","90","","90","0.002","90","","1339.4","0.3","141","2","141","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H21 Cl2 N3 O V -","- C9 H21 Cl2 N3 O V -","- C36 H84 Cl8 N12 O4 V4 -","4","1","OB6133","Dorothea Fiedler; Ognjen S. Miljanić; Eric J. Welch","Dichlorooxo(<i>N,N</i>',<i>N</i>''-trimethyl-1,4,7-triazacyclononane-κ^3^<i>N</i>)vanadium(IV)","Acta Crystallographica Section E","2002","58","7","m347","m348","10.1107/S160053680201053X","","","0.71073","MoKα","","0.0466","0.0381","","0.1219","","0.1084","","","0.76","","","0.718","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201540","19.551","0.003","12.1135","0.0019","18.41","0.003","90","","119.529","0.003","90","","3793.7","1","294","2","294","2","","","","","","","","7","C 1 2 1","C 2y","5","","A Cationic Palladium (R)-2,2',6,6'-Tetramethoxy-4,4'-Bis(diphenylphosphino)- 3,3'-Bipyridine Complex","","- C38 H34 Cl2 N2 O4 P2 Pd -","- C38 H34 Cl2 N2 O4 P2 Pd -","- C152 H136 Cl8 N8 O16 P8 Pd4 -","4","1","OB6134","Wang, Lailai; Kwok, Waihim; Zhou, Zhongyuan","[(<i>R</i>)-4,4'-Bis(diphenylphosphino)-2,2',6,6'-tetramethoxy-3,3'-bipyridine-κ^2^<i>P,P</i>']dichloropalladium(II)","Acta Crystallographica Section E","2002","58","7","m322","m323","10.1107/S1600536802009558","","","0.71073","MoKα","","0.1114","0.0681","","","0.1413","0.1554","","","","","","1.133","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201541","19.9938","0.0005","11.7063","0.0004","27.1914","0.0009","90","","111.514","0.0013","90","","5920.8","0.3","200","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C71 H71 Ni P4 -","- C56 H56 Ni P4 -","- C224 H224 Ni4 P16 -","4","1","OB6135","Alison J. Edwards; Mikael Retbøll; Eric Wenger","The tetrahedral tetrakis(phosphine) complex [bis(diphenylphosphino)butane-κ<i>P,P</i>]nickel(0)‒benzene (1/2.5)","Acta Crystallographica Section E","2002","58","7","m375","m377","10.1107/S1600536802011121","","","0.71073","MoKα","","","0.0586","","","","0.0649","","","","","","1.0308","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201542","3.864","0.001","10.691","0.003","20.461","0.005","90","","93.036","0.005","90","","844.1","0.4","168","2","168","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H7 N O3 -","- C10 H7 N O3 -","- C40 H28 N4 O12 -","4","1","OB6136","Rodriguez, Mark A.; Aubert, James H.; McElhanon, James R.; Eatough, Michael O.","<i>N</i>-(4-Hydroxyphenyl)maleimide","Acta Crystallographica Section E","2002","58","7","o742","o744","10.1107/S1600536802009819","","","0.71073","MoKα","","0.0606","0.0393","","","0.0906","0.1003","","","","","","1.032","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201543","9.205","0.002","10.372","0.002","10.989","0.002","81.831","0.004","87.033","0.004","80.405","0.004","1023.6","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Dichloro(dimethylformamide)[2-hydroxy-5-nitro-N-(8- quinolyl)salicylaldiminato]iron(III)","","- C19 H17 Cl2 Fe N4 O4 -","- C19 H17 Cl2 Fe N4 O4 -","- C38 H34 Cl4 Fe2 N8 O8 -","2","1","OB6137","Xie, Jing-Li; Tong, Wen-Jun; Zou, Yang; Ren, Xiao-Ming; Li, Yi-Zhi; Meng, Qing-Jin","Dichloro(dimethylformamide)[2-hydroxy-5-nitro-<i>N</i>-(8-quinolyl)salicylaldiminato]iron(III)","Acta Crystallographica Section E","2002","58","7","m334","m336","10.1107/S1600536802010073","","","0.71073","MoKα","","0.1233","0.0902","","","0.2214","0.2439","","","","","","0.95","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201544","14.734","0.003","6.5429","0.0009","20.907","0.003","90","","103.793","0.009","90","","1957.4","0.6","144","2","144","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1-(4-methoxyphenyl)-but-3-yn-1-ol","","- C11 H12 O2 -","- C11 H12 O2 -","- C88 H96 O16 -","8","2","OB6138","Bats, Jan W.; Fischer, Dirk; Hashmi, A. Stephen K.","1-(4-Methoxyphenyl)but-3-yn-1-ol","Acta Crystallographica Section E","2002","58","7","o735","o737","10.1107/S1600536802009820","","","0.71073","MoKα","","0.1127","0.0692","","","0.12","0.1387","","","","","","1.206","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201545","9.082","0.002","7.72","0.005","7.996","0.005","90","","102.907","0.012","90","","546.5","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis-buthanediammoniumchloride tetrachloromercurate","","- C4 H14 Cl4 Hg N2 -","- C4 H14 Cl4 Hg N2 -","- C8 H28 Cl8 Hg2 N4 -","2","0.5","OB6139","Amami, Mongi; Zouari, Ridha; Ben Salah, Abdelhamid; Burzlaff, Hans","1,4-Butanediammonium tetrachloromercurate(II)","Acta Crystallographica Section E","2002","58","7","m357","m359","10.1107/S160053680201067X","","","0.71073","MoKα","","0.0646","0.0361","","","0.0678","0.0729","","","","","","1.148","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201546","10.7617","0.0005","19.1957","0.0007","21.4568","0.0009","90","","90","","90","","4432.5","0.3","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Triphenyl(benzoylmethyl)phosphonium nitrate","Triphenyl(benzoylmethyl)phosphonium nitrate","","- C26 H22 N O4 P -","- C26 H22 N O4 P -","- C208 H176 N8 O32 P8 -","8","1","OB6140","Baby Mariyatra, Mahimaidoss; Panchanatheswaran, Krishnaswamy; Goeta, Andres E.","Triphenyl(benzoylmethyl)phosphonium nitrate: a three-dimensional hydrogen-bonded network","Acta Crystallographica Section E","2002","58","8","o807","o809","10.1107/S1600536802011431","","","0.71073","MoKα","","0.0471","0.0392","","","0.105","0.1138","","","","","","1.028","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201547","3.8983","0.0013","25.651","0.014","7.256","0.004","90","","101.33","0.05","90","","711.4","0.6","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","PdCl2(4-CNpy)2","Palladium(II)-transdichlorobis(4-cyanopyridine)","","- C12 H8 Cl2 N4 Pd -","- C12 H8 Cl2 N4 Pd -","- C24 H16 Cl4 N8 Pd2 -","2","0.5","OB6141","Barnett, Sarah A.; Blake, Alexander J.; Brooks, Neil R.; Champness, Neil R.; Hubberstey, Peter; Teat, Simon J.; Schröder, Martin","<i>trans</i>-Dichlorobis(4-cyanopyridine)palladium(II)","Acta Crystallographica Section E","2002","58","8","m385","m386","10.1107/S1600536802011248","","","0.689","synchrotron","","0.0472","0.0366","","","0.0866","0.0882","","","","","","0.932","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201548","9.5502","0.0005","8.6443","0.0005","13.1213","0.0006","90","","91.028","0.003","90","","1083.05","0.1","120","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C26 H20 Br N O3 S -","- C26 H20 Br N O3 S -","- C52 H40 Br2 N2 O6 S2 -","2","1","OB6142","Veronica Åberg; Dan Boström; Andreas Fischer; Fredrik Almqvist","Synthesis and absolute configuration of methyl (‒)-(3<i>R</i>)-8-(4-bromophenyl)-7-(naphthalen-1-ylmethyl)-5-oxo-2,3-dihydro-5<i>H</i>-thiazolo[3,2-<i>a</i>]pyridine-3-carboxylate","Acta Crystallographica Section E","2002","58","8","o812","o814","10.1107/S1600536802011480","","","0.71073","MoKα","","0.0524","0.0436","","","0.0975","0.1028","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201549","9.7764","0.001","28.491","0.003","11.279","0.0012","90","","102.437","0.002","90","","3067.9","0.6","93","2","93","2","","","","","","","","6","C 1 c 1","C -2yc","9","Cu([9]ane(Nvbz)~3~)NO~3~Cl","Chloro(nitrato)[1,4,7-tris(4-vinyl)benzyl-1,4,7-triazacyclononane]copper(II)","","- C33 H39 Cl Cu N4 O3 -","- C33 H39 Cl Cu N4 O3 -","- C132 H156 Cl4 Cu4 N16 O12 -","4","1","OB6143","Deschamps, Jeffrey R.; Hartshorn, Christopher M.; Singh, Alok; Chang, Eddie L.","Chloro(nitrato)[1,4,7-tris(4-vinyl)benzyl-1,4,7-triazacyclononane]copper(II)","Acta Crystallographica Section E","2002","58","8","m396","m398","10.1107/S1600536802011613","","","0.71073","MoKα","","0.0243","0.0228","","","0.0611","0.064","","","","","","0.879","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201550","12.037","0.003","13.239","0.003","14.158","0.003","90","","113.728","0.004","90","","2065.5","0.8","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","cs2","cis,cis-Ceratospongamide monohydrate (from MPD-water solution) cyclo(-Ile-Oxz-Phe-Pro-Thz-Phe-Pro-)","","- C41 H51 N7 O7 S -","- C41 H51 N7 O7 S -","- C82 H102 N14 O14 S2 -","2","1","OB6144","Mitsunobu Doi; Akiko Asano","<i>cis,cis</i>-Ceratospongamide monohydrate","Acta Crystallographica Section E","2002","58","8","o834","o836","10.1107/S1600536802011558","","","0.71073","MoKα","","0.107","0.0564","","","0.1159","0.141","","","","","","0.995","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201551","6.486","0.001","15.464","0.003","8.457","0.002","90","","103.91","0.01","90","","823.4","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[Hydroxy(4-pyridyl)methyl]phosphonic acid monohydrate","","- C6 H10 N O5 P -","- C6 H10 N O5 P -","- C24 H40 N4 O20 P4 -","4","1","OB6146","Yi, Xiao-Yi; Li, Yi-Zhi; Zheng, Li-Min","[Hydroxy(4-pyridyl)methyl]phosphonic acid monohydrate","Acta Crystallographica Section E","2002","58","8","o820","o821","10.1107/S160053680201173X","","","0.71073","MoKα","","0.0574","0.0431","","","0.0988","0.103","","","","","","0.938","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201552","9.2079","0.0004","13.2553","0.0005","17.8928","0.0008","90","","93.385","0.001","90","","2180.07","0.16","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,2'-dithiodibenzoic acid‒4,4'-bipyridine (1/1)","","- C24 H18 N2 O4 S2 -","- C24 H18 N2 O4 S2 -","- C96 H72 N8 O16 S8 -","4","1","OB6147","Bi, Wenhua; Sun, Daofeng; Cao, Rong; Hong, Maochun","A novel three-dimensional supramolecule of 2,2'-dithiodibenzoic acid‒4,4'-bipyridine (1/1)","Acta Crystallographica Section E","2002","58","8","o837","o839","10.1107/S1600536802012217","","","0.71073","MoKα","","","0.0463","","","0.1034","0.1209","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201553","18.741","0.002","6.302","0.002","13.069","0.003","90","","90","","91.68","0.01","1542.9","0.6","343","2","343","2","","","","","","","","5","P 1 1 21/n","-P 2n","14","bis(trimethylammonium)tetrachloromerurate","trimethylammonium tetrachloromercurates(II)","","- C6 H20 Cl4 Hg N2 -","- C6 H2 Cl4 Hg N2 -","- C24 H8 Cl16 Hg4 N8 -","4","1","OB6148","Amami, Mongi; Van Smaalen, Sander; Ben Salah, Abdelhamid","Bis(trimethylammonium) tetrachloromercurate(II) at 343K","Acta Crystallographica Section E","2002","58","8","m416","m419","10.1107/S160053680201214X","","","0.5","Synchrotron","","0.0507","0.0507","","","0.0785","0.0785","","","","","","2.3","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201554","8.4238","0.0011","29.217","0.004","7.712","0.0011","90","","98.052","0.003","90","","1879.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,4'-[2,2'-(Piperidin-1,4-diyldiethylene)di(tosylimino)]diphthalonitrile","","- C38 H36 N8 O4 S2 -","- C38 H36 N8 O4 S2 -","- C76 H72 N16 O8 S4 -","2","0.5","OB6149","Çoruh, Ufuk; Akdemir, Nesuhi; Ag̃ar, Erbil; Vázquez-López, Ezequiel M.; Erdönmez, Ahmet","4,4'-[2,2'-(Piperidine-1,4-diyldiethylene)di(tosylimino)]diphthalonitrile","Acta Crystallographica Section E","2002","58","8","o896","o897","10.1107/S1600536802012308","","","0.71073","MoKα","","0.2177","0.0463","","","0.118","0.1542","","","","","","0.722","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2201555","6.162","0.004","16.71","0.011","13.403","0.007","90","","93.58","0.04","90","","1377.4","1.5","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","endo-6,syn-7-Dichloro-exo-6-phenylsulphonylbicyclo[3.1.1]heptane","","- C13 H14 Cl2 O2 S -","- C13 H14 Cl2 O2 S -","- C52 H56 Cl8 O8 S4 -","4","1","OB6150","Oleg Ya. Borbulevych; Aleksey V. Semenov; Victor A. Vasin; Vyachislav V. Razin","<i>endo</i>-6,<i>syn</i>-7-Dichloro-<i>exo</i>-6-phenylsulfonylbicyclo[3.1.1]heptane","Acta Crystallographica Section E","2002","58","8","o925","o926","10.1107/S1600536802013016","","","0.71073","MoKα","","0.0535","0.0329","","","0.0881","0.0911","","","","","","0.992","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201556","8.793","0.005","9.366","0.005","17.881","0.01","90","","90","","90","","1472.6","1.4","293","2","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","1,4-Bis(2-benzimidazolyl)butane","","- C18 H18 N4 -","- C18 H18 N4 -","- C72 H72 N16 -","4","0.5","OB6151","Chunlong, Chen; Chengyong, Su; Anwu, Xu; Huaxin, Zhang; Xiaolong, Feng; Beisheng, Kang","1,4-Bis(benzimidazol-2-yl)butane","Acta Crystallographica Section E","2002","58","8","o916","o917","10.1107/S1600536802012904","","","0.71073","MoKα","","","0.0394","","","","0.106","","","","","","1.046","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201557","7.3086","0.0006","7.3086","0.0006","11.2295","0.0012","90","","90","","90","","599.83","0.09","173","2","173","2","","","","","","","","4","P -4 21 c","P -4 2n","114","","Silicon(iv) acetate","","- C8 H12 O8 Si -","- C8 H12 O8 Si -","- C16 H24 O16 Si2 -","2","0.25","OB6152","Wicke, Lena; Alig, Edith; Lerner, Hans-Wolfram; Bolte, Michael","Redetermination of silicon(IV) acetate","Acta Crystallographica Section E","2002","58","8","o927","o928","10.1107/S1600536802012916","","","0.71073","MoKα","","0.0242","0.0233","","","0.0624","0.0629","","","","","","1.104","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201558","7.0279","0.0005","11.6943","0.0005","16.5623","0.0012","90","","96.791","0.006","90","","1351.65","0.15","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H14 Cr K O13 -","- C6 H14 Cr K O13 -","- C24 H56 Cr4 K4 O52 -","4","1","OB6153","Lemmer, Markus; Lerner, Hans-Wolfram; Bolte, Michael","Potassium <i>trans</i>-diaquabis(malonato)chromium(III) trihydrate","Acta Crystallographica Section E","2002","58","8","m447","m448","10.1107/S1600536802013077","","","0.71073","MoKα","","0.027","0.0247","","","0.0646","0.0659","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201559","9.9942","0.001","11.6591","0.0011","7.6298","0.0009","90","","104.392","0.009","90","","861.15","0.16","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C11 H8 O3 -","- C11 H8 O3 -","- C44 H32 O12 -","4","1","OB6154","Schmidt, Martin U.; Wagner, Guido; Bolte, Michael","Redetermination of 3-hydroxy-2-naphthoic acid","Acta Crystallographica Section E","2002","58","8","o918","o919","10.1107/S1600536802012667","","","0.71073","MoKα","","0.0492","0.0299","","","0.0678","0.0701","","","","","","0.956","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201560","10.13","0.002","11.778","0.002","13.065","0.003","99.608","0.004","90.336","0.005","100.351","0.004","1510.9","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H38 Co N3 O6 -","- C33 H38 Co N3 O6 -","- C66 H76 Co2 N6 O12 -","2","1","OB6155","Shongwe, Musa S.; Al-Juma, Shaima A.; Fernandes, Manuel A.","A comparative study of the interactions of cobalt(III) with naphtholate and phenolate moieties","Acta Crystallographica Section E","2002","58","8","m457","m459","10.1107/S1600536802013181","","","0.71073","MoKα","","0.0996","0.044","","","0.0863","0.1023","","","","","","0.927","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201561","14.28","0.02","11.17","0.02","12.98","0.01","90","","97.67","0.09","90","","2052","5","296","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C6 H18 Cr O6 P3 S6 -","- C6 H18 Cr O6 P3 S6 -","- C24 H72 Cr4 O24 P12 S24 -","4","0.5","OB6156","Tetsuzo Ito","Tris(<i>O,O</i>'-dimethyldithiophosphato)chromium(III)","Acta Crystallographica Section E","2002","58","8","m449","m450","10.1107/S1600536802013193","","","0.7107","MoKα","","","0.037","","","","0.021","","","","","","2.2","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201562","13.488","0.006","17.868","0.007","16.452","0.007","90","","90","","90","","3965","3","100","2","100","2","","","","","","","","4","C 2 2 21","C 2c 2","20","mont2","Montanastatin: cyclo(-Val-D-Hyv-D-Val-Lac-)2, Hyv=alpha-hydroxyisovaleric acid, Lac=lactic acid","","- C36 H60 N4 O12 -","- C36 H60 N4 O12 -","- C144 H240 N16 O48 -","4","0.5","OB6157","Mitsunobu Doi; Akiko Asano","Montanastatin, cyclo[‒(Val-<small>D</small>-Hyv-<small>D</small>-Val-Lac)~2~‒]","Acta Crystallographica Section E","2002","58","8","o935","o936","10.1107/S1600536802013259","","","0.71073","MoKα","","0.0511","0.0489","","","0.1096","0.1107","","","","","","1.177","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201563","3.9015","0.0008","12.658","0.003","9.6687","0.0019","90","","101.186","0.005","90","","468.42","0.17","293","2","293","2","","","","","","","","5","P 1 n 1","P -2yac","7","2,4,5-trichloroacetanilide","N-[2,4,5-trichlorophenyl]acetamide","","- C8 H6 Cl3 N O -","- C8 H6 Cl3 N O -","- C16 H12 Cl6 N2 O2 -","2","1","OB6158","Mahalakshmi, L.; Upadhyaya, V.; Guru Row, T. N.","2,4,5-Trichloroacetanilide","Acta Crystallographica Section E","2002","58","8","o946","o947","10.1107/S1600536802013417","","","0.71073","MoKα","","0.0238","0.0232","","","0.061","0.0616","","","","","","1.049","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201564","11.4158","0.0007","7.5787","0.0005","7.4714","0.0004","90","","101.9","0.004","90","","632.51","0.07","150","2","150","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","2,3-lutidine","2,3-dimethylpyridine","","- C7 H9 N -","- C7 H9 N -","- C28 H36 N4 -","4","0.5","OB6159","Bond, Andrew D.; Davies, John E.","2,3-Lutidine","Acta Crystallographica Section E","2002","58","8","o961","o963","10.1107/S1600536802013648","","","0.7107","MoKα","","0.0678","0.0503","","","0.1445","0.157","","","","","","1.075","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201565","10.325","0.004","14.813","0.005","11.295","0.004","90","","110.709","0.005","90","","1615.9","1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","HEPTanalog","1-methoxymethyl-5-ethyl-6-(1-naphthyl)uracil","","- C19 H20 N2 O3 -","- C19 H20 N2 O3 -","- C76 H80 N8 O12 -","4","1","OB6160","Ge Meng; Lin Hong Weng; Fen Er Chen","1-Methoxymethyl-5-ethyl-6-(1-naphthylmethyl)uracil","Acta Crystallographica Section E","2002","58","10","o1075","o1077","10.1107/S1600536802015908","","","0.71073","MoKα","","0.11","0.0595","","","0.1203","0.1377","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201566","6.6709","0.0006","5.7814","0.0005","8.8881","0.0006","90","","100.684","0.005","90","","336.85","0.05","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","n-Methyl-4-hydroxyproline","","- C6 H11 N O3 -","- C6 H11 N O3 -","- C12 H22 N2 O6 -","2","1","OB6161","Yapp, Donald T. T.; Steed, Jonathan W.; Houghton, Peter J.","4-Hydroxy-<i>N</i>-methylproline","Acta Crystallographica Section E","2002","58","9","o988","o989","10.1107/S160053680201406X","","","0.71073","MoKα","","0.0297","0.0265","","","0.0599","0.0613","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201567","8.8282","0.0017","11.144","0.002","12.318","0.003","97.104","0.019","105.586","0.018","95.05","0.02","1149","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","[Au(4,6-Me~2~pymS)(PPh~3~)]","(4,6-Dimethylpyrimidine-2-thiolato)triphenylphosphanegold(I)","","- C24 H22 Au N2 P S -","- C24 H22 Au N2 P S -","- C48 H44 Au2 N4 P2 S2 -","2","1","OB6162","Schulz Lang, Ernesto; Fernandes Jr, Ramão Marceli; Lemos, Sebastião Souza; Schulz Lang, Leonardo; Burrow, Robert Alan","(4,6-Dimethylpyrimidine-2-thiolato)(triphenylphosphine)gold(I)","Acta Crystallographica Section E","2002","58","9","m469","m470","10.1107/S1600536802013776","","","0.71073","MoKα","","0.1196","0.0469","","","0.0836","0.0998","","","","","","0.98","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201568","9.767","0.002","13.298","0.003","13.272","0.003","90","","102.991","0.005","90","","1679.7","0.6","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","3-nitroacetanilide","N-[3-nitrophenyl]acetamide","","- C8 H8 N2 O3 -","- C8 H8 N2 O3 -","- C64 H64 N16 O24 -","8","4","OB6163","Mahalakshmi, L.; Upadhyaya, V.; Guru Row, T. N.","3-Nitroacetanilide","Acta Crystallographica Section E","2002","58","9","o983","o984","10.1107/S1600536802013843","","","0.71073","MoKα","","0.0689","0.0588","","","0.144","0.154","","","","","","1.067","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201569","8.2","0.004","8.538","0.004","8.295","0.004","90","","113.626","0.006","90","","532.1","0.4","293","2","293","2","","","","","","","","4","P 1 n 1","P -2yac","7","2,4,6-trimethylacetanilide","N-[2,4,6-trimethylphenyl]acetamide","","- C11 H15 N O -","- C11 H15 N O -","- C22 H30 N2 O2 -","2","1","OB6164","Upadhyaya, V.; Mahalakshmi, L.; Guru Row, T. N.","2,4,6-Trimethylacetanilide","Acta Crystallographica Section E","2002","58","9","o997","o998","10.1107/S1600536802014228","","","0.71073","MoKα","","0.0505","0.0447","","","0.1115","0.1158","","","","","","1.132","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201570","5.9261","0.0003","11.1029","0.0006","19.6978","0.0011","90","","95.521","0.001","90","","1290.04","0.12","213","2","213","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","6,6-Dimethyl-2-phenyl-4,5,6,7-tetrahydrobenzofuran-4-one","","- C16 H16 O2 -","- C16 H16 O2 -","- C64 H64 O8 -","4","1","OB6165","Yun Li; Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Yan Zhang; Jian-Hua Xu","6,6-Dimethyl-2-phenyl-4,5,6,7-tetrahydrobenzofuran-4-one","Acta Crystallographica Section E","2002","58","9","o992","o993","10.1107/S1600536802014058","","","0.71073","MoKα","","0.0874","0.0693","","","0.1634","0.1722","","","","","","0.944","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201571","12.4224","0.0004","17.1489","0.0005","5.668","0.0001","90","","90","","90","","1207.46","0.06","163","2","163","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C11 H13 Br N4 O2 -","- C11 H13 Br N4 O2 -","- C44 H52 Br4 N16 O8 -","4","1","OB6166","Gainsford, Graeme J.; Evans, Gary B.","3-Bromo-7-methoxy-2-(tetrahydropyran-2-yl)pyrazolo[4,3-<i>d</i>]pyrimidine","Acta Crystallographica Section E","2002","58","9","o1021","o1022","10.1107/S1600536802014988","","","0.71073","MoKα","","0.072","0.059","","","0.1398","0.147","","","","","","0.99","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201572","13.4628","0.0007","5.8074","0.0003","20.3321","0.0011","90","","96.611","0.01","90","","1579.07","0.15","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Erythro-2-morpholino-1,2-diphenyl ethanol","","- C18 H21 N O2 -","- C18 H21 N O2 -","- C72 H84 N4 O8 -","4","1","OB6167","Karadayı, Nevzat; Kazak, Canan; Öztürk, Sema; Aydın, Meral; Arsu, Nergis; Fun, Hoong-Kun; Büyükgüngör, Orhan","<i>erythro</i>-2-Morpholino-1,2-diphenylethanol","Acta Crystallographica Section E","2002","58","10","o1152","o1153","10.1107/S1600536802016252","","","0.71073","MoKα","","0.0882","0.0543","","","0.1176","0.1321","","","","","","0.728","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201573","8.284","0.002","10.488","0.002","10.916","0.002","90","","103.25","0.02","90","","923.2","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Sodium complex of HQS","(8-hydroxyquinoline-5-sulfonato-N^1^,O^8^)sodium(I)","","- C9 H6 N Na O4 S -","- C9 H6 N Na O4 S -","- C36 H24 N4 Na4 O16 S4 -","4","1","OB6168","Savarimuthu Baskar Raj; Packianathan Thomas Muthiah; Gabriele Bocelli; Rita Olla","Metal-binding modes in sulfoxines: supramolecular network in (8-hydroxyquinoline-5-sulfonato-<i>N</i>^1^,<i>O</i>^8^)sodium(I)","Acta Crystallographica Section E","2002","58","10","m513","m516","10.1107/S1600536802015118","","","0.71069","MoKα","","0.0424","0.031","","","0.0868","0.0911","","","","","","1.005","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201574","13.6479","0.0002","18.8071","0.0002","21.6016","0.0003","90","","90","","90","","5544.64","0.13","123","2","123","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","1,1,1-tris(2-hydroxybenzylideneaminomethyl)propane iron(III)","1,1,1-tris(2-hydroxybenzylideneaminomethyl)propane iron(III)","","- C28 H27 Cl3 Fe N3 O3 -","- C28 H27 Cl3 Fe N3 O3 -","- C224 H216 Cl24 Fe8 N24 O24 -","8","1","OB6169","Reglinski, John; Patykiewicz, Marta","1,1,1-Tris(2-hydroxybenzylideneamino)methylpropane iron(III) chloroform solvate","Acta Crystallographica Section E","2002","58","10","m543","m544","10.1107/S1600536802015921","","","0.71073","MoKα","","0.0608","0.0356","","","0.0792","0.0873","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201575","7.032","0.001","22.455","0.004","11.075","0.002","90","","91.36","0.03","90","","1748.3","0.5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H26 Cl4 Fe2 N4 Ni O2 -","- C36 H26 Cl4 Fe2 N4 Ni O2 -","- C72 H52 Cl8 Fe4 N8 Ni2 O4 -","2","0.5","OB6170","Huang, Guo-Sheng; Li, Yi-Zhi; Ma, Yong-Xiang; Song, Qing-Bao; Liang, Yong-Min","Bis[1-(2,4-dichlorobenzoylhydrazonomethyl)ferrocene(1‒)]nickel(II)","Acta Crystallographica Section E","2002","58","10","m574","m576","10.1107/S1600536802016872","","","0.71073","MoKα","","0.0403","0.0358","","","0.0908","0.094","","","","","","1.008","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201576","3.7659","0.0004","27.486","0.006","11.7723","0.0015","90","","96.677","0.01","90","","1210.3","0.3","298","","298","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H8 Cl N3 O4 -","- C11 H8 Cl N3 O4 -","- C44 H32 Cl4 N12 O16 -","4","1","OB6171","Hiroyuki Ishida; Takeo Fukunaga; Setsuo Kashino","The 1:1 complex of 4-chloro-3-nitrobenzoic acid and pyridazine","Acta Crystallographica Section E","2002","58","10","o1081","o1082","10.1107/S1600536802015933","","","0.71073","MoKα","","0.063","0.046","","","0.073","0.087","","","1.19","","","1.19","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201577","7.059","0.0015","11.7721","0.0013","16.4853","0.0017","90","","93.717","0.013","90","","1367","0.4","300","","300","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H9 Cl N4 O4 -","- C13 H9 Cl N4 O4 -","- C52 H36 Cl4 N16 O16 -","4","1","OB6172","Hiroyuki Ishida; Takeo Fukunaga; Setsuo Kashino","The 1:1 complex of 2-chloro-4-nitrobenzoic acid and 1,2,3-benzotriazole","Acta Crystallographica Section E","2002","58","10","o1083","o1084","10.1107/S1600536802015969","","","0.71073","MoKα","","0.118","0.052","","","0.11","0.132","","","","","","1.06","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201578","11.12","0.003","14.771","0.003","17.414","0.003","90","","95.963","0.018","90","","2844.8","1.1","300","","300","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H10 Cl N3 O4 -","- C14 H10 Cl N3 O4 -","- C112 H80 Cl8 N24 O32 -","8","1","OB6173","Hiroyuki Ishida; Takeo Fukunaga; Setsuo Kashino","Benzimidazolium 2-chloro-4-nitrobenzoate","Acta Crystallographica Section E","2002","58","10","o1085","o1087","10.1107/S1600536802015970","","","0.71073","MoKα","","0.114","0.048","","","0.108","0.134","","","","","","1","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201579","9.7014","0.0003","10.3257","0.0003","17.8823","0.0005","85.994","0.001","86.487","0.001","83.405","0.001","1772.57","0.09","293","2","293","2","","","","","","","","7","P -1","-P 1","2","C32.50 H22 Cl2 N4 O10 Re2 S","(μ-benzenethiolato){Bis((bipyridine)(tricarbonyl))} dirhenium(I)perchloratedichloromethanesolvate","","- C32.5 H22 Cl2 N4 O10 Re2 S -","- C32.5 H22 Cl2 N4 O10 Re2 S -","- C65 H44 Cl4 N8 O20 Re4 S2 -","2","1","OB6174","Chen, Yandan; Zhang, Liyi; Chen, Zhongning","(μ-Benzenethiolato)bis[(bipyridine)tricarbonylrhodium(I)] perchlorate dichloromethane hemisolvate","Acta Crystallographica Section E","2002","58","10","m590","m591","10.1107/S1600536802017129","","","0.71073","MoKα","","0.0483","0.0377","","","0.0953","0.109","","","","","","1.126","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201580","8.6057","0.0011","16.11","0.001","8.9967","0.0011","90","","115.557","0.005","90","","1125.2","0.2","93.1","","93.1","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","propane-2-one 6-chloro-2,4-dinitrophenylhydrazone","","- C9 H9 Cl N4 O4 -","- C9 H9 Cl N4 O4 -","- C36 H36 Cl4 N16 O16 -","4","1","OB6175","Yasushi Kawai; Motoko Hayashi; Norihiro Tokitoh","Propanone 2-chloro-4,6-dinitrophenylhydrazone","Acta Crystallographica Section E","2002","58","10","o1098","o1099","10.1107/S1600536802016483","","","0.7107","MoKα","","","0.03","","","","0.103","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201581","8.787","0.001","10.464","0.001","10.866","0.001","90","","110.67","0.01","90","","934.78","0.17","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H16 N14 Ni -","- C12 H16 N14 Ni -","- C24 H32 N28 Ni2 -","2","0.5","OB6176","Quan-Zheng Zhang; Chuan-De Wu; Wen-Bin Yang; Ya-Qin Yu; Shu-Mei Chen; Xiao-Ping Zhan; Can-Zhong Lu","Diazidotetraimidazolenickel(II)","Acta Crystallographica Section E","2002","58","10","m566","m568","10.1107/S1600536802016884","","","0.71073","MoKα","","0.043","0.0321","","","0.0828","0.0917","","","","","","1.063","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201582","7.5203","0.0001","11.4213","0.0003","22.2986","0.0006","90","","90","","90","","1915.26","0.08","100","1","100","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H22 Fe2 O Si2 -","- C22 H22 Fe2 O Si2 -","- C88 H88 Fe8 O4 Si8 -","4","1","OB6177","Berenbaum, Andrea; Lough, Alan J.; Manners, Ian","An oxygen-bridged bis(sila[1]ferrocenophane), [Fe(η-<i>C</i>~5~H~4~)~2~Si(Me)]~2~O","Acta Crystallographica Section E","2002","58","10","m562","m563","10.1107/S1600536802016690","","","0.71073","MoKα","","0.038","0.0293","","","0.067","0.0693","","","","","","0.997","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201583","14.804","0.002","7.8988","0.0014","9.1216","0.0013","90","","111.732","0.012","90","","990.8","0.3","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","cis-bis(amidinothioureato-N,N)~2~Nickel(II)","","- C4 H10 N8 Ni S2 -","- C4 H10 N8 Ni S2 -","- C16 H40 N32 Ni4 S8 -","4","0.5","OB6178","Kabir, Md. Khayrul; Yamada, Koichi; Adachi, Keiichi; Kondo, Mitsuru; Kawata, Satoshi","<i>cis</i>-Bis(amidinothioureato-κ^2^<i>N,N</i>')nickel(II)","Acta Crystallographica Section E","2002","58","10","m580","m582","10.1107/S1600536802017038","","","0.71069","MoKα","","0.081","0.0527","","","0.1289","0.1336","","","","","","0.986","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201584","9.87","0.003","5.8527","0.0009","14.888","0.003","90","","93.924","0.009","90","","858","0.3","170","2","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C24 H14 N2 -","- C24 H14 N2 -","- C48 H28 N4 -","2","1","OB6179","Khan, Muhammad S.; Ahrens, Birte; Mahon, Mary F.; Male, Louise; Raithby, Paul R.","5,8-Diethynyl-2,3-diphenylquinoxaline","Acta Crystallographica Section E","2002","58","11","o1258","o1260","10.1107/S1600536802018561","","","0.71073","MoKα","","","0.0351","","","","0.0811","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201585","17.623","0.003","5.7385","0.0006","20.089","0.004","90","","112.061","0.002","90","","1882.8","0.5","170","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H20 N2 S Si2 -","- C16 H20 N2 S Si2 -","- C64 H80 N8 S4 Si8 -","4","1","OB6180","Khan, Muhammad S.; Ahrens, Birte; Mahon, Mary F.; Male, Louise; Raithby, Paul R.","4,7-Bis(trimethylsilylethynyl)-2,1,3-benzothiadiazole","Acta Crystallographica Section E","2002","58","11","o1202","o1203","10.1107/S1600536802017993","","","0.71073","MoKα","","","0.0446","","","","0.1161","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201586","13.3931","0.0008","16.2214","0.0012","8.3414","0.0006","90","","122.013","0.003","90","","1536.62","0.19","150","2","150","2","","","","","","","","4","C 1 2 1","C 2y","5","Magnesium acetate ethanol solvate","Poly[hexakis-acetato bis-ethanol trismagnesium(II)] ethanol solvate","","- C20 H42 Mg3 O8 -","- C20 H42 Mg3 O16 -","- C40 H84 Mg6 O32 -","2","0.5","OB6182","Hector, Andrew L.; Mayer, Thomas A.","Poly[[hexaacetatodiethanoltrimagnesium(II)] diethanol solvate], a polymeric acetate-bridged magnesium chain structure","Acta Crystallographica Section E","2002","58","11","m628","m630","10.1107/S1600536802018378","","","0.71073","MoKα","","","0.0361","","","","0.0924","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201587","12.1787","0.0004","16.032","0.0005","17.3628","0.0005","90","","105.223","0.001","90","","3271.11","0.18","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Aquabenzoatobis(1,10-phenanthroline-κ^2^N,N')manganese (II) perchlorate dimethylformamide solvate","","- C34 H30 Cl Mn N5 O8 -","- C34 H30 Cl Mn N5 O8 -","- C136 H120 Cl4 Mn4 N20 O32 -","4","1","OB6183","Zhang, Xiaofeng; Fan, Cheng; Wang, Wenguo; Chen, Changneng; Liu, Qiutian","Aquabenzoatobis(1,10-phenanthroline-κ^2^<i>N,N</i>')manganese(II) perchlorate dimethylformamide solvate","Acta Crystallographica Section E","2002","58","12","m688","m690","10.1107/S1600536802019979","","","0.71073","MoKα","","0.0826","0.0605","","","0.1371","0.1534","","","","","","1.132","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201588","16.2876","0.0008","7.4552","0.0004","17.1415","0.0005","90","","117.075","0.003","90","","1853.34","0.15","93.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Hexacarbonyldicobalt(0) complex of ""Magazine-rack"" molecule, [(η^2^-C~32~H~20~)Co~2~(CO)~6~]","","- C22 H8 Co2 O6 -","- C22 H8 Co2 O6 -","- C88 H32 Co8 O24 -","4","1","OB6184","Orita, Akihiro; Jiang, Lasheng; Ye, Fangguo; Imai, Nobuyuki; Akashi, Haruo; Junzo Otera","Hexacarbonyldicobalt(0) complex of 5,6,11,12-tetradehydrodibenzo[<i>a</i>,<i>e</i>]cyclooctene, [(η^2^-C~16~H~8~)Co~2~(CO)~6~]","Acta Crystallographica Section E","2002","58","12","m748","m749","10.1107/S1600536802021062","","","0.7107","MoKα","","","0.031","","","","0.09","","","","","","0.993","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201589","12.73","0.003","16.873","0.004","18.864","0.004","90","","97.572","0.007","90","","4016.5","1.6","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","[Bis(diphenylphosphino)methane]bis(pyridine-2-thiolato N-oxide)cobalt(III) perchlorate diethyl ether solvate","","- C39 H40 Cl Co N2 O7 P2 S2 -","- C39 H40 Cl Co N2 O7 P2 S2 -","- C156 H160 Cl4 Co4 N8 O28 P8 S8 -","4","1","OB6185","Xu, Hong-Wu; Chen, Zhong-Ning; Wu, Ji-Gui","[Bis(diphenylphosphino)methane]bis(pyridine-2-thiolato <i>N</i>-oxide)cobalt(III) perchlorate diethyl ether solvate","Acta Crystallographica Section E","2002","58","11","m672","m673","10.1107/S1600536802019311","","","0.71073","MoKα","","0.1246","0.0814","","","0.1508","0.1768","","","","","","1.188","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2201590","25.7075","0.0015","10.7351","0.0009","18.8469","0.0014","90","","90","","90","","5201.2","0.7","120","2","120","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","Bis(benzoylmethyltriphenylphosphonium) hexabromocadmate(II)","","- C52 H44 Br6 Cd2 O2 P2 -","- C52 H44 Br6 Cd2 O2 P2 -","- C208 H176 Br24 Cd8 O8 P8 -","4","0.5","OB6186","Baby Mariyatra, Mahimaidoss; Panchanatheswaran, Krishnaswamy; Goeta, Andres E.","Triphenyl(benzoylmethyl)phosphonium hexabromodicadmate(II): supramolecular aggregation through extensive C—H···Br and C—H···O interactions","Acta Crystallographica Section E","2002","58","12","m694","m696","10.1107/S1600536802019955","","","0.71073","MoKα","","0.0404","0.0256","","","0.0534","0.0578","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201591","6.275","0.001","17.438","0.003","22.839","0.003","90","","91.87","0.01","90","","2497.8","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N-(4-Br-benzyl)-pyridinium with 2-thioxo-1,3-dithiole-4,5-dithiolato Nickel(III)","","- C18 H11 Br N Ni S10 -","- C18 H11 Br N Ni S10 -","- C72 H44 Br4 N4 Ni4 S40 -","4","1","OB6187","Tong, Wen-Jun; Liu, Ling; Meng, Qing-Jin; Li, Yi-Zhi","<i>N</i>-(4-Bromobenzyl)pyridinium bis(2-thioxo-1,3-dithiole-4,5-dithiolato)nickel(III)","Acta Crystallographica Section E","2002","58","12","m724","m725","10.1107/S1600536802020342","","","0.71073","MoKα","","0.0906","0.0484","","","0.0721","0.0792","","","","","","1.001","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201592","11.374","0.006","11.669","0.005","13.715","0.006","84.56","0.04","75.64","0.04","75.07","0.04","1703","1.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3-Methyl-1,5-dinitro-9-phenacyl-3-azabicyclo[3.3.1]non-7-en-6-one","","- C17 H17 N3 O6 -","- C17 H17 N3 O6 -","- C68 H68 N12 O24 -","4","2","OB6188","Oleg Ya. Borbulevych; Irina V. Shahkheldyan; Olga V. Leonova; Yuriy M. Atroshchenko; Elena. N. Alifanova","3-Methyl-1,5-dinitro-9-phenacyl-3-azabicyclo[3.3.1]non-7-en-6-one","Acta Crystallographica Section E","2002","58","12","o1363","o1364","10.1107/S160053680202041X","","","0.71073","MoKα","","0.0832","0.0609","","","0.1569","0.1687","","","","","","0.948","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201593","9.905","0.003","19.091","0.005","20.384","0.005","90","","99.18","0.005","90","","3805.2","1.8","293","2","293","2","","","","","","","","6","P 1 n 1","P -2yac","7","","2-(p-Methoxyphenyl)-3-[o-(methylaminothiocarbonyl)phenyl]-1,3,2- oxazaphospholidine 2-sulfide","","- C17 H19 N2 O2 P S2 -","- C17 H19 N2 O2 P S2 -","- C136 H152 N16 O16 P8 S16 -","8","4","OB6189","Sheng-Lou Deng; Dong-Zhi Liu; Wei Li","2-(<i>p</i>-Methoxyphenyl)-3-[<i>o</i>-(methylaminothiocarbonyl)phenyl]-1,3,2-oxazaphospholidine 2-sulfide","Acta Crystallographica Section E","2002","58","12","o1430","o1431","10.1107/S1600536802021219","","","0.71073","MoKα","","0.0925","0.0448","","","0.0861","0.1029","","","","","","0.967","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201594","25.071","0.005","23.872","0.005","26.189","0.005","90","","113.16","0.03","90","","14411","6","199","2","199","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Lithium tetrakis(tri-tert-butoxysilanethiolato)gallate(III)","Lithium tetrakis(tri-tert-butoxysilanethiolato)gallate(III)","","- C48 H108 Ga Li O12 S4 Si4 -","- C48 H108 Ga Li O12 S4 Si4 -","- C384 H864 Ga8 Li8 O96 S32 Si32 -","8","2","OB6190","Katarzyna Baranowska; Jaroslaw Chojnacki; Wieslaw Wojnowski; Evelyn Wurster","Lithium tetrakis(tri-<i>tert</i>-butoxysilanethiolato)gallate(III)","Acta Crystallographica Section E","2002","58","12","m728","m729","10.1107/S160053680202055X","","","0.71073","MoKα","","0.0651","0.0425","","","0.1039","0.1107","","","","","","0.908","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201595","9.8088","0.0003","10.608","0.0003","12.0502","0.0004","93.5","0.002","110.936","0.002","114.273","0.002","1035.21","0.06","180","2","180","2","","","","","","","","5","P 1","P 1","1","CUmof-5","catena-Poly[[[diaquacadmium(II)]-di-μ-4,4'-trimethylenedipyridine-κ^2^N:N'] dinitrate 4,4'-trimethylenedipyridine monohydrate]","","- C39 H48 Cd N8 O9 -","- C39 H48 Cd N8 O9 -","- C39 H48 Cd N8 O9 -","1","1","OB6191","Almeida Paz, Filipe A.; Bond, Andrew D.; Khimyak, Yaroslav Z.; Klinowski, Jacek","<i>catena</i>-Poly[[[diaquacadmium(II)]-di-μ-4,4'-trimethylenedipyridine-κ^2^<i>N</i>:<i>N</i>'] dinitrate 4,4'-trimethylenedipyridine monohydrate]","Acta Crystallographica Section E","2002","58","12","m730","m732","10.1107/S1600536802020573","","","0.7107","MoKα","","0.0257","0.0255","","","0.066","0.0663","","","","","","1.046","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201596","12.484","0.001","16.742","0.001","18.267","0.001","90","","102.82","0.01","90","","3722.8","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetrabutylammonium tetrakis(nitrato-κ^2^O,O')[1,3,5-tris(pyrazolyl)methane-κ^3^N]cerate(III)","","- C26 H46 Ce N11 O12 -","- C26 H46 Ce N11 O12 -","- C104 H184 Ce4 N44 O48 -","4","1","OB6192","Chen, Shu-Jian; Li, Yi-Zhi; Chen, Xue-Tai; Shi, Yu-Jun; You, Xiao-Zeng","Tetrabutylammonium tetrakis(nitrato-κ^2^<i>O,O</i>')[1,3,5-tris(pyrazolyl)methane-κ^3^<i>N</i>]cerate(III)","Acta Crystallographica Section E","2002","58","12","m753","m755","10.1107/S1600536802021177","","","0.71073","MoKα","","0.0653","0.0426","","","0.0884","0.0917","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201597","8.3399","0.0002","27.2748","0.0006","9.6593","0.0001","90","","98.588","0.001","90","","2172.56","0.07","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H20 N2 Ni2 O15 -","- C14 H20 N2 Ni2 O15 -","- C56 H80 N8 Ni8 O60 -","4","1","OB6193","Yi-Hang Wen; Zhao-Ji Li; Ye-Yan Qin; Yao Kang; Yu-Biao Chen; Jian-Kai Cheng; Yuan-Gen Yao","Pentaaqua(μ-pyridine-2,6-dicarboxylato-<i>N,O,O</i>',<i>O</i>'')(pyridine-2,6-dicarboxylato-<i>N,O,O</i>'')dinickel(II) dihydrate","Acta Crystallographica Section E","2002","58","12","m762","m764","10.1107/S1600536802021669","","","0.71073","MoKα","","0.0514","0.0411","","","0.1037","0.1121","","","","","","0.954","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201598","9.033","0.0004","10.2107","0.0005","24.5414","0.0012","90","","90","","90","","2263.53","0.19","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Methyl (1SR,8RS,10SR)-3,5-dichloro-1-(4-methoxyphenyl)-8-(phenylthio)-11- oxa-4-azatricyclo[6.2.1.0^2,7^]undeca-2,4,6-triene-10-carboxylate","","- C24 H19 Cl2 N O4 S -","- C24 H19 Cl2 N O4 S -","- C96 H76 Cl8 N4 O16 S4 -","4","1","OB6194","Anwar Usman; Tarun K. Sarkar; Sankar Basak; Niranjan Panda; Hoong-Kun Fun","Methyl (1<i>SR</i>,8<i>RS</i>,10<i>SR</i>)-3,5-dichloro-1-(4-methoxyphenyl)-8-(phenylthio)-11-oxa-4-azatricyclo[6.2.1.0^2,7^]undeca-2,4,6-triene-10-carboxylate","Acta Crystallographica Section E","2002","58","12","o1402","o1404","10.1107/S1600536802021013","","","0.71073","MoKα","","0.0357","0.0303","","","0.0742","0.0777","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201599","9.5923","0.0008","10.1129","0.0008","10.9661","0.0009","112.886","0.002","94.278","0.002","117.285","0.002","828.42","0.12","160","2","160","2","","","","","","","","3","P -1","-P 1","2","","(11SR,15SR)-9,10,11,15-Tetrahydro-9-[(1SR)-1-methoxyethyl]- 9,10-[3',4']furanoanthracene-12,14-dione","","- C21 H18 O4 -","- C21 H18 O4 -","- C42 H36 O8 -","2","1","OB6195","Clegg, William; Harrington, Ross W.","(11<i>SR</i>,15<i>SR</i>)-9,10,11,15-Tetrahydro-9-[(1<i>SR</i>)-1-methoxyethyl]-9,10-[3',4']furanoanthracene-12,14-dione","Acta Crystallographica Section E","2002","58","12","o1411","o1412","10.1107/S1600536802021311","","","0.71073","MoKα","","0.065","0.0511","","","0.1068","0.112","","","","","","1.129","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201600","10.7625","0.0007","9.685","0.0006","16.7021","0.0011","90","","93.067","0.002","90","","1738.45","0.19","160","2","160","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(3aSR,9aSR)-3a,4,9,9a-Tetrahydro-4-[(1SR)-1-methoxyethyl]-2-methyl- 4,9-[1',2-]benzeno-1H-benzo[f]isoindole-1,3-(2H)-dione","","- C22 H21 N O3 -","- C22 H21 N O3 -","- C88 H84 N4 O12 -","4","1","OB6196","Clegg, William; Harrington, Ross W.","(3a<i>SR</i>,9a<i>S</i>R)-3a,4,9,9a-Tetrahydro-4-[(1<i>SR</i>)-1-methoxyethyl]-2-methyl-4,9-[1',2']benzeno-1<i>H</i>-benzo[<i>f</i>]isoindole-1,3-(2<i>H</i>)-dione","Acta Crystallographica Section E","2002","58","12","o1413","o1414","10.1107/S1600536802021323","","","0.71073","MoKα","","0.0565","0.0481","","","0.1143","0.1196","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201601","11.986","0.002","12.387","0.006","9.2183","0.0013","90","","110.293","0.014","90","","1283.7","0.7","295","","295","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-[2-(Phenylsulfonyl)ethyl]cyclopentanone","","- C13 H16 O3 S -","- C13 H16 O3 S -","- C52 H64 O12 S4 -","4","1","OB6199","Wendy A. Loughlin; Michelle A. McCleary; Peter C. Healy","2-[2'-(Phenylsulfonyl)ethyl]cyclopentanone","Acta Crystallographica Section E","2002","58","12","o1418","o1420","10.1107/S1600536802021335","","","0.71069","MoKa","","0.0648","0.0422","","","0.1171","0.1303","","","","","","1.032","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201602","12.1239","0.0015","14.1289","0.0017","14.8381","0.0018","90","","90","","90","","2541.7","0.5","100","2","100.01","0.02","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","beclomethasone dipropionate anhydrous","9α-chloro-16β-methyl-3,20-dioxo-1,4-pregnadiene-11β,17,21-triol 17,21-dipropionate","","- C28 H37 Cl O7 -","- C28 H37 Cl O7 -","- C112 H148 Cl4 O28 -","4","1","OM6090","Jeffrey W. Millard; Paul B. Myrdal","Anhydrous beclomethasone dipropionate","Acta Crystallographica Section E","2002","58","7","o712","o714","10.1107/S1600536802009406","","","0.71073","MoKα","","0.0333","0.0297","","","0.0698","0.072","","","","","","1.068","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201603","37.557","0.007","7.0816","0.0014","22.498","0.004","90","","124.86","0.03","90","","4910","2","150","2","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C29 H27 O8 -","- C29 H27 O8 -","- C232 H216 O64 -","8","1","OM6092","Coles, Simon J.; Gale, Philip A.; Hursthouse, Michael B.; Warriner, Colin N.","Tetramethyl biphenyl-3,5,3',5'-tetracarboxylate benzene sesquisolvate","Acta Crystallographica Section E","2002","58","8","o887","o888","10.1107/S1600536802010978","","","0.71073","MoKα","","","0.0527","","","","0.1481","","","","","","1.011","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201604","13.0046","0.0007","14.071","0.001","7.9235","0.0008","92.79","0.02","96.95","0.02","71.85","0.01","1367.5","0.2","273","","273","","","","","","","","","5","P -1","-P 1","2","","","","- C25 H33 B3 N2 O5 -","- C25 H33 B3 N2 O5 -","- C50 H66 B6 N4 O10 -","2","1","OM6095","Wolfgang Kliegel; Klaus Drückler; Brian O. Patrick; Steven J. Rettig; James Trotter","Triphenylboroxin <i>N,N</i>-diethylhydroxylamine adduct (dimethylformamide solvate)","Acta Crystallographica Section E","2002","58","8","o831","o833","10.1107/S1600536802011820","","","0.7107","MoKα","","0.164","0.081","","0.264","","0.264","","","1.4","","","1.4","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2201605","7.0647","0.0008","12.0073","0.0013","8.1788","0.0011","90","","103.247","0.008","90","","675.33","0.14","120","","120","","","","","","","","","3","P 1 21 1","P 2yb","4","peruvin","(3aR,4aS,7aR,8S,9aR)-decahydro-7a-hydroxy-4a,8-dimethyl- methylene-azuleno[6,5-b]furan-2,5-dione","","- C15 H20 O4 -","- C15 H20 O4 -","- C30 H40 O8 -","2","1","OM6096","Fronczek, Frank R.","The pseudoguaianolide peruvin","Acta Crystallographica Section E","2002","58","8","o871","o873","10.1107/S1600536802011832","","","1.5418","CuKα","","0.037","0.037","","","0.109","0.109","","","","","","1.097","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201606","7.646","0.002","11.633","0.002","23.709","0.004","90","","97.385","0.006","90","","2091.3","0.7","120","","120","","","","","","","","","3","P 1 21 1","P 2yb","4","melampodinone","","","- C21 H22 O10 -","- C21 H22 O10 -","- C84 H88 O40 -","4","2","OM6097","Fronczek, Frank R.; Fischer, Nikolaus H.","Melampodinone","Acta Crystallographica Section E","2002","58","8","o874","o876","10.1107/S1600536802011844","","","0.71073","MoKα","","0.056","0.042","","","0.083","0.09","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201607","10.929","0.003","10.976","0.003","14.843","0.003","90","","109.745","0.012","90","","1675.8","0.7","120","","120","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","atranorin","Methyl 4-(3-formyl-2,4-dihydroxy-6-methyl-benzoyloxy)-2-hydroxy- 3,6-dimethyl-benzoate","","- C19 H18 O8 -","- C19 H18 O8 -","- C76 H72 O32 -","4","1","OM6098","Liu, Yen-Hsiang; Robbs, Steven L.; Fronczek, Frank R.; Watkins, Steven F.; Fischer, Nikolaus H.","A new polymorph of atranorin, a lichen paradepside","Acta Crystallographica Section E","2002","58","8","o877","o878","10.1107/S1600536802011856","","","0.71073","MoKα","","0.08","0.05","","","0.1162","0.1366","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201608","16.279","0.001","10.5194","0.0008","19.68","0.002","90","","96.935","0.001","90","","3345.5","0.5","173","2","173","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","rac-1,2-bis(1,4-di-tertbutylcyclopentadiene)-1,2-di-tertbutylethane dimer","rac-3,4-bis(1,4-di-tertbutylcyclopenta-1,3-dien-2-yl)-2,2,5,5-tetramethyl- hexane","","- C36 H62 -","- C36 H62 -","- C144 H248 -","4","1","OM6099","Bragg, Sarah; Johnson, Jane E.B.; Graziano, Gina M.; Balaich, Gary J.; Heimer, Norman E.","New <i>C</i>2-symmetric cyclopentadiene dimer from sodium naphthalenide reduction of 1,3,6-tri-<i>tert</i>-butylfulvene","Acta Crystallographica Section E","2002","58","9","o1010","o1012","10.1107/S1600536802013089","","","0.71073","MoKα","","0.0917","0.0596","","","0.1412","0.158","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201609","16.056","0.001","9.1258","0.0005","17.005","0.001","90","","98.796","0.001","90","","2462.3","0.3","128","2","128","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C21 H36 F3 O4 P Ru S -","- C21 H36 F3 O4 P Ru S -","- C84 H144 F12 O16 P4 Ru4 S4 -","4","1","OM6100","Jill Fuss; Valerie C. Pierre; Karl A. Tupper","Carbonyl(η^5^-pentamethylcyclopentadienyl)(triflato-<i>O</i>)(triisopropylphosphine-<i>P</i>)ruthenium(II)","Acta Crystallographica Section E","2002","58","9","m482","m483","10.1107/S1600536802013399","","","0.71073","MoKα","","0.0536","0.0378","","0.0969","","0.0886","","","1.047","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201610","7.493","0.005","21.276","0.005","8.024","0.005","90","","113.508","0.005","90","","1173","1.1","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H9 N O3 -","- C16 H9 N O3 -","- C64 H36 N4 O12 -","4","1","OM6102","Guilardi, Silvana; Machado, Antonio Eduardo da Hora; Resende, Jackson Antônio Lamounier Camargos; Franca, Eduardo de Faria","3-(Benzoxazol-2-yl)cromem-2-one","Acta Crystallographica Section E","2002","58","9","o985","o987","10.1107/S1600536802013740","","","0.71073","MoKα","","","0.0553","","","","0.1198","","","","","","0.803","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201611","13.66","0.001","19.504","0.003","14.433","0.002","90","","106.626","0.008","90","","3684.5","0.8","294","","294","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C37 H50 B3 N2 O5 -","- C37 H50 B3 N2 O5 -","- C148 H200 B12 N8 O20 -","4","1","OM6103","Wolfgang Kliegel; Gottfried Lubkowitz; Brian O. Patrick; Steven J. Rettig; James Trotter","Triphenylboroxin complex with <i>N</i>-cyclohexylhydroxylamine and its isobutyraldehyde nitrone","Acta Crystallographica Section E","2002","58","9","o1034","o1037","10.1107/S1600536802015052","","","1.54178","CuKα","","","0.047","","0.057","","0.057","","","","","","1.89","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201612","5.737","0.002","12.438","0.002","9.777","0.002","90","","102.59","0.02","90","","680.9","0.3","290","2","290","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","3-pentafluorothiopropionic acid","","","- C3 H5 F5 O2 S -","- C3 H5 F5 O2 S -","- C12 H20 F20 O8 S4 -","4","1","OM6104","Yokochi, Alex F. T.; Winter, Richard; Gard, Gary","3-Pentafluorothiopropionic acid","Acta Crystallographica Section E","2002","58","10","o1133","o1135","10.1107/S1600536802016793","","","1.54178","CuKα","","0.1133","0.0558","","","0.1138","0.1376","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201613","11.438","0.002","11.438","0.002","14.284","0.002","90","","90","","90","","1868.7","0.5","296","","296","","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","Cyclopropyl meta-nitrophenyl ketone","","- C10 H9 N O3 -","- C10 H9 N O3 -","- C80 H72 N8 O24 -","8","1","OM6108","Kolb, Vera M.; Donahue, Matthew G.; Putnam, Eric A.; Meyers, Cal Y.; Robinson, Paul D.","Cyclopropyl <i>m</i>-nitrophenyl ketone","Acta Crystallographica Section E","2002","58","10","o1161","o1163","10.1107/S1600536802017142","","","0.71069","MoKα","","0.107","0.04","","","0.085","0.105","","","","","","0.976","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201614","29.425","0.009","6.1454","0.0009","13.739","0.002","90","","96.38","0.01","90","","2469","0.9","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Methyl 3-ferrocenylpropanoate","Methyl 3-ferrocenylpropanoate","","- C14 H16 Fe O2 -","- C14 H16 Fe O2 -","- C112 H128 Fe8 O16 -","8","1","OM6109","Mario Cetina; Draginja Mrvoš-Sermek; Marijana Jukić; Vladimir Rapić","Methyl 3-ferrocenylpropanoate","Acta Crystallographica Section E","2002","58","11","m676","m678","10.1107/S1600536802019141","","","0.71073","MoKα","","0.0488","0.0357","","","0.0936","0.0991","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201615","8.7813","0.001","8.8586","0.001","16.1136","0.0018","103.703","0.002","105.009","0.002","94.87","0.002","1161.9","0.2","153","2","153","2","","","","","","","","5","P -1","-P 1","2","bis(di-2-pyridylmethanediol-N,N')iron(III) nitrate dihydrate","bis(bis(2-Pyridyl)(hydroxy)methanolato-O,N,N')-iron(III) nitrate dihydrate","","- C22 H22 Fe N5 O9 -","- C22 H22 Fe N5 O9 -","- C44 H44 Fe2 N10 O18 -","2","1","OM6111","Woltz, James; Westcott, Barry L.; Crundwell, Guy; Zeller, Matthias; Hunter, Allen D.; Sommerer, Shaun O.","Bis(di-2-pyridylmethanediol-κ^2^<i>N,N</i>')iron(III) nitrate dihydrate","Acta Crystallographica Section E","2002","58","11","m609","m610","10.1107/S1600536802017798","","","0.71073","MoKα","","0.0486","0.0422","","","0.1044","0.1084","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201616","5.787","0.0012","9.4205","0.0019","13.242","0.003","90","","92.81","0.03","90","","721","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Diaqua(N-salicylidene-L-2-phenylglycinate-κ^3^N,O,O')copper(II)","","- C15 H15 Cu N O5 -","- C15 H15 Cu N O5 -","- C30 H30 Cu2 N2 O10 -","2","1","OM6112","Weng, Jiabao; Hong, Maochun; Cao, Rong; Bi, Wenhua; Albert S. C. Chan","Diaqua(<i>N</i>-salicylidene-<small>L</small>-2-phenylglycinate-κ^3^<i>N,O,O</i>')copper(II)","Acta Crystallographica Section E","2002","58","12","m746","m747","10.1107/S1600536802020706","","","0.71073","MoKα","","","0.0246","","","0.0441","0.046","","","","","","0.85","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201617","7.8213","0.0014","11.1055","0.0013","11.494","0.002","90.003","0.018","106.098","0.015","102.96","0.014","932.7","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","LDS 698","2-{4-[4-(Dimethylamino)phenyl]-1,3-butadienyl}-1-ethylpyridinium perchlorate","","- C19 H23 Cl N2 O4 -","- C19 H23 Cl N2 O4 -","- C38 H46 Cl2 N4 O8 -","2","1","OM6113","Jerry P. Jasinski; John M. Jasinski; Daniel J. Crosby","2-{4-[4-(Dimethylamino)phenyl]-1,3-butadienyl}-1-ethylpyridinium perchlorate","Acta Crystallographica Section E","2002","58","11","o1283","o1284","10.1107/S1600536802019013","","","0.71069","MoKα","","0.1661","0.0458","","","0.1165","0.1594","","","","","","1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201618","9.3624","0.0006","9.835","0.0006","11.5019","0.0007","90","","90","","90","","1059.09","0.11","120","2","120","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Cyclohexyl phenyl ketone","","- C13 H16 O -","- C13 H16 O -","- C52 H64 O4 -","4","1","OM6115","Robinson, Paul D.; Meyers, Cal Y.; Kolb, Vera M.","Cyclohexyl phenyl ketone","Acta Crystallographica Section E","2002","58","11","o1288","o1289","10.1107/S160053680201913X","","","0.71073","MoKα","","0.042","0.031","","","0.076","0.08","","","","","","1.029","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201619","12.2528","0.0018","11.702","0.002","13.263","0.002","90","","110.915","0.01","90","","1776.4","0.5","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Coumarin 545","10-(1,3-Benzothiazol-2-yl)-2,3,6,7-tetrahydro-1H,5H-11H- [1]benzopyrano[6,7,8-ij]-quinoliz-11-one1","","- C22 H18 N2 O2 S -","- C22 H18 N2 O2 S -","- C88 H72 N8 O8 S4 -","4","1","OM6116","Jerry P. Jasinski; Yu Li","10-(1,3-Benzothiazol-2-yl)-2,3,6,7-tetrahydro-1<i>H</i>,5<i>H</i>-11<i>H</i>-[1]benzopyrano[6,7,8-<i>ij</i>]-quinoliz-11-one","Acta Crystallographica Section E","2002","58","11","o1312","o1314","10.1107/S1600536802019517","","","0.71069","MoKα","","0.1298","0.0446","","","0.1076","0.1434","","","","","","1.008","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2201620","17.1677","0.0009","17.1677","0.0009","17.1677","0.0009","90","","90","","90","","5059.8","0.5","150","2","150","2","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","tris(1-propan-1-onyl oxime)amine","","- C9 H18 N4 O3 -","- C9 H18 N4 O3 -","- C144 H288 N64 O48 -","16","0.333333","OM6117","Goldcamp, Michael J.; Krause Bauer, Jeanette A.; Baldwin, Michael J.","Tris(1-propan-2-onyl oxime)amine","Acta Crystallographica Section E","2002","58","12","o1354","o1355","10.1107/S1600536802020135","","","0.71073","MoKα","","0.0434","0.0381","","","0.1014","0.1037","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201621","10.856","0.002","9.815","0.002","14.052","0.003","90","","93.07","0.03","90","","1495.1","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(3-chlorophenyl)-4-(3-chloropropyl)piperazinium chloride","","- C13 H19 Cl3 N2 -","- C13 H19 Cl3 N2 -","- C52 H76 Cl12 N8 -","4","1","OM6118","Homrighausen, Craig L.; Krause Bauer, Jeanette A.","1-(3-Chlorophenyl)-4-(3-chloropropyl)piperazinium chloride","Acta Crystallographica Section E","2002","58","12","o1395","o1396","10.1107/S1600536802021025","","","0.71073","MoKα","","0.0719","0.0474","","","0.1136","0.1296","","","","","","1.017","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201622","13.976","0.002","15.38","0.004","7.0465","0.0018","90","","101.38","0.02","90","","1484.9","0.6","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H14 N4 O4 -","- C15 H14 N4 O4 -","- C60 H56 N16 O16 -","4","1","OM6120","Shang Shan; Duan-Jun Xu; Jing-Yun Wu; Michael Y. Chiang","Propiophenone 2,4-dinitrophenylhydrazone","Acta Crystallographica Section E","2002","58","12","o1444","o1445","10.1107/S160053680202175X","","","0.71069","MoKα","","0.173","0.043","","","0.104","0.151","","","","","","0.947","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201623","15.789","0.004","11.68","0.005","8.726","0.0013","90","","92.296","0.016","90","","1607.9","0.8","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2(S),6(R)-Dimethyl-4-(4-methoxyphenyl)-5(R)-ethyl-3-cyclohexene-1(S)- carboxylic acid","","- C18 H24 O3 -","- C18 H24 O3 -","- C72 H96 O12 -","4","1","OM6121","Xie, Songwen; Hou, Yuqing; Meyers, Cal Y.; Robinson, Paul D.","2(<i>S</i>),6(<i>R</i>)-Dimethyl-4-(4-methoxyphenyl)-5(<i>R</i>)-ethyl-3-cyclohexene-1(<i>S</i>)-carboxylic acid and its enantiomer: potential therapeutic agents for prostate cancer","Acta Crystallographica Section E","2002","58","12","o1460","o1462","10.1107/S1600536802021748","","","0.71069","MoKα","","0.16","0.041","","","0.097","0.134","","","","","","0.982","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201624","9.489","0.006","6.248","0.004","13.062","0.008","90","","100.28","0.01","90","","762","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 N4 O2 -","- C16 H18 N4 O2 -","- C32 H36 N8 O4 -","2","0.5","SU6000","An-Wu Xu; Hua-Xin Zhang; Hai-Yan Tan; Bei-Sheng Kang","<i>N,N</i>'-Bis(2-pyridylethyl)oxamide","Acta Crystallographica Section E","2002","58","10","o1164","o1165","10.1107/S1600536802017452","","","0.71073","MoKα","","0.0529","0.0399","","","0.1575","0.1808","","","","","","1.062","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2201625","19.6834","0.001","9.8097","0.0005","12.8171","0.0007","90","","103.403","0.001","90","","2407.4","0.2","183","2","183","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H26 N2 O2 S4 Zn -","- C22 H26 N2 O2 S4 Zn -","- C88 H104 N8 O8 S16 Zn4 -","4","0.5","SU6001","Soh, Shu Fang; Lai, Chian Sing; Tiekink, Edward R. T.","(4,7-Dimethyl-1,10-phenanthroline)bis(<i>O</i>-isopropropyldithiocarbonato)zinc(II)","Acta Crystallographica Section E","2002","58","11","m641","m643","10.1107/S1600536802018433","","","0.71069","MoKα","","0.028","0.027","","","0.075","0.076","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201626","6.163","0.004","21.801","0.005","16.069","0.003","90","","93.73","0.03","90","","2154.5","1.5","293","","293","1","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","6,13-dihydropentacene?","","- C66 H46 -","- C66 H46 -","- C132 H92 -","2","0.5","SU6002","Mattheus, Christine C.; Baas, Jacob; Meetsma, Auke; Boer, Jan L. de; Kloc, Christian; Siegrist, Theo; Palstra, Thomas T.M.","A 2:1 cocrystal of 6,13-dihydropentacene and pentacene","Acta Crystallographica Section E","2002","58","11","o1229","o1231","10.1107/S1600536802018445","","","0.71073","MoKα","","0.1992","0.0639","","","0.1058","0.1509","","","","","","0.932","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201627","13.671","0.003","10.641","0.002","11.781","0.002","90","","96.6","0.03","90","","1702.5","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2,2-Pentamethylene-4,5-imidazolidinedione","","","- C8 H12 N2 O2 -","- C8 H12 N2 O2 -","- C64 H96 N16 O16 -","8","2","SU6004","Daniel Stasko; Matthew C. Davis; Robert D. Chapman","1,4-Diazaspiro[4.5]decane-2,3-dione","Acta Crystallographica Section E","2002","58","12","o1384","o1386","10.1107/S1600536802020482","","","0.71073","MoKα","","0.0791","0.0459","","","0.093","0.1065","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201628","13.19","0.005","7.003","0.003","14.326","0.004","90","","102.14","0.03","90","","1293.7","0.8","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","3,4,6-Tris(pyrazol-1-yl)pyridazine","3,4,6-Tris(pyrazol-1-yl)pyridazine","","- C13 H10 N8 -","- C13 H10 N8 -","- C52 H40 N32 -","4","1","SU6005","Blake, Alexander J.; Hubberstey, Peter; Mackrell, Alexander D.","3,4,6-Tris(pyrazol-1-yl)pyridazine","Acta Crystallographica Section E","2002","58","12","o1408","o1410","10.1107/S1600536802020925","","","0.71073","MoKα","","0.173","0.081","","","0.127","0.168","","","","","","1.187","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201629","12.34","0.001","10.38","0.001","20.321","0.002","90","","90","","90","","2602.9","0.4","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","1,4,7,11,14,17-Hexaazacycloicosane-9,19-diol hexahydrobromide","","- C14 H40 Br6 N6 O2 -","- C14 H40 Br6 N6 O2 -","- C56 H160 Br24 N24 O8 -","4","0.5","TK6064","Liang, Feng; Li, Yi-Zhi; Wu, Cheng-Tai; Liu, Si-Min","1,4,7,11,14,17-Hexaazacycloicosane-9,19-diol hexahydrobromide","Acta Crystallographica Section E","2002","58","8","m950","m952","10.1107/S1600536802012187","","","0.71073","MoKα","","0.056","0.039","","","0.086","0.088","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201630","5.1016","0.0013","26.753","0.005","8.8805","0.0015","90","","96.031","0.016","90","","1205.3","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H16 N4 S8 -","- C18 H16 N4 S8 -","- C36 H32 N8 S16 -","2","0.5","TK6065","Liu, Guoqun; Xue, Gang; Yu, Wentao; Xu, Wen; Fang, Qi","2,3,6,7-Tetrakis(2-cyanoethylthio)tetrathiafulvalene","Acta Crystallographica Section E","2002","58","8","o842","o844","10.1107/S1600536802012199","","","0.71073","MoKα","","0.077","0.065","","","0.172","0.182","","","","","","1.1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201631","10.953","0.015","11.45","0.008","7.118","0.004","94.56","0.05","105.61","0.07","117.61","0.06","739.7","1.4","295","2","295","2","","","","","","","","4","P -1","-P 1","2","Benzylammonium 3,5-dinitrosalicylate","","","- C14 H13 N3 O7 -","- C14 H13 N3 O7 -","- C28 H26 N6 O14 -","2","1","TK6066","Graham Smith; Urs D. Wermuth; Peter C. Healy","The 1:1 proton-transfer compound of benzylamine with 3,5-dinitrosalicylic acid","Acta Crystallographica Section E","2002","58","8","o845","o847","10.1107/S1600536802012163","","","0.71069","MoKα","","0.14","0.056","","","0.17","0.217","","","","","","0.88","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201632","12.065","0.005","12.065","0.005","9.633","0.008","90","","90","","120","","1214.4","1.2","168","2","168","2","","","","","","","","4","R 3 :H","R 3","146","","","","- C12 H30 N2 O7 -","- C12 H30 N2 O7 -","- C36 H90 N6 O21 -","3","0.333333","TK6067","Kemmitt, Tim; Gainsford, Graeme J.; Steel, Peter J.; Wikaira, Jan","Four-centre hydrogen bonds: a triethanolamine‒triethanolamine oxide complex","Acta Crystallographica Section E","2002","58","8","o851","o852","10.1107/S1600536802012175","","","0.71073","MoKα","","0.097","0.061","","","0.113","0.134","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201633","40.66","0.02","29.4","0.01","9.267","0.004","90","","90","","90","","11078","8","158.2","0.2","293","2","","","","","","","","6","F d d 2","F 2 -2d","43","","(1RS,7RS,8RS,14SR-5,12-Dimethyl-7,14-diphenyl-1,4,8,11- tetraazacyclotetradeca-4,11-diene-N^1^,N^4^,N^8^,N^11^)nickel(II) Perchlorate","","- C24 H32 Cl2 N4 Ni O8 -","- C24 H32 Cl2 N4 Ni O8 -","- C384 H512 Cl32 N64 Ni16 O128 -","16","1","TK6068","Neil F. Curtis; David C. Weatherburn","[(1<i>RS</i>,7<i>RS</i>,8<i>RS</i>,14<i>RS</i>)-5,12-Dimethyl-7,14-diphenyl-1,4,8,11-tetraazacyclotetradeca-4,11-diene-κ^4^<i>N</i>^1,4,8,11^]nickel(II) perchlorate","Acta Crystallographica Section E","2002","58","8","m423","m425","10.1107/S1600536802012205","","","0.71073","MoKα","","0.092","0.041","","","0.078","0.083","","","","","","0.76","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201634","13.819","0.004","22.55","0.007","20.23","0.006","90","","108.53","0.01","90","","5977","3","168","2","168","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","Bis[μ-bis(diphenylphosphino)methane-κ^2^P:P']bis[(saccharinato- κN)palladium(I)] dichloromethane solvate","","- C65 H54 Cl2 N2 O6 P4 Pd2 S2 -","- C65 H54 Cl2 N2 O6 P4 Pd2 S2 -","- C260 H216 Cl8 N8 O24 P16 Pd8 S8 -","4","1","TK6069","Henderson, William; Nicholson, Brian K.; Chung, Dong C.","Bis[μ-bis(diphenylphosphino)methane-κ^2^<i>P</i>:<i>P</i>']bis[(saccharinato-κ<i>N</i>)palladium(I)] dichloromethane solvate","Acta Crystallographica Section E","2002","58","8","m432","m433","10.1107/S1600536802012515","","","0.71073","MoKα","","0.031","0.025","","","0.065","0.068","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201635","8.1766","0.0002","8.8854","0.0002","23.0888","0.0003","90","","90","","90","","1677.46","0.06","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","trans-2-(2-Naphthyl)-3-(phenylselenyl)tetrahydropyran","","- C21 H20 O Se -","- C21 H20 O Se -","- C84 H80 O4 Se4 -","4","1","TK6070","Rickard, Clifton E. F.; Brimble, Margaret A.; Pavia, Gabrielle; Stevenson, Ralph J.","<i>trans</i>-2-(2-Naphthyl)-3-(phenylselenyl)tetrahydropyran","Acta Crystallographica Section E","2002","58","8","o931","o932","10.1107/S1600536802013260","","","0.71073","MoKα","","0.029","0.026","","","0.064","0.065","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201636","7.1823","0.0004","7.7739","0.0004","13.9367","0.0007","97.18","0.002","97.654","0.002","94.793","0.002","761.18","0.07","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","cis-2-(2-Methoxyphenyl)-3-(phenylselenyl)tetrahydropyran","","- C18 H20 O2 Se -","- C18 H20 O2 Se -","- C36 H40 O4 Se2 -","2","1","TK6071","Rickard, Clifton E. F.; Brimble, Margaret A.; Pavia, Gabrielle; Stevenson, Ralph J.","<i>cis</i>-2-(2-Methoxyphenyl)-3-(phenylselenyl)tetrahydropyran","Acta Crystallographica Section E","2002","58","8","o933","o934","10.1107/S1600536802013272","","","0.71073","MoKα","","0.02","0.019","","","0.051","0.052","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201637","8.901","0.002","7.539","0.001","11.905","0.002","90","","103.97","0.01","90","","775.3","0.2","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Al2 B2 O7 Rb2 -","- Al2 B2 O7 Rb2 -","- Al8 B8 O28 Rb8 -","4","1","","Judith L. Kissick; Douglas A. Keszler","Rb~2~Al~2~B~2~O~7~","Acta Crystallographica, Section E","2002","58","","i85","i87","10.1107/S1600536802015659","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2201638","11.945","0.004","13.225","0.005","16.78","0.006","76.159","0.005","80.985","0.005","88.763","0.005","2541.7","1.6","168","2","168","2","","","","","","","","4","P -1","-P 1","2","","","","- H60 N10 O51 W12 -","- N10 O51 W12 -","- N20 O102 W24 -","2","1","TK6075","Gainsford, Graeme J.; Chong, S. V.; Ingham, B.; Tallon, J. L.","Decaammonium dodecatungstate nonahydrate, (NH~4~)~10~[H~2~W~12~O~42~]·9H~2~O: anionic `isomorphism'","Acta Crystallographica Section E","2002","58","10","i93","i94","10.1107/S1600536802016963","","","0.71073","MoKα","","0.067","0.051","","","0.125","0.128","","","","","","0.99","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201639","7.688","0.003","10.122","0.005","16.212","0.007","94.808","0.006","100.973","0.005","109.2","0.005","1155","0.9","170","2","170","2","","","","","","","","7","P -1","-P 1","2","","","","- C21 H26 Cl2 N2 O2 S Ti -","- C21 H26 Cl2 N2 O2 S Ti -","- C42 H52 Cl4 N4 O4 S2 Ti2 -","2","1","TK6076","Lensink, Cornelis; Gainsford, Graeme J.; Brandsma, Menno J.R.","Bis(μ-<i>N</i>-(3-[3-indenyl]propyl-<i>p</i>-toluenesulfamido-<i>N,O,O</i>')-dimethylamidodichorotitanium)","Acta Crystallographica Section E","2002","58","10","m519","m520","10.1107/S1600536802015787","","","0.71073","MoKα","","0.114","0.052","","","0.118","0.14","","","","","","0.94","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201640","10.987","0.002","10.98","0.002","14.681","0.003","85.99","0.03","84.85","0.03","87.69","0.03","1758.6","0.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H98 N10 O50 W12 -","- C24 H48 N10 O50 W12 -","- C24 H48 N10 O50 W12 -","1","0.5","TK6077","Gainsford, Graeme J.; Robinson, Natalie; Tallon, J. L.","(NH~4~)~2~(NH~3~(CH~2~)~6~NH~3~)~4~[H~2~W~12~O~42~]·8H~2~O: a novel ammonium 1,6-hexanediammonium dodecatungstate","Acta Crystallographica Section E","2002","58","10","m521","m523","10.1107/S1600536802015799","","","0.9204","synchrotron","","0.039","0.038","","","0.103","0.103","","","","","","1.09","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2201641","7.6919","0.0008","8.1526","0.0009","12.2337","0.0015","87.249","0.009","88.694","0.008","89.414","0.007","766.05","0.15","293","2","293","2","","","","","","","","5","P 1","P 1","1","Nicotinium tetrachlorocuprate(II)","Nicotinium tetrachlorocuprate(II)","","- C10 H16 Cl4 Cu N2 -","- C10 H16 Cl4 Cu N2 -","- C20 H32 Cl8 Cu2 N4 -","2","2","TK6078","Choi, Sung-Nak; Lee, Yong-Min; Lee, Hong-Woo; Kang, Sung Kwon; Kim, Young-Inn","Nicotinium tetrachlorocuprate(II)","Acta Crystallographica Section E","2002","58","10","m583","m585","10.1107/S1600536802017154","","","0.71073","MoKα","","0.052","0.038","","","0.085","0.099","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201642","11.434","0.002","10.63","0.002","20.948","0.004","90","","100.12","0.03","90","","2506.5","0.8","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[RhCl~3~{2,6-bis(3,4-dihydro-2H-pyrrol-5-yl)pyridine}] benzene solvate","","- C25 H27 Cl3 N3 Rh -","- C25 H27 Cl3 N3 Rh -","- C100 H108 Cl12 N12 Rh4 -","4","0.5","TK6079","Cabort, Amel; Therrien, Bruno; Bernauer, Klaus; Süss-Fink, Georg","[2,6-Bis(3,4-dihydro-2<i>H</i>-pyrrol-5-yl)pyridine]trichlororhodium(III) dibenzene solvate","Acta Crystallographica Section E","2002","58","10","m564","m565","10.1107/S1600536802016896","","","0.71073","MoKα","","0.032","0.026","","","0.058","0.059","","","","","","0.98","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201643","12.641","0.003","20.24","0.005","6.051","0.002","90","","90","","90","","1548.2","0.7","295","","295","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H22 O3 S -","- C16 H22 O3 S -","- C64 H88 O12 S4 -","4","1","TK6080","Wendy A. Loughlin; Michelle A. McCleary; Peter C. Healy","2,6-Dimethyl-2-[2'-(phenylsulfonyl)ethyl]cyclohexanone","Acta Crystallographica Section E","2002","58","11","o1280","o1282","10.1107/S1600536802019037","","","0.71069","MoKα","","0.098","0.042","","","0.107","0.125","","","","","","0.99","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201644","18.271","0.006","16.941","0.005","20.221","0.006","90","","90","","90","","6259","3","170","2","170","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","bis(methyliminodiethanolato-κ^5^O:O,N,O':O')tetra-μ-n-propanolato-κ^8^O:O- octa-n-propanolato-κO-tetrazirconium","","- C23 H53 N O8 Zr2 -","- C45.996 H54 N2 O16 Zr4 -","- C183.984 H216 N8 O64 Zr16 -","4","0.5","TK6081","Gainsford, Graeme J.; Al-Salim, Najeh; Kemmitt, Tim","A centrosymmetric μ~2~-alkoxo-bridged zirconium tetrameric complex: [Zr~2~(μ~2~-<i>O</i>,μ~2~-<i>O</i>'-methyliminodiethanolate)(μ~2~-<i>O</i>-<i>n</i>-propanolate)~2~(<i>n</i>-propanolate)~4~]~2~","Acta Crystallographica Section E","2002","58","11","m619","m621","10.1107/S1600536802017981","","","0.71073","MoKα","","0.095","0.057","","","0.15","0.181","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201645","17.569","0.005","10.745","0.003","12.239","0.004","90","","109.83","0.02","90","","2173.5","1.2","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2-dichloro-6-methoxy-3,4-dihydro-2H-naphthalene","","- C11 H10 Cl2 O2 -","- C11 H10 Cl2 O2 -","- C88 H80 Cl16 O16 -","8","2","TK6083","Christopher L. Brown; James A. Freiberg; Peter C. Healy","2,2-Dichloro-6-methoxy-3,4-dihydro-2<i>H</i>-naphthalene","Acta Crystallographica Section E","2002","58","11","o1239","o1240","10.1107/S1600536802018688","","","0.71069","MoKα","","0.105","0.042","","","0.102","0.125","","","","","","0.99","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201646","8.7935","0.0011","9.3913","0.0011","14.6428","0.0018","90","","100.093","0.002","90","","1190.5","0.3","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Bis(1-phenylethylammonium)Tetraiodoplumbate(II)","","- C16 H24 I4 N2 Pb -","- C16 H24 I4 N2 Pb -","- C32 H48 I8 N4 Pb2 -","2","0.5","TK6084","Billing, David G.","Bis(1-phenylethylammonium) tetraiodoplumbate(II)","Acta Crystallographica Section E","2002","58","11","m669","m671","10.1107/S1600536802019025","","","0.71073","MoKα","","0.03","0.024","","","0.055","0.057","","","","","","1.05","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201647","7.0077","0.0004","8.5126","0.0005","28.5138","0.0015","90","","92.979","0.001","90","","1698.66","0.17","295","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","salicylaldoximato 3,5-dinitrosalicylate dihydrate","2-hydroxybenzaldehyde oximato 3,5-dinitrosalicylate dihydrate","","- C14 H15 N3 O11 -","- C14 H15 N3 O11 -","- C56 H60 N12 O44 -","4","1","TK6085","Graham Smith; Urs D. Wermuth; Jonathan M. White","Salicylaldoximium 3,5-dinitrosalicylate dihydrate","Acta Crystallographica Section E","2002","58","11","o1315","o1317","10.1107/S1600536802019463","","","0.71073","MoKα","","0.049","0.048","","","0.109","0.11","","","","","","1.21","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201648","9.641","0.001","9.997","0.001","11.042","0.001","84.77","0.01","69.72","0.01","69.59","0.01","935.06","0.18","293","2","","","","","","","","","","4","P 1","P 1","1","","tert-Butyl (7R)-7-[(4S)-2,2-dimethyl-[1,3]dioxolan-4-yl]-1,4-dioxa-8- azaspiro[4.5]decane-8-carboxylate","","- C17 H29 N O6 -","- C17 H29 N O6 -","- C34 H58 N2 O12 -","2","2","WN6098","Badorrey, Ramon; Cativiela, Carlos; Díaz-de-Villegas, Maria D.; Gálvez, Jose A.","<i>tert</i>-Butyl (7<i>R</i>)-7-[(4<i>S</i>)-2,2-dimethyl-[1,3]dioxolan-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxylate","Acta Crystallographica Section E","2002","58","7","o750","o752","10.1107/S160053680200898X","","","0.71073","MoKα","","0.1022","0.0494","","","0.0966","0.1191","","","","","","0.971","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201649","8.448","0.001","12.309","0.001","12.841","0.001","88.562","0.01","72.938","0.01","86.242","0.01","1273.8","0.2","173","2","173","1","","","","","","","","5","P -1","-P 1","2","","Aquatetrakis(methylpyrazine-N)(nitrato-O)copper(II) nitrate","","- C20 H26 Cu N10 O7 -","- C20 H26 Cu N10 O7 -","- C40 H52 Cu2 N20 O14 -","2","1","WN6100","Otieno, Tom; Pinkston, Andrea T.; Johnson, Natisha C.; Parkin, Sean","Aquatetrakis(2-methylpyrazine-κ<i>N</i>)(nitrato-κ<i>O</i>)copper(II) nitrate","Acta Crystallographica Section E","2002","58","7","m328","m330","10.1107/S1600536802010048","","","0.71073","MoKα","","0.0551","0.0488","","","0.1257","0.1291","","","","","","1.057","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201650","9.4884","0.0004","9.6935","0.0005","15.2244","0.0008","74.715","0.002","78.456","0.001","73.955","0.001","1285.84","0.11","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Aqua(chloroacetato)bis(1,10-phenanthroline-N,N')manganese(II) perchlorate","","- C26 H20 Cl2 Mn N4 O7 -","- C26 H20 Cl2 Mn N4 O7 -","- C52 H40 Cl4 Mn2 N8 O14 -","2","1","WN6101","Zhang, Xiaofeng; Chen Feng; Wang, Wenguo; Chen,Changneng; Liu, Qiutian","Aqua(chloroacetato)bis(1,10-phenanthroline-<i>N,N</i>')manganese(II) perchlorate","Acta Crystallographica Section E","2002","58","7","m360","m362","10.1107/S1600536802010899","","","0.71073","MoKα","","0.0849","0.055","","","0.1373","0.161","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201651","11.579","0.004","5.3284","0.0011","24.133","0.006","90","","102.66","0.03","90","","1452.7","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,3,4,5,6-Pentabromophenyl phenyl ether","","- C12 H5 Br5 O -","- C12 H5 Br5 O -","- C48 H20 Br20 O4 -","4","1","WN6102","Eriksson, Lars; Hu, Jiwei","2,3,4,5,6-Pentabromophenyl phenyl ether","Acta Crystallographica Section E","2002","58","7","o794","o796","10.1107/S1600536802010942","","","0.71073","MoKα","","0.0872","0.036","","","0.0608","0.0662","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201652","15.61","0.003","9.623","0.004","15.923","0.003","90","","116.17","0.01","90","","2146.7","1.1","296.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H26 Cd N2 O5 -","- C20 H26 Cd N2 O5 -","- C80 H104 Cd4 N8 O20 -","4","1","WN6103","Okabe, Nobuo; Wada, Yoshio; Muranishi, Yasunori","A polymeric cadmium(II) complex of fusaric acid","Acta Crystallographica Section E","2002","58","7","m372","m374","10.1107/S1600536802011285","","","0.7107","MoKα","","","0.0468","","","","0.1878","","","","","","0.919","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201653","12.031","0.003","11.926","0.003","27.06","0.007","90","","95.877","0.004","90","","3862.2","1.7","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C40 H40 Cu2 I2 N4 -","- C40 H40 Cu2 I2 N4 -","- C160 H160 Cu8 I8 N16 -","4","0.5","WN6104","Guido Kickelbick; Mehdi Amirnasr; Aliakbar Dehno Khalaji; Saeed Dehghanpour","Di-μ-iodo-bis{[bis(<i>trans</i>-cinnamaldehyde)ethylenediimine-κ^2^<i>N,N</i>']copper(I)}","Acta Crystallographica Section E","2002","58","8","m381","m382","10.1107/S160053680201139X","","","0.71073","MoKα","","0.1066","0.068","","","0.143","0.158","","","","","","1.105","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201654","13.0526","0.0007","11.802","0.0006","12.6014","0.0006","90","","120.636","0.001","90","","1670.26","0.15","213","2","213","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C8 H11 Cl Pt -","- C8 H8 Cl Pt -","- C64 H64 Cl8 Pt8 -","8","1","WN6105","Guido Kickelbick; Frank Stöhr; Ulrich Schubert","Chloromethyl(η^4^-norbornadiene)platinum(II), an unsymmetrical substituted precursor for Pt^II^ complexes","Acta Crystallographica Section E","2002","58","8","m387","m388","10.1107/S1600536802011509","","","0.71073","MoKα","","0.0293","0.0271","","","0.0716","0.0731","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201655","21.497","0.007","9.036","0.003","10.084","0.003","90","","114.673","0.006","90","","1780","1","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4,7-dichlorotricyclo[3.1.1.0^3,6^]heptane-2-carboxylic acid","","- C8 H8 Cl2 O2 -","- C8 H8 Cl2 O2 -","- C64 H64 Cl16 O16 -","8","1","WN6106","Richard Gilardi; Ray J. Butcher; A. Bashir-Hashemi","4,7-Dichlorotricyclo[3.1.1.0^3,6^]heptane-2-carboxylic acid","Acta Crystallographica Section E","2002","58","8","o860","o861","10.1107/S1600536802012448","","","0.71073","MoKα","","0.0487","0.04","","","0.1044","0.1104","","","","","","1.036","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201656","3.9575","0.0002","12.3228","0.0004","19.097","0.0007","90","","95.849","0.002","90","","926.46","0.07","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2E)-3-[(1E)-2-(5-nitroisoxazol-3-yl)vinyloxy]prop-2-enal","","- C8 H6 N2 O5 -","- C8 H6 N2 O5 -","- C32 H24 N8 O20 -","4","1","WN6107","Gilardi, Richard; Evans, Robin; Zhang, Mao-Xi","(2<i>E</i>)-3-[(1<i>E</i>)-2-(5-Nitroisoxazol-3-yl)vinyloxy]prop-2-enal","Acta Crystallographica Section E","2002","58","8","o856","o857","10.1107/S1600536802011583","","","1.54178","CuKα","","0.0518","0.0364","","","0.0885","0.1008","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201657","9.6395","0.0006","19.472","0.001","10.511","0.0007","90","","116.015","0.001","90","","1773.02","0.19","168","2","168","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(aquachlorodimethylphenyltin)^.^18-crown-6","","- C28 H50 Cl2 O8 Sn2 -","- C28 H50 Cl2 O8 Sn2 -","- C56 H100 Cl4 O16 Sn4 -","2","0.5","WN6108","Amini, Mostafa M.; Azadmehr, Amirreza; Hossein Abadi, Shabnam; Ng, Seik Weng","Aquachlorodimethylphenyltin‒18-crown-6 (2/1)","Acta Crystallographica Section E","2002","58","9","m484","m485","10.1107/S1600536802013557","","","0.71073","MoKα","","0.097","0.06","","","0.099","0.107","","","","","","0.948","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201658","3.7949","0.0002","20.1494","0.0009","10.3903","0.0001","90","","100.501","0.003","90","","781.19","0.06","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Guanidium Dihydrigen 1,2,4,5-Benzenetetracarboxylate","","- C12 H16 N6 O8 -","- C12 H16 N6 O8 -","- C24 H32 N12 O16 -","2","0.5","WN6109","Yan-Qiong Sun; Jie Zhang; Guo-Yu Yang","Guanidinium pyromellitate","Acta Crystallographica Section E","2002","58","8","o904","o906","10.1107/S1600536802012898","","","0.71073","MoKα","","0.0676","0.0542","","","0.135","0.1481","","","","","","1.038","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2201659","8.0936","0.0004","12.9825","0.0006","21.9157","0.001","90","","96.882","0.001","90","","2286.2","0.19","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H20 N2 O4 S2 -","- C24 H20 N2 O4 S2 -","- C96 H80 N8 O16 S8 -","4","0.5","WN6110","Yao Kang; Rui-Feng Hu; Ye-Yan Qin; Zhao-Ji Li; Yu-Biao Chen; Yi-Hang Wen; Jian-Kai Cheng; Yuan-Gen Yao","Pyridinium 2,2'-dithiodisalicylate","Acta Crystallographica Section E","2002","58","8","o959","o960","10.1107/S1600536802013545","","","0.71073","MoKα","","0.1054","0.0705","","","0.1574","0.1848","","","","","","1.15","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201660","6.4536","0.0014","9.132","0.002","12.841","0.003","108.264","0.003","95.935","0.003","91.44","0.003","713.5","0.3","203","2","203","2","","","","","","","","6","P -1","-P 1","2","Re(phen)(CO)3Cl","Fac-tricarbonylchloro(1,10-phenanthroline)rhenium(I)","","- C15 H8 Cl N2 O3 Re -","- C15 H8 Cl N2 O3 Re -","- C30 H16 Cl2 N4 O6 Re2 -","2","1","WN6111","Haddad, Salim F.; Marshall, Jason A.; Crosby, G.A.; Twamley, Brendan","<i>fac</i>-Tricarbonylchloro(1,10-phenanthroline)rhenium(I)","Acta Crystallographica Section E","2002","58","10","m559","m561","10.1107/S1600536802016379","","","0.71073","MoKα","","0.0314","0.0274","","","0.0657","0.0668","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201661","8.679","0.008","14.784","0.004","23.593","0.015","90","","90","","90","","3027","3","200","2","200","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(1R,3R,4S)-8-phenylmenthyl(8S,9S)-8-ferrocenyl-6- methyl-1,4-dithia-6-azaspiro[4,4]nonan-9-carboxylate.","","- C34 H43 Fe N O2 S2 -","- C34 H43 Fe N O2 S2 -","- C136 H172 Fe4 N4 O8 S8 -","4","1","WN6114","García-Granda, Santiago; Fernández-Rodríguez, Manuel A.; Aguilar, Enrique; Fernández-Marí, Félix","(1<i>R</i>,3<i>R</i>,4<i>S</i>)-8-Phenylmenthyl (8<i>S</i>,9<i>S</i>)-8-ferrocenyl-6-methyl-1,4-dithia-6-azaspiro[4,4]nonane-9-carboxylate","Acta Crystallographica Section E","2002","58","9","m502","m503","10.1107/S1600536802015246","","","1.5418","CuKα","","0.0684","0.0536","","","0.126","0.1421","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201662","11.8308","0.0001","22.779","0.0003","14.5238","0.0002","90","","107.407","0.0005","90","","3734.82","0.08","200","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[bis(dicyclohexylphosphino)ethane-κ^2^P,P']bromo(phenyl)nickel(II) chlorobenzene solvate","","- C38 H58 Br Cl Ni P2 -","- C38 H58 Br Cl Ni P2 -","- C152 H232 Br4 Cl4 Ni4 P8 -","4","1","WN6116","Alison J. Edwards; Mikael Retbøll; Eric Wenger","The nickel(II) complex [NiBr(Ph){(C~6~H~11~)~2~P(CH~2~)~2~P(C~6~H~11~)~2~}]·PhCl","Acta Crystallographica Section E","2002","58","9","m497","m499","10.1107/S160053680201509X","","","0.71073","MoKα","","","0.0298","","","","0.0305","","","","","","1.0463","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201663","18.298","0.005","12.792","0.003","6.586","0.002","90","","90","","90","","1541.6","0.7","143","2","143","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Di-tert-butylphosphino)(dimethylphosphino)methane disulfide","","- C11 H26 P2 S2 -","- C11 H26 P2 S2 -","- C44 H104 P8 S8 -","4","0.5","WN6117","Jones, Peter G.; Fischer, Axel K.; Krill, Jochen; Schmutzler, Reinhard","(Di-<i>tert</i>-butylphosphino)(dimethylphosphino)methane disulfide","Acta Crystallographica Section E","2002","58","9","o1016","o1017","10.1107/S1600536802014927","","","0.71073","MoKα","","0.0295","0.0267","","","0.0698","0.072","","","","","","1.073","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201664","25.5695","0.0017","25.5695","0.0017","5.1934","0.0005","90","","90","","120","","2940.5","0.4","213","2","213","2","","","","","","","","5","R -3 :H","-R 3","148","5-trifluoromethyl-uracil","","","- C5 H3 F3 N2 O2 -","- C5 H3 F3 N2 O2 -","- C90 H54 F54 N36 O36 -","18","1","WN6118","Twamley, Brendan; Gupta, O.D.; Shreeve, Jean'ne M.","5-(Trifluoromethyl)uracil","Acta Crystallographica Section E","2002","58","9","o1040","o1042","10.1107/S1600536802015295","","","0.71073","MoKα","","0.079","0.0494","","","0.0942","0.1049","","","","","","1.093","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201665","10.3368","0.0008","12.7939","0.0011","19.1336","0.0016","80.231","0.01","89.193","0.009","67.943","0.009","2307.8","0.4","153","2","153","2","","","","","","","","8","P -1","-P 1","2","","[RuCl{2,6-bis(3,4-dihydro-2H-pyrrol-5-yl)pyridine}(PPh~3~)~2~]BF~4~ dichloromethane solvate","","- C50 H47 B Cl3 F4 N3 P2 Ru -","- C50 H47 B Cl3 F4 N3 P2 Ru -","- C100 H94 B2 Cl6 F8 N6 P4 Ru2 -","2","1","WN6119","Cabort, Amel; Therrien, Bruno; Bernauer, Klaus; Süss-Fink, Georg","[RuCl{2,6-bis(3,4-dihydro-2<i>H</i>-pyrrol-5-yl)pyridine}(PPh~3~)~2~]BF~4~ dichloromethane solvate","Acta Crystallographica Section E","2002","58","10","m557","m558","10.1107/S1600536802016343","","","0.71069","MoKα","","0.0466","0.0308","","","0.0716","0.0764","","","","","","0.956","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201666","13.0348","0.0003","10.9999","0.0003","23.8599","0.0005","90","","94.584","0.001","90","","3410.12","0.14","113.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","μ-pentacyclo[26.4.0.0^9,14^.0^17,22^.0^25,30^]dotriaconta- 1,3,5,9,11,13,15,17,19,21,25,27,29,31-tetradecaene-7,24-diyne- bis(tricarbonylcobalt) dichloromethane solvate","","- C39 H22 Cl2 Co2 O6 -","- C39 H22 Cl2 Co2 O6 -","- C156 H88 Cl8 Co8 O24 -","4","1","WN6120","Orita, Akihiro; Jiang, Lasheng; Ye, Fangguo; Imai, Nobuyuki; Akashi, Haruo; Otera, Junzo","A hexacarbonyldicobalt(0) complex of a `magazine-rack' molecule, [(η^2^-<i>C</i>~32~H~20~)Co~2~(CO)~6~]·CH~2~Cl~2~","Acta Crystallographica Section E","2002","58","11","m681","m683","10.1107/S1600536802019281","","","0.7107","MoKα","","","0.026","","","","0.089","","","","","","0.903","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201667","10.2221","0.001","7.5133","0.001","17.539","0.002","90","","101.603","0.009","90","","1319.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H17 N O2 -","- C15 H17 N O2 -","- C60 H68 N4 O8 -","4","1","WN6121","Hökelek, Tuncer; Patır, Süleyman; Ergün, Yavuz; Okay, Gürol","Ethyl 9<i>H</i>-1,2,3,4-tetrahydrocarbazole-3-carboxylate","Acta Crystallographica Section E","2002","58","11","o1255","o1257","10.1107/S1600536802018871","","","0.71073","MoKα","","0.1736","0.0425","","","0.0834","0.1151","","","","","","0.918","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201668","7.0169","0.0015","13.263","0.003","14.8568","0.0019","90","","97.938","0.016","90","","1369.4","0.5","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H12 N4 O4 -","- C14 H12 N4 O4 -","- C56 H48 N16 O16 -","4","1","WN6122","Shang Shan; Duan-Jun Xu; Jing-Yun Wu; Michael Y. Chiang","Acetophenone (2,4-dinitrophenyl)hydrazone","Acta Crystallographica Section E","2002","58","12","o1333","o1335","10.1107/S160053680201975X","","","0.71069","MoKα","","0.135","0.041","","","0.108","0.142","","","","","","0.96","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201669","15.945","0.007","3.8449","0.0016","12.389","0.005","90","","99.664","0.007","90","","748.8","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","p-chlorobenzoyl hydrazide","4-chlorobenzohydrazide","","- C7 H7 Cl N2 O -","- C7 H7 Cl N2 O -","- C28 H28 Cl4 N8 O4 -","4","1","WN6123","Saraogi, Ishu; Mruthyunjayaswamy, B. H. M.; Ijare, Omkar B.; Jadegoud, Y; Guru Row, T. N.","4-Chlorobenzohydrazide","Acta Crystallographica Section E","2002","58","12","o1341","o1342","10.1107/S1600536802019803","","","0.71073","MoKα","","0.0812","0.0606","","","0.1355","0.1431","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201670","7.4639","0.0011","14.798","0.002","12.2356","0.0018","90","","97.18","0.002","90","","1340.8","0.3","180","2","180","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H17 B Cl N -","- C15 H17 B Cl N -","- C60 H68 B4 Cl4 N4 -","4","1","WN6124","Hong-Bo Tong; Xue-Hong Wei; Shu-Ping Huang; Jian-Feng Li; Dian-Sheng Liu","2-Chloro-1,1-dimethyl-2-phenyl-2,3-dihydro-1<i>H</i>-1,2-benzazoniaborolate","Acta Crystallographica Section E","2002","58","12","o1389","o1391","10.1107/S1600536802020275","","","0.71073","MoKα","","0.0882","0.0683","","","0.1315","0.1387","","","","","","1.158","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201671","5.584","0.0007","11.491","0.003","21.043","0.005","90","","90","","90","","1350.2","0.5","293","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Bis(L-aspartic acid) nitrate","Bis(L-aspartic acid) nitrate","","- C8 H15 N3 O11 -","- C8 H15 N3 O11 -","- C32 H60 N12 O44 -","4","1","WN6125","B. Sridhar; N. Srinivasan; R. K. Rajaram","<small>L</small>-Aspartic acid nitrate‒<small>L</small>-aspartic acid (1/1)","Acta Crystallographica Section E","2002","58","12","o1372","o1374","10.1107/S1600536802020305","","","0.71073","MoKα","","0.1094","0.0414","","","0.094","0.1182","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201672","10.545","0.0016","14.299","0.003","7.4229","0.0006","95.445","0.01","98.78","0.009","108.3","0.014","1038","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H16 Cu I2 N4 -","- C20 H16 Cu I2 N4 -","- C40 H32 Cu2 I4 N8 -","2","1","WN6126","Yu Liu; Duan-Jun Xu; Jing-Yun Wu; Michael Y. Chiang","Redetermination of bis(2,2'-bipyridine-κ^2^<i>N,N</i>')iodocopper(II) iodide","Acta Crystallographica Section E","2002","58","12","m733","m734","10.1107/S1600536802020895","","","0.71069","MoKα","","0.062","0.025","","","0.056","0.066","","","","","","1.008","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201673","9.067","0.0004","11.3774","0.0005","15.9752","0.0008","75.294","0.001","76.127","0.001","87.458","0.001","1547.26","0.12","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Methyl 3-benzoyl-8-hydroxy-5-methoxyindolizine-1-carboxylate","","- C18 H15 N O5 -","- C18 H15 N O5 -","- C72 H60 N4 O20 -","4","2","WN6127","Anwar Usman; Yun Li; Yan Zhang; Hoong-Kun Fun; Jian-Hua Xu","Methyl 3-benzoyl-8-hydroxy-5-methoxyindolizine-1-carboxylate","Acta Crystallographica Section E","2002","58","12","o1427","o1429","10.1107/S1600536802021165","","","0.71073","MoKα","","0.0494","0.0408","","","0.1087","0.1195","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201674","18.957","0.006","9.961","0.003","16.335","0.005","90","","110.885","0.006","90","","2881.9","1.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,3,5-Tris(2-pyrimidinylthiomethyl)-2,4,6-Trimethylbenzene","","- C24.5 H24.5 Cl1.5 N6 S3 -","- C24.5 H24.5 Cl1.5 N6 S3 -","- C98 H98 Cl6 N24 S12 -","4","1","WW6017","Yan, Zheng; Jian-Rong Li; Ya-Bo Xie; Xian-He Bu","2,4,6-Trimethyl-1,3,5-tris(2-pyrimidinylthiomethyl)benzene chloroform hemisolvate","Acta Crystallographica Section E","2002","58","8","o923","o924","10.1107/S1600536802012680","","","0.71073","MoKα","","0.1947","0.0699","","","","0.1802","","","","","","0.93","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201675","16.933","0.006","5.312","0.002","8.423","0.003","90","","91.209","0.007","90","","757.5","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(R,S)-1,2-bis(benzylsulfinyl)ethane","","- C16 H18 O2 S2 -","- C16 H18 O2 S2 -","- C32 H36 O4 S4 -","2","0.5","WW6020","Jian-Rong Li; Ruo-Hua Zhang; Xian-He Bu","(<i>R</i>,<i>S</i>)-1,2-Bis(benzylsulfinyl)ethane","Acta Crystallographica Section E","2002","58","8","o911","o912","10.1107/S1600536802012503","","","0.71073","MoKα","","0.0637","0.04","","","0.0998","0.1299","","","","","","1.106","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201676","7.8166","0.0011","11.1683","0.0018","11.5769","0.0018","73.31","0.003","85.99","0.004","77.571","0.004","945.3","0.3","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","N-(2-ethylbenzene)-2-indolecarboxamide","","- C20 H23 N3 O2 -","- C20 H23 N3 O2 -","- C40 H46 N6 O4 -","2","1","WW6023","Yang, Qi Yun; Qiu, Li Qin; Zhou, Zhong Yuan; Qi, Jian Ying; Chan, Albert S. C.","<i>N</i>-(1-Phenylethyl)indole-2-carboxamide dimethylformamide solvate","Acta Crystallographica Section E","2002","58","8","o907","o908","10.1107/S1600536802012357","","","0.71073","MoKα","","0.1624","0.0539","","","0.0944","0.1091","","","","","","0.972","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201677","10.9451","0.0007","10.0886","0.0006","28.4366","0.0017","90","","94.198","0.001","90","","3131.6","0.3","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H35 Cd N5 S4 -","- C26 H35 Cd N5 S4 -","- C104 H140 Cd4 N20 S16 -","4","1","WW6024","Guo, Tengwen; Lai, Chian Sing; Tan, Xi Jie; Teo, Chin Seng; Tiekink, Edward R. T.","Bis(diethyldithiocarbamato)(4,7-dimethyl-1,10-phenanthroline)cadmium(II) acetonitrile solvate","Acta Crystallographica Section E","2002","58","8","m439","m440","10.1107/S1600536802012679","","","0.71069","MoKα","","0.062","0.045","","","0.098","0.105","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201678","12.168","0.002","11.983","0.002","18.901","0.004","90","","108.43","0.03","90","","2614.6","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H28 N12 Ni O -","- C26 H28 N12 Ni O -","- C104 H112 N48 Ni4 O4 -","4","1","WW6025","He, Yi; Kou, Hui-Zhong; Zhou, Bei Chuan; Xiong, Ming; Wang, Ru-Ji; Li, Yadong","<i>fac</i>-Bis(2-aminomethylbenzimidazole)(2-aminomethylbenzimidazolato)nickel(II) dicyanamide monohydrate","Acta Crystallographica Section E","2002","58","8","m389","m391","10.1107/S1600536802011352","","","0.71073","MoKα","","0.1019","0.0506","","","0.0795","0.091","","","","","","0.823","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201679","8.5647","0.0006","6.9212","0.0006","18.2692","0.0015","90","","98.074","0.001","90","","1072.23","0.15","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C6 H6 N4 S4 -","- C6 H6 N4 S4 -","- C24 H24 N16 S16 -","4","0.5","WW6026","Jun-Ling Song; Wen-Bo Zhou; Hui-Yi Zeng; Zhen-Chao Dong","5,5'-Dimethyl-2,2'-dithiodi-1,3,4-thiadiazole","Acta Crystallographica Section E","2002","58","10","o1045","o1047","10.1107/S1600536802014034","","","0.71073","MoKα","","0.0411","0.0347","","","0.0926","0.0967","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201680","10.3676","0.0001","9.2278","0.0001","33.3643","0.0005","90","","98.0917","0.0006","90","","3160.19","0.07","170","2","170","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Di-n-butylbis(2',4'-difluoro-4-hydroxybiphenyl-3-carboxylato-O,O')tin(IV)","Di-n-butylbis(2',4'-difluoro-4-hydroxybiphenyl-3-carboxylato-O,O')tin(IV)","","- C34 H32 F4 O6 Sn -","- C34 H32 F4 O6 Sn -","- C136 H128 F16 O24 Sn4 -","4","1","WW6028","Hans, Karm; Parvez, Masood; Ahmad, Fiaz; Ali, Saqib; Mazhar, Muhammad; Munir, Arshad","Di-<i>n</i>-butylbis(2',4'-difluoro-4-hydroxybiphenyl-3-carboxylato-<i>O,O</i>')tin(IV)","Acta Crystallographica Section E","2002","58","8","m441","m443","10.1107/S1600536802012655","","","0.71073","MoKα","","0.064","0.0497","","","0.1398","0.1477","","","","","","1.068","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201681","8.719","0.002","9.276","0.002","15.226","0.003","90","","90","","90","","1231.4","0.5","293","2","293","2","","","","","","","","5","C m c m","-C 2c 2","63","","","","- C8 H8 Cl4 N4 Zn -","- C8 H8 Cl4 N4 Zn -","- C32 H32 Cl16 N16 Zn4 -","4","0.25","WW6029","Chen-Xin Cai; Li Xu; Yun-Qi Tian; Xiao-Zeng You","The complex salt benzodiimidazolium tetrachlorozincate","Acta Crystallographica Section E","2002","58","8","m399","m401","10.1107/S1600536802011893","","","0.71073","MoKα","","0.0311","0.026","","","0.0696","0.0725","","","","","","1.072","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201682","13.0412","0.0003","13.6473","0.0003","15.6097","0.0005","103.589","0.0011","94.9563","0.0013","115.856","0.0017","2372.76","0.12","120","2","120","2","","","","","","","","5","P -1","-P 1","2","Tetrabutylbis(N-phthaloylphenylalaninato)distannoxane Dimer","Tetrabutylbis(N-phthaloylphenylalaninato)distannoxane Dimer","","- C100 H120 N4 O18 Sn4 -","- C100 H120 N4 O18 Sn4 -","- C100 H120 N4 O18 Sn4 -","1","0.5","WW6030","Hans, Karm; Parvez, Masood; Ashfaq, Muhammad; Anwar, Saeed; Badshah, Amin; Majeed, Abdul","Tetrabutylbis(<i>N</i>-phthaloylphenylalaninato)distannoxane dimer","Acta Crystallographica Section E","2002","58","9","m466","m468","10.1107/S1600536802013600","","","0.71073","MoKα","","0.071","0.048","","","0.107","0.117","","","","","","1.08","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201683","12.286","0.004","7.3","0.002","22.573","0.007","90","","95.731","0.006","90","","2014.4","1.1","293","2","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[1,4-Bis(pyridyl-2-ylmethyl)-1,4-diazacycloheptane]chlorocobalt(II) perchlorate","","- C17 H22 Cl2 Co N4 O4 -","- C17 H22 Cl2 Co N4 O4 -","- C68 H88 Cl8 Co4 N16 O16 -","4","1","WW6033","Ya-Mei Guo; Miao Du; Shen-Tan Chen; Xian-He Bu","[1,4-Bis(pyridyl-2-ylmethyl)-1,4-diazacycloheptane]chlorocobalt(II) perchlorate","Acta Crystallographica Section E","2002","58","8","m454","m456","10.1107/S160053680201293X","","","0.71073","MoKα","","0.1346","0.0493","","","0.077","0.0909","","","","","","0.98","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201684","12.1201","0.0001","5.148","0.001","24.944","0.001","90","","101.2","0.01","90","","1526.7","0.3","293","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dimethyl 2,2'-(4,5-dicyano-o-phenylenedithio)diacetate","","- C14 H12 N2 O4 S2 -","- C14 H12 N2 O4 S2 -","- C56 H48 N8 O16 S8 -","4","1","WW6034","Çoruh, Ufuk; Akdemir, Nesuhi; Ag̃ar, Erbil; Kim, Youngme; Erdönmez, Ahmet","Dimethyl 2,2'-(4,5-dicyano-<i>o</i>-phenylenedithio)diacetate","Acta Crystallographica Section E","2002","58","9","o994","o996","10.1107/S1600536802014046","","","0.71073","MoKα","","0.113","0.046","","","0.108","0.134","","","","","","1.028","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201685","9.1746","0.0008","11.3853","0.001","14.5431","0.0012","91.648","0.002","107.925","0.002","91.642","0.002","1443.6","0.2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","r-1,c-2,t-3,t-4-1,2-Bis(4-methoxyphenyl)-3,4-bis(5-phenyl-1,3,4- oxadiazol-2-yl)cyclobutane","","- C34 H28 N4 O4 -","- C34 H28 N4 O4 -","- C68 H56 N8 O8 -","2","1","WW6038","Zhuang, Jun-Peng; Zheng, Yan","<i>r</i>-1,<i>c</i>-2,<i>t</i>-3,<i>t</i>-4-1,2-Bis(4-methoxyphenyl)-3,4-bis(5-phenyl-1,3,4-oxadiazol-2-yl)cyclobutane","Acta Crystallographica Section E","2002","58","11","o1195","o1197","10.1107/S1600536802017713","","","0.71073","MoKα","","0.0705","0.0437","","","0.1156","0.1329","","","","","","0.996","","","","has coordinates,has disorder","194528","2020-10-21","18:00:00",""
"2201686","14.294","0.007","7.027","0.004","15.679","0.008","90","","105.149","0.009","90","","1520.1","1.4","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","5,6-Diphenyl-3-(pyrazin-2-yl)-1,2,4-triazine","","- C19 H13 N5 -","- C19 H13 N5 -","- C76 H52 N20 -","4","1","WW6040","Hong Deng; Chunlong Chen; Hao Zhang; Chengyong Su; Liangnian Ji","5,6-Diphenyl-3-(pyrazin-2-yl)-1,2,4-triazine","Acta Crystallographica Section E","2002","58","11","o1321","o1322","10.1107/S1600536802019591","","","0.71073","MoKα","","0.0578","0.0386","","","0.0948","0.1076","","","","","","1.044","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201687","9.05","0.001","14.224","0.001","11.081","0.001","90","","107.986","0.009","90","","1356.7","0.2","296","2","296","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C18 H20 -","- C18 H20 -","- C72 H80 -","4","1","WW6041","Alan L. Raine; Craig M. Williams; Paul V. Bernhardt","1-(Phenylethynyl)adamantane","Acta Crystallographica Section E","2002","58","12","o1439","o1440","10.1107/S1600536802021542","","","0.71073","MoKα","","0.1162","0.0572","","","0.1732","0.1943","","","","","","1.146","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201688","10.573","0.003","11.36","0.004","13.731","0.005","87.593","0.005","78.464","0.004","81.396","0.004","1597.6","0.9","170","2","170","2","","","","","","","","6","P -1","-P 1","2","","[TiZr(μ~2~-O-,μ~2~-O'-methyliminodiethanolate)(μ~2~-O-n-propanolate)~2~ (n-propanolate)~2.7~(iso-propanolate)~1.3~]~2~ bis(methyliminodiethanolato)dodecapropanolatodititaniumdizirconium","","- C46 H106 N2 O16 Ti2 Zr2 -","- C46.004 H63.688 N2 O16 Ti2 Zr2 -","- C46.004 H63.688 N2 O16 Ti2 Zr2 -","1","0.5","WW6042","Gainsford, Graeme J.; Al-Salim, Najeh; Kemmitt, Tim","A centrosymmetric triply alkoxo-bridged titanium-μ~2~-<i>O</i>-zirconium tetranuclear complex: [TiZr(μ~2~-<i>O</i>,μ~2~-<i>O</i>'-methyliminodiethanolate)(μ~2~-<i>O</i>-<i>n</i>-propanolate)~2~(<i>n</i>-propanolate)~2.7~(isopropanolate)~1.3~]~2~","Acta Crystallographica Section E","2002","58","11","m636","m638","10.1107/S1600536802018482","","","0.71073","MoKα","","0.14","0.068","","","0.175","0.215","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201689","20.006","0.004","9.545","0.002","11.922","0.002","90","","124.479","0.004","90","","1876.7","0.6","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(E)-Ethyl 3-acetamido-2-butenoate","","- C8 H13 N O3 -","- C8 H13 N O3 -","- C64 H104 N8 O24 -","8","1","WW6044","Chen, Xuanhua; Guo, Rongwei; Zhou, Zhongyuan","Ethyl (<i>E</i>)-3-acetamido-2-butenoate","Acta Crystallographica Section E","2002","58","10","o1157","o1158","10.1107/S1600536802017373","","","0.71073","MoKα","","0.1038","0.0529","","","0.1332","0.1534","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201690","8.099","0.002","12.761","0.002","8.75","0.002","90","","110.268","0.004","90","","848.3","0.3","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(E)-Methyl 3-acetamido-2-butenoate","","- C7 H11 N O3 -","- C7 H11 N O3 -","- C28 H44 N4 O12 -","4","1","WW6045","Chen, Xuanhua; Guo, Rongwei; Zhou, Zhongyuan","Methyl (<i>E</i>)-3-acetamido-2-butenoate","Acta Crystallographica Section E","2002","58","10","o1159","o1160","10.1107/S1600536802017361","","","0.71073","MoKα","","0.0937","0.0506","","","0.1313","0.1479","","","","","","1.008","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201691","17.784","0.003","17.611","0.003","14.217","0.002","90","","126.31","0.003","90","","3588.1","1","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N,N'-Bis[2-(2-pyridyl)methyl]pyridine-2,6-dicarboxamide hemihydrate","","- C19 H18 N5 O2.5 -","- C19 H18 N5 O2.5 -","- C152 H144 N40 O20 -","8","1","WW6046","Qi, Jian Ying; Chen, Jian; Yang, Qi Yun; Zhou, Zhong Yuan; Chan, Albert S. C.","<i>N,N</i>'-Bis[2-(2-pyridyl)methyl]pyridine-2,6-dicarboxamide hemihydrate","Acta Crystallographica Section E","2002","58","11","o1232","o1233","10.1107/S160053680201824X","","","0.71073","MoKα","","0.1436","0.0549","","","0.1209","0.1365","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201692","11.33","0.001","8.1","0.001","13.965","0.001","90","","104.096","0.009","90","","1243","0.2","298.2","","298.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H8 Br N O2 -","- C14 H8 Br N O2 -","- C56 H32 Br4 N4 O8 -","4","1","WW6049","Wu, Jing-Yun; Chiang, Michael Yen-Nan; Zeng, Wen-Feng","<i>N</i>-(2-Bromophenyl)phthalimide","Acta Crystallographica Section E","2002","58","12","o1370","o1371","10.1107/S1600536802020263","","","0.7107","MoKα","","0.1234","0.0676","","0.0583","","0.0538","","","1.584","","","1.83","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201693","21.9899","0.0011","13.3576","0.0011","15.2317","0.001","90","","103.828","0.002","90","","4344.4","0.5","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","[8,8'-(Propane-1,3-diyldioxy)diquinoline-κ^4^N,O,O',N']silver(I) trifluoromethanesulfonate","[8,8'-(Propane-1,3-diyldioxy)diquinoline-κ^4^N,O,O',N']silver(I) trifluoromethanesulfonate","","- C22 H18 Ag F3 N2 O5 S -","- C22 H18 Ag F3 N2 O5 S -","- C176 H144 Ag8 F24 N16 O40 S8 -","8","1","WW6050","An-Wu Xu; Yue-Peng Cai; Li-Zhi Zhang; Cheng-Yong Su; Bei-Sheng Kang","[8,8'-(Propane-1,3-diyldioxy)diquinoline-κ^4^<i>N,O,O</i>',<i>N</i>']silver(I) trifluoromethanesulfonate","Acta Crystallographica Section E","2002","58","12","m770","m771","10.1107/S1600536802021529","","","0.71073","MoKα","","0.0569","0.0432","","","0.1154","0.1225","","","","","","1.034","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201694","12.382","0.009","23.7","0.015","8.664","0.006","90","","104.313","0.012","90","","2464","3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-(3,5-dimethoxyphenyl)-2-[2-(3,5-dimethoxyphenyl)hydroxymethyl-4- methoxyphenyl]ethanol","","- C26 H30 O7 -","- C26 H30 O7 -","- C104 H120 O28 -","4","1","WW6051","Yin, Qiang; Zhang, Wen-Qin","1-(3,5-Dimethoxyphenyl)-2-{2-[(3,5-dimethoxyphenyl)hydroxymethyl]-4-methoxyphenyl}ethanol","Acta Crystallographica Section E","2002","58","12","o1367","o1369","10.1107/S1600536802020251","","","0.71073","MoKα","","0.104","0.05031","","","","0.1375","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201695","9.718","0.007","12.673","0.009","15.653","0.007","90","","104.825","0.015","90","","1864","2","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H13 N O3 -","- C8 H13 N O3 -","- C64 H104 N8 O24 -","8","2","WW6052","Chen, Xuanhua; Guo, Rongwei; Zhou, Zhongyuan","Methyl (<i>E</i>)-3-acetamido-2-pentenoate","Acta Crystallographica Section E","2002","58","12","o1421","o1422","10.1107/S1600536802021396","","","0.71073","MoKα","","0.1665","0.0594","","","0.1299","0.1555","","","","","","1.055","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201696","17.158","0.003","7.607","0.0012","18.823","0.003","90","","90","","90","","2456.8","0.7","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H15 N O3 -","- C13 H15 N O3 -","- C104 H120 N8 O24 -","8","1","WW6053","Chen, Xuanhua; Guo, Rongwei; Zhou, Zhongyuan","Ethyl (<i>E</i>)-2-acetyl-3-amino-3-phenyl-2-propylenoate","Acta Crystallographica Section E","2002","58","12","o1423","o1424","10.1107/S1600536802021517","","","0.71073","MoKα","","0.0974","0.0465","","","0.1026","0.1176","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201697","10.3539","0.0013","17.0677","0.0012","13.537","0.0013","90","","90.729","0.008","90","","2392","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H16 N Ni S10 -","- C16 H16 N Ni S10 -","- C64 H64 N4 Ni4 S40 -","4","1","WW6054","Xu, Wen; Yu, Wentao; Xue, Gang; Fang, Qi","Benzyltrimethylammonium bis(2-thioxo-1,3-dithiole-4,5-dithiolato)nickelate(III)","Acta Crystallographica Section E","2002","58","12","m772","m774","10.1107/S1600536802021530","","","0.71073","MoKα","","0.0747","0.0397","","","0.1098","0.1362","","","","","","0.8","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201698","9.806","0.002","12.435","0.003","17.067","0.004","90","","90","","90","","2081.1","0.8","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C9 H15 N O3 -","- C9 H15 N O3 -","- C72 H120 N8 O24 -","8","1","WW6055","Chen, Xuanhua; Guo, Rongwei; Zhou, Zhongyuan","Methyl (<i>E</i>)-3-acetamido-4-methyl-2-pentenoate","Acta Crystallographica Section E","2002","58","12","o1425","o1426","10.1107/S1600536802021554","","","0.71073","MoKα","","0.1791","0.0635","","","0.1517","0.1981","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201699","9.21","0.002","12.121","0.002","19.374","0.009","73.59","0.02","81.2","0.02","81.89","0.01","2039.3","1.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Bis(1,3-diphenylpropane-1,3-dionato-O,O')(aqua)(benzo-15-crown-5) dioxo-uranium(VI)","","- C44 H44 O12 U -","- C44 H44 O12 U -","- C88 H88 O24 U2 -","2","1","YA6099","K. Rajagopal; R. V. Krishnakumar; M. Subha Nandhini; S. Kannan; S. Natarajan","Aquabis(1,3-diphenylpropane-1,3-dionato-<i>O,O</i>')dioxouranium(VI) benzo-15-crown-5","Acta Crystallographica Section E","2002","58","7","m316","m318","10.1107/S1600536802009352","","","0.71073","MoKα","","0.055","0.033","","","0.061","0.072","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201700","6.12","0.001","8.95","0.001","37.622","0.004","90","","90","","90","","2060.7","0.5","133","2","133","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","3-methoxy-1'-phenyl-4'β,5-dihydro-1H-pyrazolo [4',3':16,17]estra-1,3,5(10)-triene","3-methoxy-1'-phenyl-4'β,5-dihydro-1H-pyrazolo [4',3':16,17]estra-1,3,5(10)-triene","","- C26 H30 N2 O -","- C26 H30 N2 O -","- C104 H120 N8 O4 -","4","1","YA6104","König, Verena; Schneider, Thomas R.; Frank, Eva; Aukszi, Beatrix; Schneider, Gyula; János Wölfling","3-Methoxy-1'-phenyl-4'β,5-dihydro-1<i>H</i>-pyrazolo[4',3':16,17]estra-1,3,5(10)-triene","Acta Crystallographica Section E","2002","58","8","o810","o811","10.1107/S160053680201125X","","","0.71073","MoKα","","0.047","0.038","","","0.089","0.092","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201701","9.484","0.003","16.235","0.005","6.907","0.002","90","","118.25","0.02","90","","936.8","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H11 N O3 -","- C9 H11 N O3 -","- C36 H44 N4 O12 -","4","1","YA6107","Ivashevskaja, Svetlana N.; Aleshina, Lyudmila A.; Andreev, Vladimir P.; Nizhnik, Yakov P.; Chernyshev, Vladimir V.","Quinoline <i>N</i>-oxide dihydrate from powder data","Acta Crystallographica Section E","2002","58","8","o920","o922","10.1107/S1600536802012564","","","1.5418","CuKα","","","","","","","","","","3.346","","","","","","","has coordinates","203508","2020-10-21","18:00:00",""
"2201702","12.593","0.005","5.081","0.002","20.169","0.008","90","","104.028","0.015","90","","1252","0.9","130","2","130","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H15 N O3 S -","- C13 H15 N O3 S -","- C52 H60 N4 O12 S4 -","4","1","YA6108","Gainsford, Graeme J.; Woolhouse, Anthony D.","<i>exo</i>-7-Phenyl-3-<i>n</i>-propyl-5-oxa-2-thia-6-azabicyclo[3.2.0^1,4^]hept-6-ene 2,2-dioxide","Acta Crystallographica Section E","2002","58","7","o715","o716","10.1107/S1600536802009807","","","0.71069","MoKα","","0.061","0.039","","","0.088","0.092","","","","","","0.85","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201703","6.033","0.001","11.805","0.001","14.354","0.001","90","","90","","90","","1022.3","0.2","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Bis(L-lactato)diaquanickel(II)","","- C6 H14 Ni O8 -","- C6 H14 Ni O8 -","- C24 H56 Ni4 O32 -","4","1","YA6109","Zhou, Zhao-Hui; Ye, Jian-Jun; Zhong, Hao; Ng, Seik Weng","Diaquadi(<small>L</small>-lactato)nickel(II)","Acta Crystallographica Section E","2002","58","7","m326","m327","10.1107/S160053680200956X","","","0.71073","MoKα","","0.06","0.047","","","0.106","0.113","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201704","11.372","0.0015","5.5876","0.0008","15.323","0.002","90","","107.782","0.005","90","","927.1","0.2","105","2","105","2","","","","","","","","6","P 1 21 1","P 2yb","4","L-methionine L-methioninium perchlorate monohydrate","L-methionine L-methioninium perchlorate monohydrate","","- C10 H25 Cl N2 O9 S2 -","- C10 H25 Cl N2 O9 S2 -","- C20 H50 Cl2 N4 O18 S4 -","2","1","YA6110","B. Sridhar; N. Srinivasan; Bjoern Dalhus; R. K. Rajaram","<small>L</small>-Methionine <small>L</small>-methioninium perchlorate monohydrate","Acta Crystallographica Section E","2002","58","7","o779","o781","10.1107/S1600536802010656","","","0.7107","MoKα","","0.032","0.029","","","0.082","0.086","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201705","8.7211","0.0011","12.4005","0.0007","11.6049","0.0011","90","","103.785","0.005","90","","1218.9","0.2","295","2","295","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","trans-Bis(1H-benzimidazole-1-thione-κS)tetrachlorotellurium methanol disolvate","","- C16 H20 Cl4 N4 O2 S2 Te -","- C16 H20 Cl4 N4 O2 S2 Te -","- C32 H40 Cl8 N8 O4 S4 Te2 -","2","0.5","YA6112","Fleischer, Holger; Schollmeyer, Dieter","<i>trans</i>-Bis(1<i>H</i>-benzimidazole-1-thione-κ<i>S</i>)tetrachlorotellurium methanol disolvate","Acta Crystallographica Section E","2002","58","8","o901","o903","10.1107/S1600536802012424","","","1.54178","CuKα","","0.059","0.043","","","0.104","0.113","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201706","16.097","0.009","8.922","0.003","13.858","0.004","90","","100.04","0.03","90","","1959.8","1.4","193","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[5-Amino-6,8-dichloro-2,3-bis(2-pyridyl)quinoxaline]dichlorozinc(II)","","- C18 H11 Cl4 N5 Zn -","- C18 H11 Cl4 N5 Zn -","- C72 H44 Cl16 N20 Zn4 -","4","1","YA6113","Dao-Li An; Miao Du; Xian-He Bu; Kumar Biradha; Mitsuhiko Shionoya","[5-Amino-6,8-dichloro-2,3-bis(2-pyridyl)quinoxaline]dichlorozinc(II)","Acta Crystallographica Section E","2002","58","8","m436","m438","10.1107/S1600536802011996","","","0.71073","MoKα","","0.096","0.046","","","0.078","0.088","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201707","10.2056","0.0006","40.436","0.003","10.3584","0.0006","90","","117.423","0.006","90","","3794.3","0.5","153","2","153","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Dibromodicarbonylbis(triphenylphosphine)ruthenium(II) dichloromethane solvate","","- C39 H32 Br2 Cl2 O2 P2 Ru -","- C39 H32 Br2 Cl2 O2 P2 Ru -","- C156 H128 Br8 Cl8 O8 P8 Ru4 -","4","1","YA6114","Lozano Diz, Enrique; Therrien, Bruno; Neels, Antonia; Süss-Fink, Georg","Dibromodicarbonylbis(triphenylphosphine)ruthenium(II) dichloromethane solvate","Acta Crystallographica Section E","2002","58","8","m404","m405","10.1107/S160053680201190X","","","0.71073","MoKα","","0.059","0.038","","","0.084","0.09","","","","","","0.93","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201708","12.7053","0.0008","12.7053","0.0008","17.6737","0.0015","90","","90","","90","","2853","0.4","293","2","293","2","","","","","","","","5","I -4 2 d","I -4 2bw","122","","Bis(dicyclohexylammonium) tungstate dihydrate","","- C24 H52 N2 O6 W -","- C24 H52 N2 O6 W -","- C96 H208 N8 O24 W4 -","4","0.25","YA6115","Bi, Wenhua; Sun, Daofeng; Cao, Rong; Hong, Maochun","Bis(dicyclohexylammonium) tungstate dihydrate, [NH~2~(C~6~H~11~)~2~]~2~[WO~4~]·2H~2~O","Acta Crystallographica Section E","2002","58","11","m611","m612","10.1107/S1600536802017828","","","0.71073","MoKα","","0.026","0.02","","","0.043","0.046","","","","","","1.05","","","","has coordinates,has Fobs","194538","2020-10-21","18:00:00",""
"2201709","8.5979","0.0002","6.9495","0.0002","8.9726","0.0002","90","","101.783","0.002","90","","524.83","0.02","294","2","294","2","","","","","","","","4","P 1 21 1","P 2yb","4","bicyclo-HMX","cis-2,4,6,8-Tetranitro-1H,5H-2,4,6,8-tetraazabicyclo[3.3.0]octane","","- C4 H6 N8 O8 -","- C4 H6 N8 O8 -","- C8 H12 N16 O16 -","2","1","YA6116","Gilardi, Richard; Flippen-Anderson, Judith L.; Evans, Robin","<i>cis</i>-2,4,6,8-Tetranitro-1<i>H</i>,5<i>H</i>-2,4,6,8-tetraazabicyclo[3.3.0]octane, the energetic compound `bicyclo-HMX'","Acta Crystallographica Section E","2002","58","9","o972","o974","10.1107/S1600536802013582","","","1.54178","CuKα","","0.036","0.036","","","0.09","0.091","","","","","","1.15","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201710","23.8006","0.0004","6.1611","0.0001","20.2972","0.0004","90","","106.539","0.001","90","","2853.2","0.09","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","cis-(1H,5H)-2,4-dinitro-6,8-dipropionyl-2,4,6,8-tetraazabicyclo[3.3.0]octane","","- C10 H16 N6 O6 -","- C10 H16 N6 O6 -","- C80 H128 N48 O48 -","8","1","YA6117","Gilardi, Richard; George, Clifford; Evans, Robin","<i>cis</i>-2,4-Dinitro-6,8-dipropionyl-1<i>H</i>,5<i>H</i>-2,4,6,8-tetraazabicyclo[3.3.0]octane, a precursor of the energetic compound `bicyclo-HMX'","Acta Crystallographica Section E","2002","58","9","o969","o971","10.1107/S1600536802013570","","","1.54178","CuKα","","0.054","0.051","","","0.136","0.139","","","","","","1.08","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201711","4.8211","0.0008","9.2441","0.0014","12.0228","0.001","90","","98.224","0.012","90","","530.31","0.13","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H8 Cl2 N4 S2 -","- C6 H8 Cl2 N4 S2 -","- C12 H16 Cl4 N8 S4 -","2","0.5","YA6119","Jia-Geng Liu; Duan-Jun Xu; Yuan-Zhi Xu; Jing-Yun Wu; Michael Y. Chiang","2,2'-Diamino-4,4'-bi-1,3-thiazolium dichloride","Acta Crystallographica Section E","2002","58","8","o929","o930","10.1107/S160053680201317X","","","0.71073","MoKα","","0.069","0.058","","","0.17","0.18","","","","","","1.12","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201712","9.087","0.002","9.343","0.002","9.682","0.002","87.761","0.003","75.719","0.002","61.275","0.002","695.5","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Hexaaquanickel dinitrate bis(hexamethylenetetramine) tetrahydrate","","- C12 H44 N10 Ni O16 -","- C12 H44 N10 Ni O16 -","- C12 H44 N10 Ni O16 -","1","0.5","YA6120","Hu, Mao-Lin; Ye, Ming-De; Ng, Seik Weng","Hexaaquanickel(II) dinitrate bis(hexamethylenetetramine) tetrahydrate","Acta Crystallographica Section E","2002","58","9","m486","m487","10.1107/S1600536802014071","","","0.71073","MoKα","","0.062","0.043","","","0.087","0.095","","","","","","0.88","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201713","8.468","0.002","11.297","0.002","10.957","0.002","90","","102.314","0.003","90","","1024.1","0.4","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Aminopyrimidin-1-ium trichloroacetate","","- C6 H6 Cl3 N3 O2 -","- C6 H6 Cl3 N3 O2 -","- C24 H24 Cl12 N12 O8 -","4","1","YA6121","Hu, Mao-Lin; Ye, Ming-De; Zain, Sharifuddin M.; Ng, Seik Weng","2-Aminopyrimidin-1-ium trichloroacetate","Acta Crystallographica Section E","2002","58","9","o1005","o1007","10.1107/S160053680201471X","","","0.71073","MoKα","","0.093","0.058","","","0.154","0.181","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201714","7.862","0.001","19.644","0.003","8.204","0.001","90","","103.53","0.01","90","","1231.9","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,4-Bis(2-ammonioethyl)piperazin-1,4-ium tetraperchlorate tetrahydrate","","- C8 H32 Cl4 N4 O20 -","- C8 H32 Cl4 N4 O20 -","- C16 H64 Cl8 N8 O40 -","2","0.5","YA6122","Ye, Ming-De; Hu, Mao-Lin; Zain, Sharifuddin M.; Ng, Seik Weng","1,4-Bis(2-ammonioethyl)piperazin-1,4-ium tetraperchlorate tetrahydrate","Acta Crystallographica Section E","2002","58","9","o1008","o1009","10.1107/S1600536802014782","","","0.71073","MoKα","","0.058","0.05","","","0.139","0.146","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201715","5.8083","0.0009","10.9298","0.0019","5.7575","0.0008","90","","99.903","0.012","90","","360.06","0.1","220","2","220","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","N,N-dimethylpiperazine","","","- C6 H14 N2 -","- C6 H14 N2 -","- C12 H28 N4 -","2","0.5","YA6123","Andrew Parkin; Simon Parsons","<i>N,N</i>'-Dimethylpiperazine, grown at 270K and studied at 220K","Acta Crystallographica Section E","2002","58","9","o981","o982","10.1107/S1600536802013594","","","1.54178","CuKα","","0.041","0.038","","","0.104","0.107","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201716","6.712","0.0008","31.392","0.001","9.826","0.0009","90","","103.17","0.005","90","","2015.9","0.3","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H18 N4 O10 S2 -","- C15 H18 N4 O10 S2 -","- C60 H72 N16 O40 S8 -","4","1","YA6126","Chan, Kannie Wai Yan; Wong, Wing Tak","2-Hydroxy-3-(<i>p</i>-nitrobenzenesulfonylamino)propylammonium <i>p</i>-nitrobenzenesulfonate","Acta Crystallographica Section E","2002","58","10","o1048","o1050","10.1107/S1600536802015349","","","0.7107","MoKα","","","0.053","","","","0.052","","","","","","1.19","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2201717","7.6045","0.0012","9.6885","0.0015","9.7991","0.0016","88.804","0.002","69.069","0.002","72.853","0.002","641.46","0.18","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Imidazolium trihydrogen 1,2,4,5-benzenetetracarboxylate","","- C13 H10 N2 O8 -","- C13 H10 N2 O8 -","- C26 H20 N4 O16 -","2","1","YA6127","Yan-Qiong Sun; Jie Zhang; Guo-Yu Yang","Imidazolium trihydrogen-1,2,4,5-benzenetetracarboxylate","Acta Crystallographica Section E","2002","58","10","o1100","o1102","10.1107/S1600536802016410","","","0.71073","MoKα","","0.073","0.058","","","0.139","0.156","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201718","10.4584","0.0001","9.2661","0.0002","13.7923","0.0003","90","","90.329","0.001","90","","1336.57","0.04","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Acetyl-1,2-dihydro-2-oxotrispiro[indole-3,2'-oxetane-3',1'';4',1'''- dicyclopropane]","","- C16 H15 N O3 -","- C16 H15 N O3 -","- C64 H60 N4 O12 -","4","1","YA6128","Anwar Usman; Ibrahim Abdul Razak; Hoong-Kun Fun; Suchada Chantrapromma; Yan Zhang; Jian-Hua Xu","1-Acetyl-1,2-dihydro-2-oxotrispiro[indole-3,2'-oxetane-3',1''; 4',1'''-dicyclopropane]","Acta Crystallographica Section E","2002","58","10","o1055","o1056","10.1107/S1600536802015672","","","0.71073","MoKα","","0.091","0.062","","","0.156","0.176","","","","","","0.99","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201719","10.542","0.008","5.359","0.003","11.958","0.005","90","","115.83","0.02","90","","608","0.6","150","","150","","","","","","","","","2","I 1 2/a 1","-I 2ya","15","","","","- Cl4 Pb -","- Cl4 Pb -","- Cl16 Pb4 -","4","0.5","","Iain J. Maley; Simon Parsons; Colin R. Pulham","Lead(IV) chloride at 150 K","Acta Crystallographica, Section E","2002","58","","i79","i81","10.1107/S1600536802015064","","","","","","","","","","","","","","","","","","","","","has coordinates","282067","2023-03-26","07:49:21",""
"2201720","5.788","0.005","17.499","0.005","19.463","0.005","90","","90","","90","","1971.3","1.9","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Ethyl 3-(diphenylphosphinoyl)-3-phenylpropionate","","- C23 H23 O3 P -","- C23 H23 O3 P -","- C92 H92 O12 P4 -","4","1","YA6130","Light, Mark E.; Murphy, Patrick J.; Hancock, Paul; Hursthouse, Michael B.","Ethyl 3-(diphenylphosphinoyl)-3-phenylpropionate","Acta Crystallographica Section E","2002","58","9","o990","o991","10.1107/S1600536802014642","","","0.71073","MoKα","","0.111","0.055","","","0.094","0.11","","","","","","0.98","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201721","18.763","0.004","10.674","0.002","16.064","0.003","90","","115.02","0.03","90","","2915.3","1.2","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","tetrakis(2-methylimidazolo) bis(trifluoromethylsulfonato)copper(II)","","- C18 H24 Cu F6 N8 O6 S2 -","- C18 H24 Cu F6 N8 O6 S2 -","- C72 H96 Cu4 F24 N32 O24 S8 -","4","1","YA6131","Liu, Shyh-Jiun; Wang, Ru-Ji; Su, Chan-Cheng","Tetrakis(2-methylimidazolo)bis(trifluoromethylsulfonato)copper(II)","Acta Crystallographica Section E","2002","58","10","m554","m556","10.1107/S1600536802016288","","","0.71073","MoKα","","0.123","0.058","","","0.112","0.126","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201722","30.102","0.006","5.712","0.001","7.466","0.002","90","","93.97","0.03","90","","1280.6","0.5","152","2","152","2","","","","","","","","3","C 1 c 1","C -2yc","9","","1,5-diphenylpent-4-ene-1,3-dione","","- C17 H14 O2 -","- C17 H14 O2 -","- C68 H56 O8 -","4","1","YA6133","Arrieta, Antonio F.; Arvid Mostad","1,5-Diphenylpent-4-ene-1,3-dione","Acta Crystallographica Section E","2002","58","11","o1301","o1303","10.1107/S160053680201930X","","","0.71073","MoKα","","0.053","0.044","","","0.123","0.141","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201723","12.005","0.007","5.758","0.002","16.25","0.009","90","","107.48","0.06","90","","1071.4","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","DL-phenylalaninium nitrate","DL-phenylalaninium nitrate","","- C9 H12 N2 O5 -","- C9 H12 N2 O5 -","- C36 H48 N8 O20 -","4","1","YA6134","B.Sridhar; N. Srinivasan; R.K.Rajaram","<small>DL</small>-Phenylalaninium nitrate","Acta Crystallographica Section E","2002","58","10","o1103","o1105","10.1107/S1600536802016525","","","0.71073","MoKα","","0.168","0.047","","","0.101","0.141","","","","","","0.96","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201724","9.059","0.0006","19.507","0.003","10.1015","0.0009","90","","90","","90","","1785.1","0.3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","DL-threoninium dihydrogen phosphate","DL-threoninium dihydrogen phosphate","","- C4 H12 N O7 P -","- C4 H12 N O7 P -","- C32 H96 N8 O56 P8 -","8","1","YA6135","Ravikumar, B.; Sridhar, B.; Rajaram, R. K.","<small>DL</small>-Threoninium dihydrogen phosphate","Acta Crystallographica Section E","2002","58","11","o1185","o1187","10.1107/S1600536802017762","","","0.71069","MoKα","","0.049","0.036","","","0.086","0.091","","","","","","1.23","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201725","8.2","0.001","11.002","0.002","12.408","0.002","82.28","0.02","82.26","0.02","72.57","0.01","1053","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","Bis(1,10-phenanthroline)diazidonickel(II)","","- C24 H16 N10 Ni -","- C24 H16 N10 Ni -","- C48 H32 N20 Ni2 -","2","1","YA6136","Cheng, Ya-Qian; Liu, Ai-Li; Hu, Mao-Lin; Ng, Seik Weng","Bis(1,10-phenanthroline)diazidonickel(II)","Acta Crystallographica Section E","2002","58","10","m545","m547","10.1107/S1600536802016264","","","0.71073","MoKα","","0.032","0.027","","","0.071","0.072","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201726","5.49","0.001","6.799","0.002","8.716","0.002","79.742","0.004","75.852","0.003","69.517","0.003","293.99","0.12","298","2","298","2","","","","","","","","4","P -1","-P 1","2","Disodium dihydrogen pyromellitate dihydrate","Disodium dihydrogen 1,2,4,5-benzenetetracarboxylate dihydrate","","- C10 H8 Na2 O10 -","- C10 H8 Na2 O10 -","- C10 H8 Na2 O10 -","1","0.5","YA6137","Hu, Mao-Lin; Ng, Seik Weng","Disodium dihydrogen 1,2,4,5-benzenetetracarboxylate dihydrate","Acta Crystallographica Section E","2002","58","11","m616","m618","10.1107/S1600536802017816","","","0.71073","MoKα","","0.057","0.041","","","0.099","0.107","","","","","","0.94","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201727","7.122","0.0012","10.3935","0.0007","11.1259","0.001","90","","91.529","0.01","90","","823.27","0.17","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C4 H10 Co O8 -","- C4 H10 Co O8 -","- C16 H40 Co4 O32 -","4","1","YA6138","Zhi-Yong Wu; Duan-Jun Xu; Jing-Yun Wu; Michael Y. Chiang","Redetermination of <i>catena</i>-poly[diaqua(oxydiacetato-<i>O</i>,<i>O</i>',<i>O</i>'')cobalt(II) monohydrate]","Acta Crystallographica Section E","2002","58","11","m634","m635","10.1107/S1600536802018342","","","0.71069","MoKα","","0.026","0.022","","","0.062","0.064","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201728","6.6552","0.0003","10.9949","0.0005","17.0794","0.0007","90","","90","","90","","1249.76","0.1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Dimethylphenyltin(IV) trifluoroacetate","catena-Poly(dimethylphenyltin-μ-trifluoroacetato-O;O')","","- C10 H11 F3 O2 Sn -","- C10 H11 F3 O2 Sn -","- C40 H44 F12 O8 Sn4 -","4","1","YA6139","Amini, Mostafa M.; Abadi, Shabnam Hossein; Mirzaee, Mahdi; Lügger, Thomas; Hahn, F. Ekkehardt; Ng, Seik Weng","<i>catena</i>-Poly[μ-trifluoroacetato-<i>O</i>:<i>O</i>'-dimethylphenyltin(IV)]","Acta Crystallographica Section E","2002","58","11","m650","m652","10.1107/S1600536802018779","","","0.71073","MoKα","","0.021","0.02","","","0.05","0.051","","","","","","0.99","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201729","9.4001","0.0006","20.952","0.001","11.292","0.0007","90","","110.671","0.002","90","","2080.8","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Bis(1,1,3,3-tetramethyl-1,3-dibenzoatodistannoxane)","Octamethyl-1κ^2^C,2κ^2^C,3κ^2^C,4κ^2^C-tetrakis-μ-benzoato- 1:2κ^2^O,O';2:3κ^2^O;3:4κ^2^O,O';1:4κ^2^O-bis-μ~3~-oxo- 1:2:3k^3^O;1:3:4k^3^O-tetratin","","- C36 H44 O10 Sn4 -","- C36 H44 O10 Sn4 -","- C72 H88 O20 Sn8 -","2","0.5","YA6140","Amini, Mostafa M.; Abadi, Shabnam Hossein; Mirzaee, Mahdi; Lügger, Thomas; Hahn, F. Ekkehardt; Ng, Seik Weng","Bis(1,1,3,3-tetramethyl-1,3-dibenzoatodistannoxane)","Acta Crystallographica Section E","2002","58","12","m697","m699","10.1107/S1600536802020020","","","0.71073","MoKα","","0.049","0.034","","","0.075","0.08","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201730","10.512","0.0001","10.5128","0.0001","14.5755","0.0001","99.713","0.001","99.927","0.001","103.383","0.001","1506.53","0.03","183","2","183","2","","","","","","","","5","P -1","-P 1","2","","Tris(N-butyl-N-ethyldithiocarbamato)bismuth(III)","","- C21 H42 Bi N3 S6 -","- C21 H42 Bi N3 S6 -","- C42 H84 Bi2 N6 S12 -","2","1","YA6141","Baba, Ibrahim; Karimah, Kassim; Farina, Yang; Othman, Abdul Hamid; Ibrahim, Abdul Razak; Usman, Awang; Fun, Hoong-Kun; Ng, Seik Weng","Tris(<i>N</i>-butyl-<i>N</i>-ethyldithiocarbamato)bismuth(III)","Acta Crystallographica Section E","2002","58","12","m756","m757","10.1107/S1600536802021256","","","0.71073","MoKα","","0.07","0.059","","","0.154","0.162","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201731","12.7276","0.0001","6.6693","0.0001","22.2508","0.0001","90","","100.669","0.001","90","","1856.09","0.03","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(μ-N-methyl-N-phenyldithiocarbamato)[bis(μ-N-methyl-N- phenyldithiocarbamato)zinc(II)]","","- C32 H32 N4 S8 Zn2 -","- C32 H32 N4 S8 Zn2 -","- C64 H64 N8 S16 Zn4 -","2","0.5","YA6142","Baba, Ibrahim; Lee, Lay Hoon; Farina, Yang; Othman, A. Hamid; Ibrahim, Abdul Razak; Usman, Awang; Fun, Hoong-Kun; Ng, Seik Weng","Bis(μ-<i>N</i>-methyl-<i>N</i>-phenyldithiocarbamato)[bis(<i>N</i>-methyl-<i>N</i>-phenyldithiocarbamato)zinc(II)]","Acta Crystallographica Section E","2002","58","12","m744","m745","10.1107/S1600536802021141","","","0.71073","MoKα","","0.065","0.047","","","0.106","0.114","","","","","","0.95","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201732","11.78","0.003","14.872","0.005","6.061","0.002","90","","98.27","0.02","90","","1050.8","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H14 Cl4 Cu2 N2 O2 -","- C18 H14 Cl4 Cu2 N2 O2 -","- C36 H28 Cl8 Cu4 N4 O4 -","2","0.5","YA6147","Ivashevskaja, Svetlana N.; Aleshina, Lyudmila A.; Andreev, Vladimir P.; Nizhnik, Yakov P.; Chernyshev, Vladimir V.","Bis(μ-quinoline <i>N</i>-oxide-κ^2^<i>O</i>:<i>O</i>)bis[dichlorocopper(II)], a powder diffraction study","Acta Crystallographica Section E","2002","58","12","m721","m723","10.1107/S1600536802020561","","","1.93728","FeKα","","","","","","","","","","2.8","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201733","6.366","0.003","15.411","0.006","7.679","0.003","90","","91.331","0.007","90","","753.2","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-[1,4-phenylenebis(methylenethio)]dithiazole","","- C14 H12 N2 S4 -","- C14 H12 N2 S4 -","- C28 H24 N4 S8 -","2","0.5","AC6022","Zhang, Wei; Liu, Hui-Min; Li, Chun-Bao; Zhang, Wen-Qin","2,2'-[1,4-Phenylenebis(methylenethio)]dithiazole","Acta Crystallographica Section E","2003","59","1","o26","o27","10.1107/S1600536802022377","","","0.71073","MoKα","","0.0689","0.0399","","","0.0773","0.086","","","","","","1.038","","","","has coordinates,has Fobs","198633","2020-10-21","18:00:00",""
"2201734","6.6372","0.0011","18.109","0.003","11.4921","0.0019","90","","92.867","0.003","90","","1379.5","0.4","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-(4-methoxylphenyl)quinoline-2-carboxamide","","- C17 H14 N2 O2 -","- C17 H14 N2 O2 -","- C68 H56 N8 O8 -","4","1","AC6023","Qi, Jian Ying; Qiu, Li Qin; Yang, Qi Yun; Zhou, Zhong Yuan; Chan, Albert S. C.","<i>N</i>-(4-Methoxyphenyl)quinoline-2-carboxamide","Acta Crystallographica Section E","2003","59","1","o102","o103","10.1107/S1600536802022420","","","0.71073","MoKα","","0.0784","0.0419","","","0.0981","0.1107","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201735","6.5389","0.001","17.036","0.003","12.702","0.002","90","","102.377","0.003","90","","1382.1","0.4","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-(4-iodopheny)quinoline-2-carboxamide","","- C16 H11 I N2 O -","- C16 H11 I N2 O -","- C64 H44 I4 N8 O4 -","4","1","AC6024","Qi, Jian Ying; Qiu, Li Qin; Yang, Qi Yun; Zhou, Zhong Yuan; Chan, Albert S. C.","<i>N</i>-(4-Iodophenyl)quinoline-2-carboxamide","Acta Crystallographica Section E","2003","59","1","o104","o105","10.1107/S1600536802022419","","","0.71073","MoKα","","0.052","0.0314","","","0.0654","0.0716","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201736","8.0552","0.0001","11.668","0.0001","18.3257","0.0002","95.079","0.001","102.171","0.001","93.226","0.001","1672.1","0.03","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","3-Methoxy-1-(4-methoxyphenyl)-4,4-bis(methylsulfoxy)azetidin-2-one","","- C13 H17 N O7 S2 -","- C13 H17 N O7 S2 -","- C52 H68 N4 O28 S8 -","4","2","AC6025","Deschamps, Jeffrey R.; McCain, Melodie; Konaklieva, Monika","3-Methoxy-1-(4-methoxyphenyl)-4,4-bis(methylsulfoxy)azetidin-2-one","Acta Crystallographica Section E","2003","59","1","o36","o37","10.1107/S1600536802022705","","","1.54178","CuKα","","0.0441","0.0418","","","0.1122","0.1149","","","","","","1.082","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201737","8.0985","0.001","6.8757","0.0015","20.406","0.002","90","","103.607","0.008","90","","1104.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate","","- C11 H15 N O3 -","- C11 H15 N O3 -","- C44 H60 N4 O12 -","4","1","AC6026","Paixão, Jose Antonio; Ramos Silva, Manuela; Matos Beja, Ana; Sobral, Abilio J. F. N.; Lopes, Susana H.; Rocha Gonsalves, A. M. d'A.","Ethyl 4-acetyl-3,5-dimethyl-1<i>H</i>-pyrrole-2-carboxylate","Acta Crystallographica Section E","2003","59","1","o94","o96","10.1107/S1600536802023073","","","1.5418","CuKα","","0.0609","0.0438","","","0.1322","0.1435","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201738","9.706","0.005","7.292","0.003","16.958","0.008","90","","104.519","0.006","90","","1161.9","0.9","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","5-butylthevinone","(7α-acetyl-4,5α-epoxy-3,6-dimethoxy-5β-butyl-17-methyl-6α, 14α ethenoisomorphinan)","","- C27 H35 N O4 -","- C27 H35 N O4 -","- C54 H70 N2 O8 -","2","1","AC6027","Chen, Weibin; Matthew D. Metcalf; Coop, Andrew; Flippen-Anderson, Judith L.; Deschamps, Jeffrey R.","5-Butylthevinone: stereochemistry of the Diels‒Alder reaction of 5-butylthebaine with 3-buten-2-one","Acta Crystallographica Section E","2003","59","2","o114","o116","10.1107/S1600536802023413","","","0.71073","MoKα","","0.1081","0.0557","","","0.1128","0.1236","","","","","","0.965","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201739","4.814","0.0002","8.9168","0.0004","12.4943","0.0006","83.797","0.002","79.735","0.002","81.035","0.002","519.51","0.04","120","2","120","2","","","","","","","","4","P -1","-P 1","2","Succinyl isoniazid","4-(2-isonicotinoylhydrazino)-4-oxobutanoic acid","","- C10 H11 N3 O4 -","- C10 H11 N3 O4 -","- C20 H22 N6 O8 -","2","1","AC6028","Doriguetto, Antonio C.; Paula Silva, Carlos H. T. de; Rando, Daniela G.; Ferreira, Elizabeth I.; Ellena, Javier A.","4-(2-Isonicotinoylhydrazino)-4-oxobutanoic acid","Acta Crystallographica Section E","2003","59","3","o288","o289","10.1107/S1600536803002435","","","0.71073","MoKα","","","0.0551","","","","0.1594","","","","","","1.084","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201740","10.633","0.004","12.078","0.004","12.262","0.004","113.266","0.006","95.167","0.006","95.326","0.006","1426.6","0.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1'-(2-Carboxyethyl)-3',3'-dimethyl-6,8-dinitrospiro[2H-1-benzopyran- 2,2'(2H)-indole] bis(dimethylformamide) solvate","","- C27 H33 N5 O9 -","- C27 H33 N5 O9 -","- C54 H66 N10 O18 -","2","1","AC6029","Zou, Wuxin; Chen, Peili; Gao, Yu; Meng, Jiben","3-{2-[2-(3,5-Dinitro-2-oxidophenyl)ethyl]-3,3-dimethyl-3<i>H</i>-indol-1-ium-1-yl}propanoic acid bis(dimethylformamide) solvate","Acta Crystallographica Section E","2003","59","3","o337","o339","10.1107/S1600536803003337","","","0.71073","MoKα","","0.1593","0.0631","","","0.1196","0.1528","","","","","","0.997","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201741","16.2513","0.0009","15.5891","0.0009","16.376","0.001","90","","94","0.001","90","","4138.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[[bis(4,4'-bipyridine)bis(μ-oxalato)trizinc(II)]]-di-μ-4,4'- bipyridine-μ~2~-oxalato]","","- C46 H32 N8 O12 Zn3 -","- C46 H32 N8 O12 Zn3 -","- C184 H128 N32 O48 Zn12 -","4","1","AC6030","Nordell, Karen J.; Higgins, Khadine A.; Smith, Mark D.","Poly[[bis(4,4'-bipyridine)bis(μ-oxalato)trizinc(II)]-di-μ-4,4'-bipyridine-μ-oxalato]","Acta Crystallographica Section E","2003","59","3","m114","m115","10.1107/S1600536803003532","","","0.71073","MoKα","","0.0347","0.0268","","","0.0609","0.0618","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201742","23.998","0.007","4.2785","0.0013","8.944","0.003","90","","90","","90","","918.3","0.5","294","2","294","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C8 H13 N O3 -","- C8 H13 N O3 -","- C32 H52 N4 O12 -","4","1","AC6031","Chen, Xuanhua; Chen, Tao","Methyl (<i>E</i>)-2-acetyl-3-amino-2-pentenoate","Acta Crystallographica Section E","2003","59","4","o553","o554","10.1107/S1600536803005609","","","0.71073","MoKα","","0.1286","0.0484","","","0.0755","0.0875","","","","","","1.029","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201743","11.188","0.001","12.138","0.002","16.354","0.002","90","","90","","90","","2220.9","0.5","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C24 H22 N4 O6 -","- C24 H22 N4 O6 -","- C96 H88 N16 O24 -","4","0.5","AC6032","Moreno-Fuquen, Rodolfo; Font i Carot, Mercé; Garriga, Miquel; Cano, Felix; Martinez-Ripoll, Martin; Valderrama-Naranjo, Jaime; Serratto, Luis Manuel","The 2:1 complex of 4-aminobenzoic acid and 4,4'-bipyridyl <i>N,N</i>'-dioxide","Acta Crystallographica Section E","2003","59","4","o495","o497","10.1107/S160053680300552X","","","0.71073","MoKα","","0.087","0.044","","","0.116","0.146","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201744","7.449","0.002","7.537","0.002","12.403","0.003","73.47","0.03","79.92","0.03","85.45","0.03","656.9","0.3","174","2","174","2","","","","","","","","4","P -1","-P 1","2","","4,5-Dibromo-1-methyl-1H-imidazole","","- C4 H4 Br2 N2 -","- C4 H4 Br2 N2 -","- C16 H16 Br8 N8 -","4","2","AC6033","Noland, Wayland E.; Cole, Kevin P.; Britton, Doyle","4,5-Dibromo-1-methyl-1<i>H</i>-imidazole","Acta Crystallographica Section E","2003","59","4","o458","o460","10.1107/S1600536803005269","","","0.71073","MoKα","","0.039","0.032","","","0.077","0.08","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201745","9.256","0.003","14.834","0.005","15.957","0.005","90","","104.979","0.006","90","","2116.5","1.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","{[N-Benzyl-N-(2-pyridyl)amino]methylene}diphenylphosphine oxide","","- C25 H23 N2 O P -","- C25 H23 N2 O P -","- C100 H92 N8 O4 P4 -","4","1","AC6034","Cui Da-Jun; Zeng Xianshun; Leng Xuebing; Xu Fengbo; Zhang Zhengzhi","{[<i>N</i>-Benzyl-<i>N</i>-(2-pyridyl)amino]methylene}diphenylphosphine oxide","Acta Crystallographica Section E","2003","59","5","o679","o680","10.1107/S1600536803008304","","","0.71073","MoKα","","0.1055","0.0468","","","0.0993","0.1204","","","","","","0.971","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201746","9.793","0.002","11.704","0.002","18.061","0.004","71.72","0.03","89.45","0.03","82.09","0.03","1945.7","0.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","AETO4Pb3I10","Tetrakis[(9-oxo-10-thiaxanthen-2-yloxyethyl)ammonium] decaiodidotriplumbate(II)","","- C60 H56 I10 N4 O8 Pb3 S4 -","- C60 H56 I10 N4 O8 Pb3 S4 -","- C60 H56 I10 N4 O8 Pb3 S4 -","1","0.5","AC6035","Karen R. Maxcy; Roger D. Willett; David B. Mitzi; Ali Afzali","Tetrakis[(9-oxo-10-thiaxanthen-2-yloxyethyl)ammonium] decaiodotriplumbate(II)","Acta Crystallographica Section E","2003","59","6","m364","m366","10.1107/S1600536803007414","","","0.71073","MoKα","","0.0501","0.0353","","","0.086","0.0923","","","","","","0.973","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201747","5.6672","0.0003","18.0609","0.0011","8.1949","0.0005","90","","99.135","0.003","90","","828.15","0.08","120","2","","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C9 H8 N2 O2 -","- C9 H8 N2 O2 -","- C36 H32 N8 O8 -","4","1","AC6036","Resende, Jackson Antônio Lamounier Camargos; Santos Jr, Sauli; Ellena, Javier; Guilardi, Silvana","2-Cyano-<i>N</i>-(2-hydroxyphenyl)acetamide","Acta Crystallographica Section E","2003","59","5","o723","o725","10.1107/S1600536803008316","","","0.71073","MoKα","","","0.0511","","","","0.1311","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201748","12.0156","0.0006","10.7001","0.0006","18.628","0.0009","90","","95.177","0.004","90","","2385.2","0.2","294","1","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,2'-bis(1-ethylbenzimidazol-2-yl)biphenyl","","- C30 H26 N4 -","- C30 H26 N4 -","- C120 H104 N16 -","4","1","AC6037","Robert T. Stibrany; Harvey J. Schugar; Joseph A. Potenza","2,2'-Bis(1-ethylbenzimidazol-2-yl)biphenyl","Acta Crystallographica Section E","2003","59","5","o693","o695","10.1107/S1600536803007852","","","0.71073","MoKα","","0.0801","0.0598","","","0.1597","0.174","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201749","6.186","0.0012","13.436","0.003","14.725","0.003","65.63","0.03","88.15","0.03","83.55","0.03","1107.6","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Indium 8-hydroxyquinolate","Tris(quinolin-8-olato)indium","","- C27 H18 In N3 O3 -","- C27 H18 In N3 O3 -","- C54 H36 In2 N6 O6 -","2","1","AC6038","Rajeswaran, Manju; Jarikov, Viktor V.","Tris(quinolin-8-olato)indium(III)","Acta Crystallographica Section E","2003","59","6","m306","m307","10.1107/S1600536803009231","","","0.71073","MoKα","","0.1055","0.0499","","","0.1155","0.1498","","","","","","0.743","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201750","10.2683","0.0011","10.9843","0.0013","34.514","0.004","90","","93.294","0.009","90","","3886.4","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","cis-Dichlorotetrakis(2-mercapto-1-tert-butylimidazole)lead(II)","","- C28 H48 Cl2 N8 Pb S4 -","- C28 H48 Cl2 N8 Pb S4 -","- C112 H192 Cl8 N32 Pb4 S16 -","4","1","AC6039","Robin N. Evans; David J. Mihalcik; Daniel S. Jones; Daniel Rabinovich","<i>cis</i>-Dichlorotetrakis(2-mercapto-1-<i>tert</i>-butylimidazole)lead(II)","Acta Crystallographica Section E","2003","59","6","m370","m372","10.1107/S160053680301064X","","","1.5418","CuKα","","0.0579","0.0472","","","0.1235","0.1301","","","","","","1.034","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201751","14.819","0.003","9.4142","0.0016","18.635","0.003","90","","97.674","0.003","90","","2576.5","0.8","178","2","178","2","","","","","","","","5","P 1 21 1","P 2yb","4","","[(1-tert-Butyl-2-phenylvinylamino)(dimethylamino)dimethylsilyl-κ^2^N,N'] (N,N,N',N'-tetramethylenediamine-κ^2^N,N')lithium(I)","","- C22 H43 Li N4 Si -","- C22 H43 Li N4 Si -","- C88 H172 Li4 N16 Si4 -","4","2","AC6040","He-Ping Shi; Dian-Sheng Liu; Shu-Ping Huang","[(1-<i>tert</i>-Butyl-2-phenylvinylamino)(dimethylamino)dimethylsilyl-κ^2^<i>N,N</i>'] (<i>N,N,N</i>',<i>N</i>'-tetramethylenediamine-κ^2^<i>N,N</i>')lithium(I)","Acta Crystallographica Section E","2003","59","6","m339","m341","10.1107/S1600536803010353","","","0.71073","MoKα","","0.1027","0.0584","","","0.0582","0.0658","","","","","","0.833","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201752","9.1611","0.0004","9.9709","0.0009","11.1916","0.0008","90","","90","","90","","1022.29","0.13","293","2","293","2","","","","","","","","3","A b a 2","A 2 -2ab","41","","","","- Mo7.62 O14 Pr -","- Mo7.622 O14 Pr -","- Mo30.488 O56 Pr4 -","4","","BR6072","Barrier, N.; Gougeon, P.","The cluster compound PrMo~7.6~O~14~","Acta Crystallographica Section E","2003","59","3","i28","i30","10.1107/S1600536802022973","","","0.7107","MoKα","","0.0492","0.0413","","","0.0894","0.0932","","","","","","1.103","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2201753","7.26327","0.00004","14.78061","0.00008","7.70343","0.00004","90","","90","","90","","827.006","0.008","293","","293","","","","","","","","","2","P n m a","-P 2ac 2n","62","","pentaytterbium tetrasilicide","","- Si4 Yb5 -","- Si4 Yb5 -","- Si16 Yb20 -","4","0.5","BR6073","Radovan Černý; K. Alami-Yadri","Orthorhombic Yb~5~Si~4~ from synchrotron powder data","Acta Crystallographica Section E","2003","59","2","i1","i3","10.1107/S1600536802023541","","","0.52301","synchrotron","","","","","","","","","","1.28","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2201754","11.791","0.003","12.489","0.003","6.4191","0.001","90","","113.82","0.02","90","","864.7","0.4","293","2","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Fe1.21 Mg1.79 Na1.79 O12 P3 -","- Fe1.2082 Mg1.792 Na1.7917 O12 P3 -","- Fe4.8328 Mg7.168 Na7.1668 O48 P12 -","4","0.5","BR6074","Hidouri, Mourad; Lajmi, Besma; Driss, Ahmed; Ben amara, Mongi","The alluaudite-like phosphate Na~1.79~Mg~1.79~Fe~1.21~(PO~4~)~3~","Acta Crystallographica Section E","2003","59","2","i7","i9","10.1107/S1600536803000837","","","0.71073","MoKα","","","0.0233","","","","0.0705","","","","","","1.154","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2201755","7.947","0.0003","11.68","0.0004","9.729","0.0003","90","","113.57","0.003","90","","827.72","0.05","293","2","292","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","dipotassium ammonium hydrogen difluorophosphate","dipotassium ammonium hydrogen difluorophosphate","","- F2 H4.704 K2.074 N0.926 O6 P2 -","- F2 H4.704 K2.074 N0.926 O6 P2 -","- F8 H18.816 K8.296 N3.704 O24 P8 -","4","0.5","BR6075","Fábry, Jan; Krupková, Radmila; Císařová, Ivana","Ammonium dipotassium hydrogen difluorophosphate at room temperature","Acta Crystallographica Section E","2003","59","2","i14","i16","10.1107/S160053680300117X","","","0.7107","MoKα","","0.0214","0.0206","","","0.0535","0.054","","","","","","1.105","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201756","9.621","0.002","5.339","0.001","13.146","0.003","90","","90.01","0.03","90","","675.3","0.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","sodium aluminum molybdate","","","- Al Mo2 Na O8 -","- Al Mo2 Na O8 -","- Al4 Mo8 Na4 O32 -","4","0.5","","Kolitsch, Uwe; Maczka, Miroslaw; Hanuza, Jerzy","NaAl(MoO~4~)~2~: a rare structure type among layered yavapaiite-related AM(XO~4~)~2~ compounds","Acta Crystallographica, Section E","2003","59","","i10","i13","10.1107/S1600536803000990","","","","","","","","","","","","","","","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201757","7.5087","0.0001","7.6412","0.0002","10.8952","0.0002","90","","90","","90","","625.12","0.02","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Triprasepdymium molybdenum heptaoxide","","- Mo O7 Pr3 -","- Mo O7 Pr3 -","- Mo4 O28 Pr12 -","4","1","BR6077","Barrier, N.; Gougeon, P.","Pr~3~MoO~7~","Acta Crystallographica Section E","2003","59","2","i22","i24","10.1107/S1600536803001892","","","0.7107","MoKα","","0.0309","0.0294","","","0.0656","0.0665","","","","","","1.054","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201758","14.806","0.001","9.078","0.002","14.811","0.002","90","","90","","90","","1990.8","0.5","295","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- H8 Mg Na O10 P3 -","- H8 Mg Na O10 P3 -","- H64 Mg8 Na8 O80 P24 -","8","1","","Ouarsal, Rachid; Alaoui Tahiri, Aziz; Lachkar, Mohammed; Dusek, Michal; Karla, Fejfarova; El Bali, Brahim","Synthesis and crystal structure of sodium magnesium tris(dihydrogenophosphite) monohydrate, NaMg(H~2~PO~3~)~3~.H~2~O","Acta Crystallographica, Section E","2003","59","","i33","i35","10.1107/S1600536803002757","","","","","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2201759","7.6259","0.0013","7.7107","0.0016","7.6592","0.0013","90","","90","","90","","450.37","0.14","173","2","173","2","","","","","","","","4","C m c m","-C 2c 2","63","","","","- Cl H2 Li O -","- Cl H2 Li O -","- Cl8 H16 Li8 O8 -","8","0.5","","Lerner, Hans-Wolfram; Bolte, Michael","The orthorhombic modification of lithium chloride monohydrate","Acta Crystallographica, Section E","2003","59","","i20","i21","10.1107/S1600536803001594","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2201760","5.5798","0.0003","5.0284","0.0003","8.4521","0.0005","90","","107.634","0.002","90","","226","0.02","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- H2 Li2 O5 Se -","- H2 Li2 O5 Se -","- H4 Li4 O10 Se2 -","2","1","","Johnston, Magnus G.; Harrison, William T. A.","Dilithium selenate hydrate, Li~2~SeO~4~.H~2~O","Acta Crystallographica, Section E","2003","59","","i25","i27","10.1107/S1600536803002526","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2201761","12.262","0.002","12.934","0.003","6.707","0.001","90","","113.69","0.002","90","","974.1","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ag1.49 As3 Mn3 O12 -","- Ag1.49 As3 Mn3 O12 -","- Ag5.96 As12 Mn12 O48 -","4","0.5","","Brahim, Ayed; Amor, Haddad","Ag~1.49~Mn^II^~1.49~Mn^III^~1.51~(AsO~4~)~3~","Acta Crystallographica, Section E","2003","59","","i77","i79","10.1107/S1600536803005816","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2201762","3.851","0.001","10.131","0.002","10.287","0.002","90","","90","","90","","401.34","0.15","293","2","293","2","","","","","","","","3","C m c m","-C 2c 2","63","scandium titanate","","","- O5 Sc2 Ti -","- O5 Sc2 Ti -","- O20 Sc8 Ti4 -","4","0.25","","Kolitsch, Uwe; Tillmanns, Ekkehart","Sc~2~TiO~5~, an entropy-stabilized pseudobrookite-type compound","Acta Crystallographica, Section E","2003","59","","i36","i39","10.1107/S1600536803003544","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2201763","8.3994","0.0013","8.8066","0.0006","14.137","0.0017","90","","90","","90","","1045.7","0.2","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","Mercury(II) tetraborate","","","- B4 Hg O7 -","- B4 Hg O7 -","- B32 Hg8 O56 -","8","1","","Weil, Matthias","HgB~4~O~7~, a member of the isotypic M^II^B~4~O~7~ family (M^II^ = Mg, Mn, Zn, Cd)","Acta Crystallographica, Section E","2003","59","","i40","i42","10.1107/S1600536803003611","","","","","","","","","","","","","","","","","","","","","has coordinates","277836","2022-09-14","17:02:02",""
"2201764","16.996","0.003","11.601","0.002","5.319","0.001","90","","104.67","0.03","90","","1014.6","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","bismuth scandium molybdate","","","- Bi3.041 Mo2 O12 Sc0.959 -","- Bi3.0411 Mo2 O12 Sc0.9589 -","- Bi12.1644 Mo8 O48 Sc3.8356 -","4","0.5","","Kolitsch, Uwe; Tillmanns, Ekkehart","Bi~3~ScMo~2~O~12~: the difference from Bi~3~FeMo~2~O~12~","Acta Crystallographica, Section E","2003","59","","i43","i46","10.1107/S160053680300374X","","","","","","","","","","","","","","","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201765","6.2727","0.0008","3.7821","0.0005","15.578","0.003","90","","90","","90","","369.58","0.09","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- F4 K Pr -","- F4 K Pr -","- F16 K4 Pr4 -","4","0.5","","Werner, Franz; Weil, Matthias; Kubel, Frank","KPrF~4~","Acta Crystallographica, Section E","2003","59","","i47","i49","10.1107/S1600536803005178","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2201766","5.13","0.001","10.56","0.002","17.745","0.004","90","","90","","90","","961.3","0.3","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","lithium scandium molybdate","","","- Li3 Mo3 O12 Sc -","- Li3.007 Mo3 O12 Sc0.993 -","- Li12.028 Mo12 O48 Sc3.972 -","4","0.5","","Kolitsch, Uwe; Tillmanns, Ekkehart","Li~3~Sc(MoO~4~)~3~: substitutional disorder on three (Li,Sc) sites","Acta Crystallographica, Section E","2003","59","","i55","i58","10.1107/S1600536803004872","","","","","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2201767","9.6432","0.0004","9.6432","0.0004","11.1112","0.0006","90","","90","","120","","894.82","0.07","293","2","293","2","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Tristrontium Magnesium Platinum Hexaoxide","","- Mg O6 Pt Sr3 -","- Mg O6 Pt Sr3 -","- Mg6 O36 Pt6 Sr18 -","6","0.166667","BR6088","Smith, Mark D.; zur Loye, Hans-Conrad","Sr~3~MgPtO~6~","Acta Crystallographica Section E","2003","59","5","i75","i76","10.1107/S1600536803005993","","","0.71073","MoKα","","0.028","0.0238","","","0.0481","0.0487","","","","","","1.005","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201768","10.762","0.002","11.122","0.003","8.771","0.002","105.12","0.02","109.379","0.018","65.112","0.018","889.3","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- Co2 H32 K2 O44 V10 -","- Co2 H32 K2 O44 V10 -","- Co2 H32 K2 O44 V10 -","1","0.5","BR6089","Lee, Uk; Jung, Yeon-Hwa; Joo, Hea-Chung","Dipotassium bis[hexaaquacobalt(II)] decavanadate tetrahydrate","Acta Crystallographica Section E","2003","59","5","i72","i74","10.1107/S1600536803006317","","","0.71069","MoKα","","0.05","0.0365","","","0.0865","0.0957","","","","","","1.116","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201769","9.3384","0.0004","17.3447","0.0007","7.3198","0.0003","90","","90","","90","","1185.6","0.09","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- Cl Co H5 O5 Se -","- Cl Co H5 O5 Se -","- Cl8 Co8 H40 O40 Se8 -","8","1","BR6090","Johnston, Magnus G.; Harrison, William T. A.","Cobalt hydrogen selenite chloride dihydrate, Co(HSeO~3~)Cl·2H~2~O","Acta Crystallographica Section E","2003","59","4","i62","i64","10.1107/S1600536803006378","","","0.71073","MoKα","","0.0264","0.0218","","","0.0602","0.0615","","","","","","1.02","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201770","8.1709","0.0007","8.1709","0.0007","5.3374","0.0007","90","","90","","90","","356.34","0.06","293","2","293","2","","","","","","","","4","P -4 21 m","P -4 2ab","113","","","","- Ba2 Co O7 Si2 -","- Ba2 Co O7 Si2 -","- Ba4 Co2 O14 Si4 -","2","0.25","","El Bali, Brahim; Zavalij, Peter Y.","Tetragonal form of barium cobalt disilicate, Ba~2~CoSi~2~O~7~","Acta Crystallographica, Section E","2003","59","","i59","i61","10.1107/S1600536803006329","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2201771","9.7613","0.0008","11.1627","0.0009","13.3949","0.0011","90","","90","","90","","1459.5","0.2","294","2","294","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- H8 K2 Mn O16 P4 -","- H8 K2 Mn O16 P4 -","- H32 K8 Mn4 O64 P16 -","4","0.5","","Alaoui Tahiri, Aziz; Ouarsal, Rachid; Lachkar, Mohammed; Zavalij, Peter Y.; El Bali, Brahim","Dipotassium manganese(II) bis(dihydrogendiphosphate) dihydrate, K~2~Mn(H~2~P~2~O~7~)~2~.2H~2~O","Acta Crystallographica, Section E","2003","59","","i68","i69","10.1107/S1600536803007189","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2201772","7.223","0.0003","10.4377","0.0004","9.3194","0.0004","90","","93.29","0.002","90","","701.45","0.05","297","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- Cl4 Ga K -","- Cl4 Ga K -","- Cl16 Ga4 K4 -","4","1","BR6095","Mikhail Gorlov; Andreas Fischer; Lars Kloo","Potassium tetrachlorogallate","Acta Crystallographica Section E","2003","59","5","i70","i71","10.1107/S1600536803008067","","","0.71073","MoKα","","0.0549","0.0472","","","0.1131","0.1167","","","","","","1.174","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201773","6.2147","0.0004","8.0225","0.0005","7.8111","0.0007","90","","93.44","0.01","90","","388.74","0.05","293","2","293","2","","","","","","","","3","I 1 2/a 1","-I 2ya","15","Terbium(III) trioxoborate","Terbium(III) trioxoborate","","- B3 O6 Tb -","- B3 O6 Tb -","- B12 O24 Tb4 -","4","0.5","BR6096","Goriounova, Alexandra; Held, Peter; Becker, Petra; Bohatý, Ladislav","Monoclinic modification of polymorphic TbB~3~O~6~","Acta Crystallographica Section E","2003","59","6","i83","i85","10.1107/S1600536803009553","","","0.71073","MoKα","","0.063","0.0356","","","0.0753","0.0823","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201774","12.286","0.005","9.965","0.003","15.386","0.005","90","","97.67","0.03","90","","1866.9","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Quinolinium dichromate","","- C18 H16 Cr2 N2 O7 -","- C18 H16 Cr2 N2 O7 -","- C72 H64 Cr8 N8 O28 -","4","1","BR6097","Sundar, T. V.; Parthasarathi, V.; Thamotharan, S.; Sekar, K. G.","Quinolinium dichromate, [C~9~H~7~NH^+^]~2~·Cr~2~O~7~^2{-^}","Acta Crystallographica Section E","2003","59","6","m327","m329","10.1107/S1600536803009802","","","0.71073","MoKα","","0.093","0.0559","","","0.1374","0.1618","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201775","6.74","0.002","11.295","0.003","11.647","0.003","67.18","0.02","81.59","0.02","85.49","0.02","808.2","0.4","178","2","178","2","","","","","","","","3","P 1","P 1","1","","(S)-4,16-Dihydroxymethyl-[2.2]paracyclophane bis-(1S)-camphanoate","","- C38 H44 O8 -","- C38 H44 O8 -","- C38 H44 O8 -","1","1","BT6213","Jones, Peter G.; Hillmer, Jörg; Hopf, Henning","(<i>S</i>)-4,16-Dihydroxymethyl-[2.2]paracyclophane bis-(1<i>S</i>)-camphanoate","Acta Crystallographica Section E","2003","59","1","o24","o25","10.1107/S1600536802022328","","","0.71073","MoKα","","0.0467","0.0366","","","0.0876","0.0949","","","","","","1.037","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201776","15.403","0.003","7.3835","0.0014","16.281","0.003","90","","92.438","0.012","90","","1849.9","0.6","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","R-(-)-5,6,9,10-tetrahydro-10- [(2-methyl-1H-imidazol-1-yl)-methyl]-4H-pyrido[3,2,1-jk]-carbazol-11(8H)-one monohydrochloride monohydrate","","- C20 H24 Cl N3 O2 -","- C20 H24 Cl N3 O2 -","- C80 H96 Cl4 N12 O8 -","4","2","BT6214","Jones, Peter G.; Möller, Hedwig; Finner, Emil","Cilansetron hydrochloride monohydrate, modification A (monoclinic)","Acta Crystallographica Section E","2003","59","1","o38","o40","10.1107/S160053680202247X","","","0.71073","MoKα","","0.0772","0.0458","","","0.0937","0.103","","","","","","0.9","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201777","7.396","0.002","16.46","0.003","30.263","0.006","90","","90","","90","","3684.2","1.4","123","2","123","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","R-(-)-5,6,9,10-tetrahydro-10- [(2-methyl-1H-imidazol-1-yl)-methyl]-4H-pyrido[3,2,1-jk]-carbazol-11(8H)-one monohydrochloride monohydrate","","- C20 H24 Cl N3 O2 -","- C20 H24 Cl N3 O2 -","- C160 H192 Cl8 N24 O16 -","8","2","BT6215","Jones, Peter G.; Möller, Hedwig; Finner, Emil","Cilansetron hydrochloride monohydrate, modification B (orthorhombic)","Acta Crystallographica Section E","2003","59","1","o41","o43","10.1107/S1600536802022481","","","0.71073","MoKα","","0.0815","0.0577","","","0.0949","0.1047","","","","","","1.153","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201778","6.363","0.002","8.963","0.002","9.157","0.003","70.76","0.02","72.13","0.02","83.41","0.02","469.2","0.2","178","2","178","2","","","","","","","","3","P -1","-P 1","2","","2,7-Dimethyl-4,5-bis(trimethylsilyl)octa-2,3,5,6-tetraene","","- C16 H30 Si2 -","- C16 H30 Si2 -","- C16 H30 Si2 -","1","0.5","BT6216","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Stamm, Reiner","2,7-Dimethyl-4,5-bis(trimethylsilyl)octa-2,3,5,6-tetraene","Acta Crystallographica Section E","2003","59","2","o119","o120","10.1107/S1600536802022870","","","0.71073","MoKα","","0.064","0.0423","","","0.1032","0.1149","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201779","8.3563","0.0006","15.0152","0.0011","11.7498","0.0008","90","","98.089","0.008","90","","1459.6","0.18","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-Cyano-7-methoxy-2,2-dimethyl-4-oxochroman-6-yl acetate","","- C15 H15 N O5 -","- C15 H15 N O5 -","- C60 H60 N4 O20 -","4","1","BT6217","Clegg, William","5-Cyano-7-methoxy-2,2-dimethyl-4-oxochroman-6-yl acetate","Acta Crystallographica Section E","2003","59","1","o61","o62","10.1107/S1600536802023000","","","0.71073","MoKα","","0.1232","0.0933","","","0.276","0.3058","","","","","","1.157","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201780","10.766","0.003","8.243","0.002","18.47","0.005","90","","93.37","0.02","90","","1636.3","0.8","178","2","178","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Z)-3-[(1-Methylethyl)thiomethylene]-4-phenyl-1,4-pentadiene- 1,1,2-tricarbonitrile","","- C18 H15 N3 S -","- C18 H15 N3 S -","- C72 H60 N12 S4 -","4","1","BT6218","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Kreutzer, Martin","(<i>Z</i>)-3-[(1-Methylethyl)thiomethylene]-4-phenyl-1,4-pentadiene-1,1,2-tricarbonitrile","Acta Crystallographica Section E","2003","59","1","o92","o93","10.1107/S1600536802023218","","","0.71073","MoKα","","0.0919","0.0548","","","0.1323","0.1606","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201781","5.2","0.002","10.132","0.004","10.768","0.004","65.66","0.02","83.87","0.02","79.63","0.03","508.1","0.3","160","2","160","2","","","","","","","","4","P 1","P 1","1","","Benzyl (2S)-2-tert-butoxycarbonylamino-5-(2-furyl)-5-oxopentanoate","","- C21 H25 N O6 -","- C21 H25 N O6 -","- C21 H25 N O6 -","1","1","BT6219","Clegg, William; Jackson, Richard F. W.; Wishart, Neil","Benzyl (2<i>S</i>)-2-<i>tert</i>-butoxycarbonylamino-5-(2-furyl)-5-oxopentanoate","Acta Crystallographica Section E","2003","59","1","o86","o88","10.1107/S1600536802023231","","","0.71073","MoKα","","0.032","0.0306","","","0.0798","0.0813","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201782","36.868","0.007","8.1185","0.0016","12.515","0.003","90","","98.36","0.03","90","","3706.1","1.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Rubidium-niobium-sulfide-oxide","Rubidium-niobium-sulfide-oxide","","- Nb4 O0.6 Rb6 S24.4 -","- Nb4 O0.6 Rb6 S24.4 -","- Nb16 O2.4 Rb24 S97.6 -","4","0.5","BT6220","Petra Stoll; Wolfgang Bensch","Rb~6~Nb~4~S~24.4~O~0.6~","Acta Crystallographica Section E","2003","59","2","i4","i6","10.1107/S1600536802023437","","","0.71073","MoKα","","0.0395","0.0307","","","0.0736","0.0767","","","1.054","1.103","1.103","","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2201783","7.9957","0.001","14.527","0.003","8.3194","0.0014","90","","94.93","0.02","90","","962.8","0.3","143","2","143","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1-O-p-toluenesulfonyl-2,3:4,5-di-O-isopropylidene-L-arabitol","","- C18 H26 O7 S -","- C18 H26 O7 S -","- C36 H52 O14 S2 -","2","1","BT6221","Jones, Peter G.; Kuś, Piotr; Celinski, Rafael","1-<i>O</i>-<i>p</i>-Toluenesulfonyl-2,3:4,5-di-<i>O</i>-isopropylidene-<small>L</small>-arabitol","Acta Crystallographica Section E","2003","59","2","o117","o118","10.1107/S1600536802023449","","","0.71073","MoKα","","0.0434","0.0395","","","0.0959","0.1","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201784","8.137","0.002","7.519","0.002","31.439","0.008","90","","95.535","0.008","90","","1914.5","0.8","150","","150","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H29 N O2 -","- C23 H29 N O2 -","- C92 H116 N4 O8 -","4","2","BT6222","Kooijman, Huub; Spek, Anthony L.","(1<i>E</i>,3<i>S</i>,4a<i>R</i>,12a<i>R</i>)-3-Isopropenyl-8-methoxy-3,4,4a,5,6,11,12,12a-octahydro-1(2<i>H</i>)-chrysenone oxime","Acta Crystallographica Section E","2003","59","2","o121","o123","10.1107/S1600536802023693","","","0.71073","MoKα","","0.0916","0.0574","","","0.1409","0.1561","","","","","","1.071","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201785","7.9671","0.0006","4.8182","0.0004","16.812","0.001","90","","110.165","0.007","90","","605.81","0.08","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Potassium 4-nitramino-1,2,4-triazolate","","- C2 H2 K N5 O2 -","- C2 H2 K N5 O2 -","- C8 H8 K4 N20 O8 -","4","1","BT6223","Vasiliev, Alexander D.; Astachov, Alexander M.; Kruglyakova, Ludmila A.; Stepanov, Rudolf S.","Potassium 4-nitramino-1,2,4-triazolate","Acta Crystallographica Section E","2003","59","2","m67","m68","10.1107/S1600536803001077","","","1.5418","CuKα","","0.0515","0.0479","","","0.1209","0.1239","","","","","","1.014","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201786","8.9336","0.0009","16.087","0.002","4.3173","0.0004","90","","96.119","0.008","90","","616.93","0.11","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-Ethyl-2-nitroguanidine","","- C3 H8 N4 O2 -","- C3 H8 N4 O2 -","- C12 H32 N16 O8 -","4","1","BT6224","Vasiliev, Alexander D.; Astachov, Alexander M.; Molokeev, Maxim S.; Kruglyakova, Ludmila A.; Stepanov, Rudolf S.","1-Ethyl-2-nitroguanidine","Acta Crystallographica Section E","2003","59","2","o193","o194","10.1107/S1600536803001089","","","1.5418","CuKα","","0.0397","0.0358","","","0.1031","0.1061","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201787","10.626","0.004","16.048","0.005","16.58","0.007","90","","90","","90","","2827.3","1.8","178","2","178","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,3-dicyanotetrabenzo-pentacyclo[8.2.2.2^4,7^.0^2,9^.0^3,8^]hexadeca- 5,11,13,15-tetraene","","- C35 H23 Cl3 N2 -","- C35 H23 Cl3 N2 -","- C140 H92 Cl12 N8 -","4","1","BT6225","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Witulkski, Bernhard","A dimer of 7-cyanodibenzobarrelene","Acta Crystallographica Section E","2003","59","2","o167","o168","10.1107/S160053680300093X","","","0.71073","MoKα","","0.1352","0.0735","","","0.1765","0.2223","","","","","","1.026","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201788","6.722","0.003","9.154","0.003","12.143","0.004","96.85","0.03","90.65","0.03","102.51","0.03","723.7","0.5","178","2","178","2","","","","","","","","3","P -1","-P 1","2","","9,10-Dicyano-dibenzoisobullvalene","","- C20 H12 N2 -","- C20 H12 N2 -","- C40 H24 N4 -","2","1","BT6226","Jones, Peter G.; Hopf, Henning; Witulkski, Bernhard","9,10-Dicyanodibenzoisobullvalene","Acta Crystallographica Section E","2003","59","2","o169","o170","10.1107/S1600536803000941","","","0.71073","MoKα","","0.0574","0.0402","","","0.1002","0.1112","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201789","14.382","0.002","17.062","0.002","17.053","0.002","90","","95.436","0.012","90","","4165.7","0.9","143","2","143","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","6,6-Dimethyl-2-(methylethenyl)-3,4,5-tris(methylidene)-1-(2-methylpropen- 1-yl)-cyclohexane","","- C24 H36 -","- C24 H36 -","- C192 H288 -","8","2","BT6227","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Höpfner, Thomas","6,6-Dimethyl-2-(1-methylethenyl)-3,4,5-tris(1-methylethylidene)-1-(2-methylpropen-1-yl)cyclohexane","Acta Crystallographica Section E","2003","59","2","o186","o187","10.1107/S1600536803001016","","","0.71073","MoKα","","0.107","0.064","","","0.1352","0.1645","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201790","13.813","0.003","8.909","0.003","10.658","0.003","90","","107.44","0.02","90","","1251.3","0.6","178","2","178","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","[2.2](2,5)Furanoparacyclophane-12,13-dicarbaldehyde","","- C16 H14 O3 -","- C16 H14 O3 -","- C64 H56 O12 -","4","1","BT6228","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Witulkski, Bernhard","[2.2](2,5)Furanoparacyclophane-12,13-dicarbaldehyde","Acta Crystallographica Section E","2003","59","2","o188","o189","10.1107/S1600536803001028","","","0.71073","MoKα","","0.0901","0.0456","","","0.1041","0.1326","","","","","","1.017","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201791","11.1917","0.0008","21.0007","0.0014","29.45","0.002","82.56","0.002","89.492","0.002","82.033","0.002","6796.9","0.8","160","2","160","2","","","","","","","","5","P -1","-P 1","2","","tetra-μ~3~-tert-butoxy-tetra-μ~4~-tert-butoxy-tetralithiumtetrasodium","","- C32 H72 Li4 Na4 O8 -","- C32 H72 Li4 Na4 O8 -","- C192 H432 Li24 Na24 O48 -","6","3","BT6229","Clegg, William; Drummond, Allison M.; Liddle, Stephen T.; Mulvey, Robert E.","A triclinic polymorph of octa-<i>tert</i>-butoxytetralithiumtetrasodium","Acta Crystallographica Section E","2003","59","2","m64","m66","10.1107/S1600536803001193","","","0.71073","MoKα","","0.0596","0.0364","","","0.0889","0.0944","","","","","","0.92","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201792","6.494","0.003","23.899","0.012","8.783","0.004","90","","92.48","0.04","90","","1361.8","1.1","178","2","178","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","[2.2](2,7)Oxepinoparacyclophane-4,5-dicarbonitrile","","- C18 H14 N2 O -","- C18 H14 N2 O -","- C72 H56 N8 O4 -","4","1","BT6230","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Witulski, Bernhard","[2.2](2,7)Oxepinoparacyclophane-4,5-dicarbonitrile","Acta Crystallographica Section E","2003","59","2","o218","o219","10.1107/S1600536803001338","","","0.71073","MoKα","","0.1419","0.0682","","","0.1679","0.2191","","","","","","0.925","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201793","15.834","0.005","8.196","0.003","22.849","0.007","90","","99.11","0.03","90","","2927.8","1.7","178","2","178","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","2,3:9,10-Dibenzotricyclo[5.3.0.0^4,8^]deca-2,5,9-triene-6,7-dicarbonitrile","","- C20 H12 N2 -","- C20 H12 N2 -","- C160 H96 N16 -","8","1","BT6231","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Witulski, Bernhard","2,3:9,10-Dibenzotricyclo[5.3.0.0^4,8^]deca-2,5,9-triene-6,7-dicarbonitrile","Acta Crystallographica Section E","2003","59","2","o220","o221","10.1107/S160053680300134X","","","0.71073","MoKα","","0.0577","0.0381","","","0.0862","0.0993","","","","","","1.046","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201794","7.4014","0.0009","8.0163","0.0006","8.2906","0.0012","89.413","0.009","77.541","0.009","74.655","0.008","462.62","0.1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","chloro(triethanolaminato)zinc(II)","","- C6 H14 Cl N O3 Zn -","- C6 H14 Cl N O3 Zn -","- C12 H28 Cl2 N2 O6 Zn2 -","2","1","BT6232","Lutz, Martin; Bakker, Ruud","Redetermination of chloro(triethanolaminato)zinc(II) at 150K","Acta Crystallographica Section E","2003","59","2","m74","m76","10.1107/S1600536803001533","","","0.71073","MoKα","","0.025","0.0211","","","0.0515","0.0534","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201795","8.647","0.002","13.604","0.004","28.959","0.008","90","","92.41","0.02","90","","3403.5","1.6","178","2","178","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Bis(η^5^-pentamethylcyclopentadienyl)[bis-η^5^-syn- [2.2](4,7)indenophanyl]diruthenium(II)","","- C42 H48 Ru2 -","- C42 H48 Ru2 -","- C168 H192 Ru8 -","4","1","BT6233","Jones, Peter G.; Hopf, Henning; Hartig, Thorsten; Döring, Detlev","Bis(η^5^-pentamethylcyclopentadienyl)[bis-η^5^-<i>syn</i>-[2.2](4,7)indenophanyl]diruthenium(II)","Acta Crystallographica Section E","2003","59","2","m85","m86","10.1107/S1600536803001673","","","0.71073","MoKα","","0.0365","0.0283","","","0.0672","0.0712","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201796","10.584","0.003","11.437","0.003","13.51","0.003","84.45","0.02","71.11","0.02","72.96","0.02","1479.4","0.7","160","2","160","2","","","","","","","","3","P -1","-P 1","2","","1,2-Bis[bis(4-methoxyphenyl)hydroxymethyl]benzene","","- C36 H34 O6 -","- C36 H34 O6 -","- C72 H68 O12 -","2","1","BT6234","Carey, Kieran A.; Clegg, William; Elsegood, Mark R. J.; Golding, Bernard T.; Maskill, Howard","1,2-Bis[bis(4-methoxyphenyl)hydroxymethyl]benzene","Acta Crystallographica Section E","2003","59","3","o263","o265","10.1107/S1600536803002514","","","1.54184","CuKα","","0.0857","0.0525","","","0.1118","0.1322","","","","","","1.044","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201797","7.486","0.002","8.918","0.002","9.24","0.002","76.26","0.03","87.15","0.03","75.08","0.03","579","0.3","293","2","90","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C8 H15 N3 O3 S -","- C8 H15 N3 O3 S -","- C16 H30 N6 O6 S2 -","2","1","BT6236","Zarychta, Bartosz; Spaleniak, Grzegorz; Zaleski, Jacek","2-Amino-5-butyl-4-methyl-1,3-thiazol-3-ium nitrate","Acta Crystallographica Section E","2003","59","3","o304","o305","10.1107/S1600536803003027","","","0.71073","MoKα","","0.0611","0.0465","","","0.12","0.1307","","","","","","0.982","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201798","7.2093","0.0015","6.9259","0.001","8.7689","0.0015","90","","90","","90","","437.84","0.13","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","holmium chloride oxo-selenate(IV)","","","- Cl Ho O3 Se -","- Cl Ho O3 Se -","- Cl4 Ho4 O12 Se4 -","4","0.5","BT6237","Wickleder, Mathias S.","Holmium chloride oxoselenate(IV), HoClSeO~3~","Acta Crystallographica Section E","2003","59","3","i31","i32","10.1107/S1600536803003301","","","0.71073","MoKα","","0.0267","0.0229","","","0.0519","0.0529","","","","","","1.041","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2201799","10.268","0.003","8.401","0.003","21.281","0.007","90","","96.45","0.03","90","","1824.1","1","178","2","178","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4,4-Dimethyl-2,6-diphenyl-2-(2-methyl-1-propenyl)-tetrahydropyrimidine","","- C22 H26 N2 -","- C22 H26 N2 -","- C88 H104 N8 -","4","1","BT6238","Jones, Peter G.; Hopf, Henning; Lautenbach, Holger W.","4,4-Dimethyl-2-(2-methyl-1-propenyl)-2,6-diphenyl-2,3,4,5-tetrahydropyrimidine","Acta Crystallographica Section E","2003","59","3","o324","o325","10.1107/S1600536803003209","","","0.71073","MoKα","","0.0728","0.0411","","","0.0991","0.1178","","","","","","1.007","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201800","19.909","0.003","9.041","0.001","20.015","0.003","90","","106.928","0.017","90","","3446.5","0.9","293","2","293","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","Bis[tris(1,2-ethanediamine-κ^2^N,N')manganese] pentaselenodiantimonate(III)","","- C12 H48 Mn2 N12 Sb2 Se5 -","- C12 H48 Mn2 N12 Sb2 Se5 -","- C48 H192 Mn8 N48 Sb8 Se20 -","4","1","BT6239","Näther, Christian; Wendland, Frank; Bensch, Wolfgang","Twinned bis[tris(1,2-ethanediamine-κ^2^<i>N,N</i>')manganese(II)] pentaselenodiantimonate(III)","Acta Crystallographica Section E","2003","59","3","m119","m121","10.1107/S1600536803003386","","","0.71073","MoKα","","0.0344","0.0296","","","0.073","0.0753","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201801","8.5554","0.0012","10.1468","0.0018","10.7086","0.0016","71.729","0.01","87.445","0.01","81.861","0.01","873.9","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Ethyl (Z)-3-bromo-2-[(tert-butoxycarbonyl)amino]-3-phenylacrylate","","- C16 H20 Br N O4 -","- C16 H20 Br N O4 -","- C32 H40 Br2 N2 O8 -","2","1","BT6240","Jones, Peter G.; Jäger, Stefan","Ethyl (<i>Z</i>)-3-bromo-2-[(<i>tert</i>-butoxycarbonyl)amino]-3-phenylacrylate","Acta Crystallographica Section E","2003","59","3","o369","o371","10.1107/S160053680300357X","","","0.71073","MoKα","","0.0681","0.0341","","","0.0457","0.05","","","","","","0.792","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201802","14.1961","0.0019","14.1961","0.0019","15.869","0.002","90","","90","","90","","3198.1","0.7","160","2","160","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Tetrakis(μ~3~-phenoxo-acetonitrilelithium)","","- C32 H32 Li4 N4 O4 -","- C32 H32 Li4 N4 O4 -","- C128 H128 Li16 N16 O16 -","4","0.25","BT6241","Tombul, Mustafa; Errington, R. John; Coxall, Robert A.; Clegg, William","Tetrakis(μ~3~-phenoxo-acetonitrilelithium), a tetrameric lithium aryloxide with a cubane core","Acta Crystallographica Section E","2003","59","3","m137","m139","10.1107/S1600536803004318","","","0.71073","MoKα","","0.0513","0.0416","","","0.0958","0.1017","","","","","","1.113","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201803","17.496","0.005","18.59","0.002","8.074","0.007","90","","90","","90","","2626","2","173","1","173","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(-)-(P)-N,N'-bis[(5-bromo-2-hydroxyphenyl)methylidene]- 6,6'-dimethyl-1,1'-biphenyl-2,2'-dimethanamine","","- C30 H26 Br2 N2 O2 -","- C30 H26 Br2 N2 O2 -","- C120 H104 Br8 N8 O8 -","4","1","BT6242","Linden, Anthony; Rippert, Andreas J.","({-})-(<i>P</i>)-<i>N,N</i>'-Bis[(5-bromo-2-hydroxyphenyl)methylidene]-6,6'-dimethyl-1,1'-biphenyl-2,2'-dimethanamine","Acta Crystallographica Section E","2003","59","4","o390","o392","10.1107/S1600536803004343","","","0.71073","MoKα","","0.1414","0.0482","","","0.0876","0.1055","","","","","","0.982","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2201804","22.5838","0.0005","3.7273","0.0001","13.2912","0.0005","90","","90","","90","","1118.81","0.06","140","2","140","2","","","","","","","","4","P c a 21","P 2c -2ac","29","Quinolinium Fumarate","Quinolinium Fumarate","","- C13 H11 N O4 -","- C13 H11 N O4 -","- C52 H44 N4 O16 -","4","1","BT6244","Shan, Ning; Batchelor, Elaine; Jones, William","Quinolinium fumarate","Acta Crystallographica Section E","2003","59","4","o397","o398","10.1107/S1600536803004446","","","0.71073","MoKα","","0.0392","0.0341","","","0.0822","0.0851","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201805","7.4869","0.0007","10.3156","0.0018","10.6773","0.0018","83.634","0.0014","69.484","0.0011","85.083","0.0011","766.6","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","18-crown-6-potassium hydrogen bis(2,4-dinitrophenolate)","1,4,7,10,13,16-Hexaoxacyclooctadecane-potassium hydrogen bis(2,4-dinitrophenolate)","","- C24 H31 K N4 O16 -","- C24 H31 K N4 O16 -","- C24 H31 K N4 O16 -","1","0.5","BT6245","Barnes, John C.; Weakley, Timothy J.R.","(18-Crown-6-κ^6^<i>O</i>)potassium 2,4-dinitrophenolate 2,4-dinitrophenol","Acta Crystallographica Section E","2003","59","4","m160","m161","10.1107/S1600536803005105","","","0.71073","MoKα","","0.0944","0.0401","","","0.0916","0.1071","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201806","12.1097","0.0015","24.311","0.003","9.209","0.0015","90","","90","","90","","2711.1","0.6","173","2","173","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","5,11,17,23-Tetrakis(diphenylphosphinoyl)-25,26,27,28-tetrapropoxycalix[4]arene","","- C64 H66 O6 P2 -","- C64 H66 O6 P2 -","- C128 H132 O12 P4 -","2","0.5","BT6246","Jeunesse, Cathérine; Matt, Dominique; Jones, Peter G.; Thönnessen, Holger","5,17-Bis(diphenylphosphinoyl)-25,26,27,28-tetrapropoxycalix[4]arene","Acta Crystallographica Section E","2003","59","4","o428","o429","10.1107/S160053680300494X","","","0.71073","MoKα","","0.04","0.034","","","0.0831","0.0851","","","","","","0.999","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201807","9.528","0.004","12.401","0.006","12.265","0.006","90","","97.73","0.04","90","","1436","1.2","178","2","178","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(3,4),(6,7)Dibenzo-9,10-dicyanotriquinacene","","- C20 H12 N2 -","- C20 H12 N2 -","- C80 H48 N8 -","4","1","BT6247","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Witulski, Bernhard","(3,4),(6,7)Dibenzo-9,10-dicyanotriquinacene","Acta Crystallographica Section E","2003","59","4","o522","o523","10.1107/S1600536803005221","","","0.71073","MoKα","","0.1468","0.0648","","","0.1591","0.2165","","","","","","1.043","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201808","9.3133","0.0003","15.4441","0.0004","9.8424","0.0003","90","","90","","90","","1415.69","0.07","120","2","","","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C14 H22 O6 -","- C14 H22 O6 -","- C56 H88 O24 -","4","1","BT6248","Coles, Simon J.; Hursthouse, Michael B.","Ethyl (2<i>S</i>*)-2-[(2<i>R</i>*,2'<i>R</i>*,5<i>S</i>*)-2',5-dimethyl-5'-oxoperhydro-[2,2']]bifuranyl-5-yl]-2-hydroxyethanoate","Acta Crystallographica Section E","2003","59","4","o501","o502","10.1107/S1600536803005762","","","0.71073","MoKα","","0.0363","0.0298","","","0.0717","0.0748","","","","","","1.078","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201809","9.5937","0.0019","15.193","0.003","10.819","0.002","90","","90","","90","","1576.9","0.5","293","2","293","2","","","","","","","","6","C c c m","-C 2 2c","66","","Bis(diethylenetriamine-κ^3^N)nickel hexafluorogermanate","","- C8 H26 F6 Ge N6 Ni -","- C8 H26 F6 Ge N6 Ni -","- C32 H104 F24 Ge4 N24 Ni4 -","4","0.25","BT6249","Hong-Xia Zhang; Guo-Yu Yang; Yan-Qiong Sun","Bis(diethylenetriamine-κ^3^<i>N</i>)nickel hexafluorogermanate","Acta Crystallographica Section E","2003","59","4","m185","m187","10.1107/S1600536803006160","","","0.71073","MoKα","","0.0537","0.039","","","0.1079","0.1186","","","","","","1.158","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201810","19.945","0.002","14.069","0.002","20.762","0.003","90","","106.209","0.006","90","","5594.4","1.3","133","2","133","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(triphenylphosphine)iminium μ-acetato-di-μ-acetylacetonato-bis[acetylacetonatomagnesate(II)] monohydrate","","- C58 H63 Mg2 N O11 P2 -","- C58 H63 Mg2 N O11 P2 -","- C232 H252 Mg8 N4 O44 P8 -","4","1","BT6250","Jones, Peter G.; Álvarez-Falcón, Miguel M.","Bis(triphenylphosphine)iminium μ-acetato-di-μ-acetylacetonato-bis[acetylacetonatomagnesate(II)] monohydrate","Acta Crystallographica Section E","2003","59","4","m192","m194","10.1107/S1600536803005713","","","0.71073","MoKα","","0.0906","0.0447","","","0.0935","0.1052","","","","","","0.917","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201811","12.706","0.002","9.2379","0.0016","13.05","0.002","90","","103.849","0.012","90","","1487.2","0.4","143","2","143","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","rac-Bis[μ-(1R,2S,12R,13s,15s,17S,18r)-14,16,19-trioxa- 3,7,11-triazatetracyclo[13.3.1.0^2,13^.0^12,17^]nonadecan-18-olato- 1κ^3^N^3^,N^7^,N^11^:2κ^2^O^18^]dizinc(II) dichloride","","- C26 H44 Cl2 N6 O8 Zn2 -","- C26 H44 Cl2 N6 O8 Zn2 -","- C52 H88 Cl4 N12 O16 Zn4 -","2","0.5","BT6251","Jones, Peter G.; Kirby, Anthony J.; Beckmann, Claus","A cationic zinc(II) complex of a new ligand based on <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylstreptamine 2,4,6-orthoformate as the chloride salt","Acta Crystallographica Section E","2003","59","4","m168","m170","10.1107/S1600536803005889","","","0.71073","MoKα","","0.0309","0.0272","","","0.0655","0.068","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201812","9.5416","0.0015","17.491","0.002","14.098","0.003","90","","104.366","0.01","90","","2279.3","0.7","143","2","143","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","rac-Bis[μ-(1R,2S,12R,13S,15S,17S,18R)-14,16,19-trioxa-3,7,11- triazatetracyclo[13.3.1.0^2,13^.0^12,17^]nonadecan-18-olato- 1κ^3^N^3^,N^7^,N^11^:2κ^2^O^18^]dizinc(II) bis[trichloro(pyridine)zincate(II)]","","- C36 H54 Cl6 N8 O8 Zn4 -","- C36 H54 Cl6 N8 O8 Zn4 -","- C72 H108 Cl12 N16 O16 Zn8 -","2","0.5","BT6252","Jones, Peter G.; Dix, Ina; Kirby, Anthony J.; Beckmann, Claus","A cationic zinc(II) complex of a new ligand based on <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylstreptamine 2,4,6-orthoformate as the trichloro(pyridine)zincate(II) salt","Acta Crystallographica Section E","2003","59","4","m171","m173","10.1107/S1600536803005890","","","0.71073","MoKα","","0.0391","0.0293","","","0.0642","0.0685","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201813","6.9344","0.0008","7.5439","0.001","12.165","0.0016","100.386","0.01","104.367","0.008","105.528","0.006","572.85","0.13","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","rac-(1s,3s,5R,6r,7S,8R,9S)-8,9-bis(dimethylamino)- 2,4,10-trioxatricyclo[3.3.1.1^3,7^]decan-6-ol","","- C11 H20 N2 O4 -","- C11 H20 N2 O4 -","- C22 H40 N4 O8 -","2","1","BT6253","Beckmann, Claus; Jones, Peter G.; Kirby, Anthony J.","<i>N,N,N</i>',<i>N</i>'-Tetramethylstreptamine 2,4,6-orthoformate","Acta Crystallographica Section E","2003","59","4","o564","o565","10.1107/S1600536803006275","","","0.71073","MoKα","","0.0514","0.0363","","","0.0962","0.1011","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201814","9.804","0.002","9.73","0.002","13.896","0.003","90","","100.82","0.02","90","","1302","0.5","143","2","143","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H21 Cl N2 O4 -","- C11 H21 Cl N2 O4 -","- C44 H84 Cl4 N8 O16 -","4","1","BT6254","Beckmann, Claus; Jones, Peter G.; Kirby, Anthony J.","<i>N,N,N</i>',<i>N</i>'-Tetramethylstreptamine 2,4,6-orthoformate hydrochloride","Acta Crystallographica Section E","2003","59","4","o566","o568","10.1107/S1600536803006287","","","0.71073","MoKα","","0.0783","0.0504","","","0.1164","0.135","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201815","8.936","0.003","10.762","0.002","19.74","0.003","80.63","0.01","88.39","0.02","84.11","0.02","1863","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis[N-n-butyl-N-(3,5-di-tert-butyl-2-hydroxybenzyl)dithiocarbamato- κ^2^S,S']zinc(II)","","- C34 H52 N2 O2 S4 Zn -","- C34 H52 N2 O2 S4 Zn -","- C68 H104 N4 O4 S8 Zn2 -","2","1","BT6255","Reck, Günter; Becker, Roland","Bis[<i>N</i>-<i>n</i>-butyl-<i>N</i>-(3,5-di-<i>tert</i>-butyl-2-hydroxybenzyl)dithiocarbamato-κ^2^<i>S,S</i>']zinc(II)","Acta Crystallographica Section E","2003","59","5","m234","m235","10.1107/S1600536803007372","","","0.71073","MoKα","","0.0425","0.0377","","","0.0968","0.1011","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201816","8.7578","0.0007","13.9951","0.001","20.7692","0.0016","90","","93.604","0.001","90","","2540.6","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(cyclooctatetraenyl)thulium lithium tris(tetrahydrofuran)","","- C28 H40 Li O3 Tm -","- C28 H40 Li O3 Tm -","- C112 H160 Li4 O12 Tm4 -","4","1","BT6256","Rabe, Gerd W.; Zhang-Preße, Mei; Golen, James A.; Rheingold, Arnold L.","Bis(cyclooctatetraenyl)thulium lithium tris(tetrahydrofuran)","Acta Crystallographica Section E","2003","59","5","m255","m256","10.1107/S1600536803007591","","","0.71073","MoKα","","0.0353","0.031","","","0.0741","0.0764","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201817","15.7741","0.001","15.7741","0.001","49.394","0.005","90","","90","","120","","10643.7","1.4","160","2","160","2","","","","","","","","4","P 32","P 32","145","","(trans-Cinnamaldehyde)tris(2,6-diphenylphenoxy)aluminium","","- C63 H47 Al O4 -","- C63 H47 Al O4 -","- C567 H423 Al9 O36 -","9","3","BT6257","Clegg, William; Elsegood, Mark R. J.; Snaith, Ronald; Deceased; Wheatley, Andrew E. H.","(<i>trans</i>-Cinnamaldehyde)tris(2,6-diphenylphenoxy)aluminium","Acta Crystallographica Section E","2003","59","5","m225","m227","10.1107/S1600536803007141","","","1.54184","CuKα","","0.1098","0.0682","","","0.1831","0.2283","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201818","9.2497","0.0003","12.3549","0.0003","17.4418","0.0006","90","","102.209","0.012","90","","1948.15","0.14","150","1","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C12 H36 Cl12 N4 P2 Si4 Ta2 -","- C12 H36 Cl12 N4 P2 Si4 Ta2 -","- C24 H72 Cl24 N8 P4 Si8 Ta4 -","2","0.5","BT6258","Rivard, Eric; Lough, Alan J.; Manners, Ian","Di-μ-chloro-bis({[bis(trimethylsilyl)amino]dichlorophosphoraniminato}trichlorotantalum(V))","Acta Crystallographica Section E","2003","59","5","m239","m240","10.1107/S1600536803007256","","","0.71073","MoKα","","0.0455","0.0355","","","0.0838","0.0884","","","","","","1.034","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201819","11.681","","15.77","","18.288","","114.33","","104.18","","90.18","","2955.38","","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H72 Hg4 I10 N2 -","- C32 H72 Hg4 I10 N2 -","- C64 H144 Hg8 I20 N4 -","2","1","BT6259","Nockemann, Peter; Meyer, Gerd","Bis(tetrabutylammonium) decaiodotetramercurate(II), (Bu~4~N)~2~[Hg~4~I~10~]","Acta Crystallographica Section E","2003","59","5","m236","m238","10.1107/S1600536803007335","","","0.71073","MoKα","","0.096","0.0383","","","0.0522","0.0601","","","","","","0.746","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2201820","12.316","0.002","12.986","0.002","4.8795","0.0006","90","","96.406","0.012","90","","775.5","0.2","295","","295","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Methyl 2,5-dihydroxybenzoate","","- C8 H8 O4 -","- C8 H8 O4 -","- C32 H32 O16 -","4","1","BT6260","Christopher L. Brown; Joel F. Heagney; David J. Young; Peter C. Healy","Methyl 2,5-dihydroxybenzoate","Acta Crystallographica Section E","2003","59","5","o630","o631","10.1107/S1600536803007347","","","0.71069","MoKα","","0.0614","0.0443","","","0.1261","0.1395","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201821","11.1679","0.0012","5.7966","0.0006","19.821","0.002","90","","103.132","0.004","90","","1249.6","0.2","133","2","133","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Tribromoacetic acid","","- C2 H Br3 O2 -","- C2 H Br3 O2 -","- C16 H8 Br24 O16 -","8","1","BT6261","Jones, Peter G.; Lozano, Virginia","Tribromoacetic acid","Acta Crystallographica Section E","2003","59","5","o619","o621","10.1107/S1600536803007268","","","0.71073","MoKα","","0.0272","0.0224","","","0.0518","0.0527","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201822","11.9789","0.0012","11.9076","0.0012","9.1495","0.0011","90","","92.128","0.003","90","","1304.2","0.2","133","2","133","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(o-nitrophenyl) carbonate","","- C13 H8 N2 O7 -","- C13 H8 N2 O7 -","- C52 H32 N8 O28 -","4","1","BT6262","Simon, Monika; Csunderlik, Carol; Jones, Peter G.; Neda, Ion; Fischer, Axel K.","A second polymorph of bis(<i>o</i>-nitrophenyl) carbonate","Acta Crystallographica Section E","2003","59","5","o688","o690","10.1107/S1600536803007487","","","0.71073","MoKα","","0.046","0.0343","","","0.0906","0.097","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201823","21.074","0.002","8.4949","0.0008","25.828","0.002","90","","111.618","0.005","90","","4298.5","0.7","133","2","133","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(p-nitrophenyl) carbonate benzene solvate (3:1)","","- C15 H10 N2 O7 -","- C15 H10 N2 O7 -","- C180 H120 N24 O84 -","12","3","BT6263","Simon, Monika; Csunderlik, Carol; Jones, Peter G.; Neda, Ion; Fischer, Axel K.","Bis(<i>p</i>-nitrophenyl) carbonate‒benzene (3/1)","Acta Crystallographica Section E","2003","59","5","o691","o692","10.1107/S1600536803007499","","","0.71073","MoKα","","0.0706","0.0338","","","0.0685","0.079","","","","","","0.915","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201824","9.2732","0.0012","19.963","0.003","10.2565","0.0013","90","","109.021","0.002","90","","1795","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[[tetraaqualanthanum(III)]-di-μ~2~-isoniconitinato-κ^2^O:O'] nitrate]","","- C12 H16 La N3 O11 -","- C12 H8 La N3 O11 -","- C48 H32 La4 N12 O44 -","4","0.5","BT6264","Li-Zhen Cai; Ming-Sheng Wang; Guo-Wei Zhou; Guo-Cong Guo; Jiang-Gao Mao; Jin-Shun Huang","<i>catena</i>-Poly[[[tetraaqualanthanum(III)]-di-μ-isoniconitinato-κ^2^<i>O</i>:<i>O</i>'] nitrate]","Acta Crystallographica Section E","2003","59","5","m249","m251","10.1107/S1600536803007918","","","0.71073","MoKα","","0.0513","0.0419","","","0.1028","0.1107","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201825","8.8977","0.0014","19.524","0.003","21.445","0.003","90","","90","","90","","3725.4","1","153","2","153","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","4,12,20-trihydroxy-3,5,8,11,13,16,19,21,24-nonamethyl-1,9,17- trioxacyclotetracosane-2,10,18-trione‒methanol‒water (1/2/1)","","- C32 H64 O12 -","- C32 H64 O12 -","- C128 H256 O48 -","4","1","BT6265","Flörke, Ulrich; Suwarso, Wahyudi Priyono; Gani, Ratna Layla; Krohn, Karsten; Wang, Xi","Dasypogalactone‒methanol‒water (1/2/1)","Acta Crystallographica Section E","2003","59","5","o638","o640","10.1107/S1600536803008055","","","0.71073","MoKα","","0.2175","0.0504","","","0.0646","0.0846","","","","","","0.863","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2201826","11.627","0.0008","6.8372","0.0004","10.4344","0.0006","90","","94.574","0.004","90","","826.85","0.09","133","2","133","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","3,5-Dibromopyridinium bromide","","- C5 H4 Br3 N -","- C5 H4 Br3 N -","- C20 H16 Br12 N4 -","4","0.5","BT6266","Jones, Peter G.; Lozano, Virginia","A second polymorph of 3,5-dibromopyridinium bromide","Acta Crystallographica Section E","2003","59","5","o632","o634","10.1107/S1600536803007773","","","0.71073","MoKα","","0.0238","0.0204","","","0.0512","0.0522","","","","","","1.057","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201827","13.239","0.002","14.629","0.002","10.3595","0.0012","90","","90","","90","","2006.4","0.5","133","2","133","2","","","","","","","","4","F d d 2","F 2 -2d","43","","N,N'-Disuccinimidyl carbonate","","- C9 H8 N2 O7 -","- C9 H8 N2 O7 -","- C72 H64 N16 O56 -","8","0.5","BT6267","Simon, Monika; Csunderlik, Carol; Jones, Peter G.; Neda, Ion; Tarta-Micle, Andreea","<i>N,N</i>'-Disuccinimidyl carbonate","Acta Crystallographica Section E","2003","59","5","o683","o685","10.1107/S1600536803007803","","","0.71073","MoKα","","0.0298","0.0274","","","0.0712","0.073","","","","","","1.064","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201828","7.2372","0.0011","13.396","0.002","9.5519","0.0012","90","","90.01","0.02","90","","926.1","0.2","133","2","133","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Carbonyldisuccinimide","","- C9 H8 N2 O5 -","- C9 H8 N2 O5 -","- C36 H32 N8 O20 -","4","1","BT6268","Simon, Monika; Csunderlik, Carol; Jones, Peter G.; Neda, Ion; Tarta-Micle, Andreea","<i>N,N</i>'-Carbonyldisuccinimide","Acta Crystallographica Section E","2003","59","5","o686","o687","10.1107/S1600536803007815","","","0.71073","MoKα","","0.0373","0.0338","","","0.0886","0.0905","","","","","","1.056","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201829","16.931","0.003","6.174","0.002","17.028","0.005","90","","94","0.02","90","","1775.6","0.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","E-azulenecarboxaldehyde oxime","","- C11 H9 N O -","- C11 H9 N O -","- C88 H72 N8 O8 -","8","1","BT6270","Kedziorek Mariusz; Hafner, Klaus; Lindner, Hans J.","(<i>E</i>)-Azulene-1-carboxaldehyde oxime","Acta Crystallographica Section E","2003","59","6","o860","o861","10.1107/S1600536803008158","","","0.71073","MoKα","","0.1667","0.0517","","","0.1052","0.1488","","","","","","0.98","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201830","15.988","0.001","19.115","0.001","23.875","0.001","90","","107.279","0.001","90","","6967.2","0.6","168","2","168","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Bis[1,2-bis(diphenylphosphino)ethane]silver(I) bis(trifluoroacetato)triphenylstannate(IV)","","- C74 H63 Ag F6 O4 P4 Sn -","- C74 H63 Ag F6 O4 P4 Sn -","- C296 H252 Ag4 F24 O16 P16 Sn4 -","4","1","BT6271","Chee, Chin Fei; Lo, Kong Mun; Ng, Seik Weng","Bis[1,2-bis(diphenylphosphino)ethane]silver(I) bis(trifluoroacetato)triphenylstannate(IV)","Acta Crystallographica Section E","2003","59","5","m273","m275","10.1107/S1600536803008651","","","0.71073","MoKα","","0.072","0.042","","","0.102","0.122","","","","","","1.06","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2201831","7.7499","0.0015","9.7054","0.0019","10.908","0.002","89.22","0.03","75.27","0.03","67.4","0.03","729.3","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis[2,2'-(2-aminoethylimino)di(ethylammonium)] hexasulfidoditin dihydrate","","- C12 H44 N8 O2 S6 Sn2 -","- C12 H44 N8 O2 S6 Sn2 -","- C12 H44 N8 O2 S6 Sn2 -","1","0.5","BT6272","Näther, Christian; Scherb, Sandra; Bensch, Wolfgang","Bis[2,2'-(2-aminoethylimino)di(ethylammonium)] hexasulfidodistannate(IV) dihydrate","Acta Crystallographica Section E","2003","59","5","m280","m282","10.1107/S160053680300878X","","","0.71073","MoKα","","0.0202","0.0194","","","0.0542","0.0544","","","","","","1.353","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201832","21.208","0.004","11.678","0.002","13.974","0.003","90","","90","","90","","3460.9","1.2","200","2","200","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","Dicyclohexylammonium benzenethiolate","","- C18 H29 N S -","- C18 H29 N S -","- C144 H232 N8 S8 -","8","2","BT6273","Katarzyna Baranowska; Jaroslaw Chojnacki; Barbara Becker; Wieslaw Wojnowski","Dicyclohexylammonium benzenethiolate","Acta Crystallographica Section E","2003","59","6","o765","o766","10.1107/S1600536803009255","","","0.71073","MoKα","","0.1319","0.039","","","0.0976","0.1439","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201833","26.219","0.006","7.4283","0.001","7.3914","0.001","90","","90","","90","","1439.6","0.4","295","","297","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Cs3 O14 Ta5 -","- Cs3 O14 Ta5 -","- Cs12 O56 Ta20 -","4","0.5","BT6274","Douglas du Boulay; Atsuko Oono; Nobuo Ishizawa","A reinvestigation of the structure of Cs~3~Ta~5~O~14~","Acta Crystallographica Section E","2003","59","6","i86","i88","10.1107/S1600536803010122","","","0.71073","MoKα","","0.044","0.044","","0.032","","0.032","","","0.909","","","0.909","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2201834","8.9286","0.0017","11.347","0.0011","8.925","0.002","90","","103.311","0.016","90","","879.9","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H22 O2 -","- C22 H22 O2 -","- C44 H44 O4 -","2","0.5","BT6276","Vande Velde, Christophe M.L.; Baeke, Jan K.; Geise, Herman J.; Blockhuys, Frank","1,4-Bis(2-phenylethoxy)benzene","Acta Crystallographica Section E","2003","59","6","o823","o824","10.1107/S1600536803009966","","","0.71073","MoKα","","0.1491","0.0449","","","0.1052","0.1312","","","","","","0.992","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201835","11.0612","0.001","19.18","0.002","27.641","0.004","90","","94.895","0.007","90","","5842.8","1.2","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Tris(nitrato-κ^2^O,O')tris(triphenylphosphine oxide-κO)terbium(III) acetone solvate","","- C58.5 H54 N3 O13.5 P3 Tb -","- C58.5 H54 N3 O13.5 P3 Tb -","- C234 H216 N12 O54 P12 Tb4 -","4","1","BT6278","Matthews, Melissa L.; Webster, Michael","Tris(nitrato-κ^2^<i>O</i>,<i>O</i>')tris(triphenylphosphine oxide-κ<i>O</i>)terbium(III) acetone sesquisolvate","Acta Crystallographica Section E","2003","59","6","m322","m323","10.1107/S160053680300967X","","","0.71073","MoKα","","0.0976","0.0536","","","0.1167","0.1354","","","","","","1.027","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201836","6.1998","0.0007","8.0292","0.0007","10.565","0.001","90","","95.942","0.004","90","","523.09","0.09","187","2","187","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H14 O2 S2 -","- C8 H14 O2 S2 -","- C16 H28 O4 S4 -","2","0.5","BT6279","Fleischer, Holger; Schollmeyer, Dieter","Butanedithiol diacetate","Acta Crystallographica Section E","2003","59","6","o845","o847","10.1107/S1600536803010523","","","1.54178","CuKα","","0.0603","0.0482","","","0.1266","0.1344","","","","","","1.118","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201837","9.4773","0.0019","19.579","0.004","12.592","0.003","90","","91.56","0.03","90","","2335.7","0.9","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C18 H64 Mn2 N12 O2 S8 Sb4 -","- C18 H64 Mn2 N12 O2 S8 Sb4 -","- C36 H128 Mn4 N24 O4 S16 Sb8 -","2","0.5","BT6281","Engelke, Lars; Bensch, Wolfgang","Bis[tris(1,3-diaminopropane)manganese(II)] octasulfidotetraantimonate(III) dihydrate","Acta Crystallographica Section E","2003","59","6","m378","m380","10.1107/S1600536803011036","","","0.71073","MoKα","","0.0371","0.0321","","","0.0899","0.0918","","","","","","1.182","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201838","10.2843","0.0002","12.1135","0.0002","14.5033","0.0002","82.915","0.001","80.656","0.001","87.563","0.001","1768.75","0.05","170","2","170","2","","","","","","","","3","P -1","-P 1","2","","9-(para-tert-Butylphenyl)-9-fluorenol","","- C23 H22 O -","- C23 H22 O -","- C92 H88 O4 -","4","2","BT6282","McLean, Aaron W.; Meyers, Cal Y.; Robinson, Paul D.","9-(<i>para</i>-<i>tert</i>-Butylphenyl)-9-fluorenol","Acta Crystallographica Section E","2003","59","6","o891","o893","10.1107/S1600536803011255","","","0.71069","MoKα","","0.079","0.046","","","0.116","0.128","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201839","7.7316","0.0006","9.3716","0.0008","17.7245","0.0014","90","","93.835","0.003","90","","1281.4","0.18","133","2","133","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,6,7-Tris(bromomethyl)naphthalene","","- C13 H11 Br3 -","- C13 H11 Br3 -","- C52 H44 Br12 -","4","1","BT6285","Kuś, Piotr; Jones, Peter G.","1,6,7-Tris(bromomethyl)naphthalene","Acta Crystallographica Section E","2003","59","6","o899","o900","10.1107/S160053680301136X","","","0.71073","MoKα","","0.052","0.0373","","","0.0893","0.094","","","","","","0.972","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201840","22.053","0.004","10.009","0.002","13.241","0.003","90","","100.76","0.003","90","","2871.3","1","120","2","120","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","Nickel-ferron complex","","","- C18 H28 I2 N2 Ni2 O18 S2 -","- C18 H28 I2 N2 Ni2 O18 S2 -","- C72 H112 I8 N8 Ni8 O72 S8 -","4","0.5","CF6220","Savarimuthu Baskar Raj; Packianathan Thomas Muthiah; Urszula Rychlewska; Beata Warżajtis; Gabriele Bocelli; Rita Oĺla","The interplay of coordination, π‒π stacking and hydrogen bonding in the supramolecular self-assembly of bis(μ-7-iodo-8-hydroxyquinoline-5-sulfonato-κ^3^<i>N,O</i>:<i>O</i>')bis[triaquanickel(II)] tetrahydrate","Acta Crystallographica Section E","2003","59","1","m46","m49","10.1107/S160053680202281X","","","0.71073","MoKα","","0.0292","0.0263","","","0.0911","0.095","","","","","","0.825","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201841","32.074","0.006","5.931","0.001","8.127","0.002","90","","101.18","0.03","90","","1516.7","0.6","293","2","293","2","","","","","","","","3","C 1 c 1","C -2yc","9","2-naphthol","","","- C10 H8 O -","- C10 H8 O -","- C80 H64 O8 -","8","2","CF6223","Marciniak, Bernard; Rozycka-Sokolowska, Ewa; Pavlyuk, Volodymyr","2-Naphthalenol","Acta Crystallographica Section E","2003","59","1","o52","o53","10.1107/S1600536802022808","","","0.71069","MoKα","","0.0555","0.0449","","","0.0904","0.0934","","","","","","1.303","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201842","10.156","0.009","10.59","0.009","19.277","0.017","79.683","0.016","75.336","0.016","83.579","0.016","1968","3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Nitratotris(2,2,6,6-tetramethyl-3,5-heptadionato)hafnium(IV)","","- C33 H57 Hf N O9 -","- C33 H57 Hf N O9 -","- C66 H114 Hf2 N2 O18 -","2","1","CF6224","Urs, Usha K.; Dharmaprakash, M. S.; Shivashankar, S. A.; Guru Row, T. N.","Nitratotris(2,2,6,6-tetramethyl-3,5-heptadionato)hafnium(IV)","Acta Crystallographica Section E","2003","59","1","m1","m2","10.1107/S160053680202202X","","","0.71073","MoKα","","","0.0607","","","","0.1373","","","","","","0.918","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201843","10.543","0.003","10.614","0.004","14.57","0.003","90","","93.68","0.02","90","","1627.1","0.8","295","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(5S*,6R*,7R*,9R*)-1-Benzyl-7,9-dimethyl-8-oxo-1- azaspiro[4.4]nonane-6-carbonitrile","","- C18 H22 N2 O -","- C18 H22 N2 O -","- C72 H88 N8 O4 -","4","1","CF6225","Gravestock, David; McKenzie, Jean M.","(5<i>S</i>*,6<i>R</i>*,7<i>R</i>*,9<i>R</i>*)-1-Benzyl-7,9-dimethyl-8-oxo-1-azaspiro[4.4]nonane-6-carbonitrile","Acta Crystallographica Section E","2003","59","1","o63","o65","10.1107/S1600536802022031","","","0.71073","MoKα","","","0.0852","","","","0.2873","","","","","","1.043","","","","has coordinates,has disorder,has Fobs","201973","2020-10-21","18:00:00",""
"2201844","7.0228","0.0004","17.298","0.009","7.6646","0.0005","90","","90","","90","","931.1","0.5","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Dimethyl iminiodiacetate chloride","","- C6 H12 Cl N O4 -","- C6 H12 Cl N O4 -","- C24 H48 Cl4 N4 O16 -","4","0.5","CF6227","Ramos Silva, Manuela; Paixão, Jose Antonio; Matos Beja, Ana; Sobral, Abilio J. F. N.; Lopes, Susana H.; Rebanda, N. G. C. L.; Rocha Gonsalves, A. M. d'A.","Dimethyl iminiodiacetate chloride","Acta Crystallographica Section E","2003","59","1","o7","o8","10.1107/S1600536802022146","","","1.5418","CuKα","","0.0588","0.0427","","","0.1226","0.1629","","","","","","1.19","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201845","10.7729","0.0002","18.0442","0.0004","19.318","0.0005","90","","90","","90","","3755.19","0.15","180","2","180","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","[Rh(R)-(+)-1,1-binaphthyl-2,2'-diamine](1,5-cyclo-octadiene)rhodium(I) trifluoromethanesulfonate diethyl ether disolvate","","- C37 H48 F3 N2 O5 Rh S -","- C37 H48 F3 N2 O5 Rh S -","- C148 H192 F12 N8 O20 Rh4 S4 -","4","1","CF6228","Jones, Matthew D.; Almeida Paz, Filipe A.; Davies, John E.; Johnson, Brian F. G.","[(<i>R</i>)-(+)-1,1-Binaphthyl-2,2'-diamine](1,5-cyclooctadiene)rhodium(I) trifluoromethanesulfonate diethyl ether disolvate","Acta Crystallographica Section E","2003","59","1","m6","m7","10.1107/S1600536802022158","","","0.71073","MoKα","","0.0523","0.0383","","","0.077","0.0828","","","","","","1.016","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201846","11.7751","0.0004","16.198","0.0007","15.8787","0.0004","90","","90.175","0.002","90","","3028.58","0.18","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-[2-(4-Pyridyl)ethyl]pyridinium nitrate trihydrate","","- C12 H19 N3 O6 -","- C12 H19 N3 O6 -","- C96 H152 N24 O48 -","8","2","CF6229","Almeida Paz, Filipe A.; Khimyak, Yaroslav Z.; Klinowski, Jacek","4-[2-(4-Pyridyl)ethyl]pyridinium nitrate trihydrate","Acta Crystallographica Section E","2003","59","2","o132","o134","10.1107/S1600536803000783","","","0.71073","MoKα","","0.0981","0.0756","","","0.2045","0.2223","","","","","","1.064","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201847","4.874","0.0005","15.261","0.0015","16.423","0.002","90","","92.375","0.005","90","","1220.5","0.2","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Naringenin","2,3-Dihydro-5,6-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one","","- C15 H12 O5 -","- C15 H12 O5 -","- C60 H48 O20 -","4","1","CF6230","Philip J. Cox; Marcel Jaspars; Yashodharan Kumarasamy; Lutfun Nahar; Satyajit D. Sarker","An anomalous racemate of naringenin at 120K","Acta Crystallographica Section E","2003","59","1","o46","o48","10.1107/S160053680202278X","","","0.71069","MoKα","","0.2191","0.0667","","","0.115","0.1553","","","","","","0.926","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2201848","12.931","0.006","7.448","0.003","15.647","0.006","90","","95.29","0.03","90","","1500.5","1.1","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","9-Pentafluorophenylmethylene-9H-fluorene","","- C20 H9 F5 -","- C20 H9 F5 -","- C80 H36 F20 -","4","1","CF6231","Plater, M. John; Howie, R. Alan; Schmidt, Derek M.","9-Pentafluorophenylmethylene-9<i>H</i>-fluorene","Acta Crystallographica Section E","2003","59","1","o89","o91","10.1107/S1600536802023280","","","0.71073","MoKα","","0.0946","0.0446","","","0.0915","0.1126","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201849","8.834","0.003","10.304","0.003","20.576","0.006","91.915","0.007","96.371","0.007","110.718","0.01","1735.7","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4,11-Bis(4-chlorophenyl)-3,10-bis(2,6-dichlorophenyl)-1,8-dioxa- 2,9-diaza-dispiro[4.1.4.3]tetradeca-2,9-dien-6-one hydrate","","- C34 H23.5 Cl6 N2 O3.75 -","- C34 H23.5 Cl6 N2 O3.75 -","- C68 H47 Cl12 N4 O7.5 -","2","1","CF6232","Li, Xiao-Fang; Feng, Ya-Qing; Zhuang, Jun-Peng; Hu, Xiao-Fen","4,11-Bis(4-chlorophenyl)-3,10-bis(2,6-dichlorophenyl)-1,8-dioxa-2,9-diazadispiro[4.1.4.3]tetradeca-2,9-dien-6-one 0.75-hydrate","Acta Crystallographica Section E","2003","59","2","o247","o249","10.1107/S1600536803002034","","","0.71073","MoKα","","0.148","0.068","","","","0.186","","","","","","1.024","","","","has coordinates,has Fobs","194538","2020-10-21","18:00:00",""
"2201850","19.663","0.004","13.177","0.003","13.708","0.003","90","","103.69","0.03","90","","3450.8","1.4","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diethyl (4-tert-butyl-1,3-thiazol-2-ylaminomethylene)malonate","","- C15 H23 N2 O4 S -","- C15 H22 N2 O4 S -","- C120 H176 N16 O32 S8 -","8","1","CF6233","Daniel E. Lynch; Ian McClenaghan","Diethyl (4-<i>tert</i>-butyl-1,3-thiazol-2-ylaminomethylene)malonate","Acta Crystallographica Section E","2003","59","2","o242","o243","10.1107/S1600536803001302","","","0.71073","MoKα","","0.1996","0.0956","","","0.2478","0.2995","","","","","","1.163","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201851","7.0797","0.0008","7.3352","0.0009","14.1594","0.0015","90","","100.03","0.009","90","","724.07","0.14","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H12 Br N -","- C4 H12 Br N -","- C16 H48 Br4 N4 -","4","1","CF6234","Scheibitz, Matthias; Lerner, Hans-Wolfram; Bolte, Michael","Dimethylethylammonium bromide","Acta Crystallographica Section E","2003","59","2","o253","o254","10.1107/S1600536803002022","","","0.71073","MoKα","","0.0571","0.0333","","","0.0669","0.0715","","","","","","0.848","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201852","18.569","0.004","18.569","0.004","10.818","0.003","90","","90","","90","","3730.1","1.5","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","tetrakis(t-butyl-3-oxobutanoato)zirconium(IV)","","- C32 H52 O12 Zr -","- C32 H52 O12 Zr -","- C128 H208 O48 Zr4 -","4","0.25","CF6235","Urs, Usha K.; Dharmaprakash, M. S.; Shivashankar, S. A.; Guru Row, T. N.","Tetrakis(<i>tert</i>-butyl 3-oxobutanoato)zirconium(IV)","Acta Crystallographica Section E","2003","59","2","m83","m84","10.1107/S1600536803002046","","","0.71073","MoKα","","","0.0472","","","","0.1018","","","","","","1.003","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2201853","21.5031","0.0002","13.9259","0.0002","17.6668","0.0002","90","","116.536","0.0004","90","","4733.01","0.1","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C50 H61 Cl2 N4 O Sm -","- C50 H61 Cl2 N4 O Sm -","- C200 H244 Cl8 N16 O4 Sm4 -","4","0.5","CF6236","Rabe, Gerd W.; Rhatigan, Brian; Golen, James A.; Rheingold, Arnold L.","Dichloro(2,2',4,4',6,6'-hexamethyl-<i>m</i>-terphenyl)bis(<i>N</i>-methylimidazole)(tetrahydrofuran)samarium(III) toluene disolvate","Acta Crystallographica Section E","2003","59","3","m99","m101","10.1107/S1600536803003076","","","0.71073","MoKα","","0.0526","0.0429","","","0.0973","0.1046","","","","","","1.205","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201854","10.0339","0.0009","12.5618","0.0012","30.22","0.003","90","","90","","90","","3809","0.6","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","3-(2,6-Dichlorophenyl)-8-ethyl-4-phenyl-1-oxa-6-thia-2,8-diazaspiro[4.4]non- 2-ene-7,9-dione","","- C19 H14 Cl2 N2 O3 S -","- C19 H14 Cl2 N2 O3 S -","- C152 H112 Cl16 N16 O24 S8 -","8","1","CF6237","Li, Xiao-Fang; Feng, Ya-Qing; Gu, Yun-Feng","3-(2,6-Dichlorophenyl)-8-ethyl-4-phenyl-1-oxa-6-thia-2,8-diazaspiro[4.4]non-2-ene-7,9-dione","Acta Crystallographica Section E","2003","59","3","o330","o331","10.1107/S1600536803003003","","","0.71073","MoKα","","0.0971","0.052","","","","0.1104","","","","","","1.066","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201855","30.575","0.005","7.929","0.001","8.356","0.002","90","","95.09","0.02","90","","2017.7","0.6","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N-(4-Ethoxyphenyl)-2-[(4-ethoxyphenylcarbamoyl)methoxy]acetamide monohydrate","","- C20 H26 N2 O6 -","- C20 H26 N2 O6 -","- C80 H104 N8 O24 -","4","0.5","CF6238","Xiao-Feng Li; Wei-Sheng Liu; Min-Yu Tan","<i>N</i>-(4-Ethoxyphenyl)-2-[(4-ethoxyphenylcarbamoyl)methoxy]acetamide monohydrate, a supramolecular chain structure formed by hydrogen bonds","Acta Crystallographica Section E","2003","59","4","o435","o437","10.1107/S1600536803004896","","","0.71073","MoKα","","0.1091","0.0488","","","0.1049","0.1239","","","","","","0.842","","","","has coordinates,has Fobs","194389","2020-10-21","18:00:00",""
"2201856","13.426","0.003","11.128","0.002","12.211","0.002","90","","113.28","0.03","90","","1675.8","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2,6-Diisopropylphenyl)isopropylideneammonium iodide","","- C15 H24 I N -","- C15 H24 I N -","- C60 H96 I4 N4 -","4","1","CF6239","Baker, Robert J.; Bettentrup, Helga; Jones, Cameron","(2,6-Diisopropylphenyl)isopropylideneammonium iodide","Acta Crystallographica Section E","2003","59","4","o538","o539","10.1107/S1600536803003751","","","0.71073","MoKα","","0.072","0.0471","","","0.0895","0.0988","","","","","","1.073","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201857","14.258","0.004","7.185","0.002","9.773","0.003","90","","94.157","0.005","90","","998.5","0.5","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","homovaretic acid","3,4-dimethoxyphenyl acetic acid","","- C10 H12 O4 -","- C10 H12 O4 -","- C40 H48 O16 -","4","1","CF6240","Chopra, Deepak; Choudhury, A. R; Guru Row, T. N.","3,4-Dimethoxyphenylacetic acid","Acta Crystallographica Section E","2003","59","4","o433","o434","10.1107/S1600536803004902","","","0.71073","MoKα","","0.0497","0.0413","","","0.1032","0.1086","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201858","6.986","0.003","27.904","0.011","12.804","0.005","90","","104.127","0.008","90","","2420.5","1.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-{[3,4-Dihydro-5-methyl-3-oxo-2-phenyl-2H-pyrazol-4- ylidene](phenyl)methylamino}-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one","","- C28 H25 N5 O2 -","- C28 H25 N5 O2 -","- C112 H100 N20 O8 -","4","1","CF6241","Jin-Ling Wang; Yun Yang; Xin Zhang; Fang-Ming Miao","4-{[3,4-Dihydro-5-methyl-3-oxo-2-phenyl-2<i>H</i>-pyrazol-4-ylidene](phenyl)methylamino}-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2003","59","4","o430","o432","10.1107/S1600536803004914","","","0.71073","MoKα","","0.1631","0.0534","","","0.1143","0.1509","","","","","","0.848","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201859","14.6733","0.0001","5.8547","0.0002","22.3503","0.0005","90","","90.73","0.002","90","","1919.91","0.08","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H14 Cd N4 O4 S2 -","- C16 H14 Cd N4 O4 S2 -","- C64 H56 Cd4 N16 O16 S8 -","4","1","CF6242","Wang, Ruihu; Hong, Maochun; Luo, Junhua; Han, Lei; Cao, Rong","<i>catena</i>-Poly[[bis(3-aminobenzoic acid-κ<i>N</i>)cadmium(II)]-di-μ-thiocyanato-κ^4^<i>N</i>:<i>S</i>;<i>S</i>:<i>N</i>]","Acta Crystallographica Section E","2003","59","4","m152","m154","10.1107/S1600536803004926","","","0.71073","MoKα","","","0.0693","","","0.0926","0.0418","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201860","13.658","0.003","7.5018","0.0015","19.936","0.004","90","","93.37","0.03","90","","2039.1","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-(4-Chloro-2-nitrophenyl)-4,4'-bipyridinium triiodide","","- C16 H11 Cl I3 N3 O2 -","- C16 H11 Cl I3 N3 O2 -","- C64 H44 Cl4 I12 N12 O8 -","4","1","CF6243","Yan-Qiong Sun; Jie Zhang; Guo-Yu Yang","1-(4-Chloro-2-nitrophenyl)-4,4'-bipyridinium triiodide","Acta Crystallographica Section E","2003","59","4","o542","o544","10.1107/S1600536803006007","","","0.71073","MoKα","","0.1124","0.0689","","","0.1527","0.1791","","","","","","1.175","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201861","11.8503","0.0005","7.853","0.0003","19.963","0.0009","90","","90","","90","","1857.76","0.13","100","2","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C9 H11 F N2 O -","- C9 H11 F N2 O -","- C72 H88 F8 N16 O8 -","8","1","CF6244","Muir, Kenneth W.; Morris, David G.","<i>N,N</i>-Dimethyl-<i>N</i>'-(<i>o</i>-fluorobenzoyl)hydrazide","Acta Crystallographica Section E","2003","59","4","o490","o492","10.1107/S1600536803005634","","","0.71073","MoKα","","","0.0447","","","","0.116","","","","","","1.11","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201862","7.0622","0.0006","9.6969","0.0008","11.3531","0.0009","90","","105.308","0.002","90","","749.89","0.11","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[[μ-N,N'-bis(2-aminoethyl)oxamido]dicopper(II)]-di-μ- dicyanoamido]","","- C10 H12 Cu2 N10 O2 -","- C10 H12 Cu2 N10 O2 -","- C20 H24 Cu4 N20 O4 -","2","0.5","CF6245","Chu, Sheng; Wang, Xiao-Qing; Wang, Ru-Ji; Shen, Guang-Qiu","<i>catena</i>-Poly[[[μ-<i>N,N</i>'-bis(2-aminoethyl)oxamido]dicopper(II)]-di-μ-dicyanoamido]","Acta Crystallographica Section E","2003","59","4","m215","m217","10.1107/S1600536803006871","","","0.71073","MoKα","","0.0547","0.0395","","","0.0697","0.0728","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201863","9.2407","0.001","12.0579","0.0013","18.841","0.002","75.882","0.013","87.813","0.014","69.403","0.012","1903.2","0.4","180","2","","","","","","","","","","7","P -1","-P 1","2","","μ-trimethylsilylethynyl-μ-trimethylsilylethynethiolato- pentadecacarbonyldicobalttriruthenium","","- C25 H18 Co2 O15 Ru3 S Si2 -","- C25 H18 Co2 O15 Ru3 S Si2 -","- C50 H36 Co4 O30 Ru6 S2 Si4 -","2","1","CF6246","Esther Delgado; M. Isabel Alcade; Bruno Donnadieu; Elisa Hernandez; Javier Sanchez-Nieves","Hexacarbonyldicobalt addition across the C[tripleC bond of the alkynethiolate ligand in the cluster [Ru~3~(μ~3~,η^2^-C[tripleCSiMe~3~)(μ-SC[tripleCSiMe~3~)(CO)~9~]","Acta Crystallographica Section E","2003","59","4","m207","m209","10.1107/S1600536803006597","","","0.71073","MoKα","","","0.0316","","","","0.0944","","","","","","1.106","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201864","9.1206","0.0002","18.7541","0.0007","9.9829","0.0003","90","","103.206","0.002","90","","1662.41","0.09","180","2","180","2","","","","","","","","3","P 1 21 1","P 2yb","4","(S)-(-)-BINAP","(S)-(-)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl","","- C44 H32 P2 -","- C44 H32 P2 -","- C88 H64 P4 -","2","1","CF6247","Jones, Matthew D.; Almeida Paz, Filipe A.; Davies, John E.; Johnson, Brian F. G.","(<i>S</i>)-({-})-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl, a versatile chelating ligand","Acta Crystallographica Section E","2003","59","4","o535","o537","10.1107/S1600536803006019","","","0.71073","MoKα","","0.0588","0.0417","","","0.0803","0.0877","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201865","12.662","0.003","13.438","0.003","16.34","0.003","97.2","0.02","101.94","0.02","117.79","0.01","2326","1","296.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C50 H43 Fe2 N5 O16 -","- C50 H43 Fe2 N5 O16 -","- C100 H86 Fe4 N10 O32 -","2","1","CF6248","Okabe, Nobuo; Muranishi, Yasunori","<i>cis</i>-Diaquabis(quinoline-2-carboxylato-κ^2^<i>N,O</i>)iron(II)‒quinoline-2-carboxylic acid‒water (2/1/2)","Acta Crystallographica Section E","2003","59","5","m220","m222","10.1107/S1600536803006603","","","0.7107","MoKα","","","0.0448","","","","0.1738","","","","","","0.842","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201866","6.8349","0.0007","6.9692","0.0007","23.184","0.002","90","","90.797","0.002","90","","1104.23","0.18","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","Dipotassium disodium trans-bis(pyrazine-2,3-dicarboxylato)copper(II) dithiocyanate dihydrate","","- C14 H8 Cu K2 N6 Na2 O10 S2 -","- C14 H8 Cu K2 N6 Na2 O10 S2 -","- C28 H16 Cu2 K4 N12 Na4 O20 S4 -","2","0.5","CF6249","Ming-Sheng Wang; Li-Zhen Cai; Guo-Wei Zhou; Guo-Cong Guo; Jiang-Gao Mao; Jin-Shun Huang","Dipotassium disodium <i>trans</i>-bis(pyrazine-2,3-dicarboxylato)copper(II) dithiocyanate dihydrate","Acta Crystallographica Section E","2003","59","4","m212","m214","10.1107/S1600536803006883","","","0.71073","MoKα","","","0.0404","","","0.0956","0.1063","","","","","","1","","","","has coordinates,has Fobs","199607","2020-10-21","18:00:00",""
"2201867","9.052","0.0018","24.134","0.005","9.533","0.0019","90","","96.22","0.03","90","","2070.3","0.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(2-Hydroxyethyl)-4-{4,5,6,7-tetrahydro-1-[1-(2-hydroxyethyl)- pyridin-4(1H)-ylidene]-1H-inden-3-yl}pyridinium iodide","","- C23 H27 I N2 O2 -","- C23 H27 I N2 O2 -","- C92 H108 I4 N8 O8 -","4","1","CF6250","Gainsford, Graeme J.; Kay, Andrew J.; Woolhouse, A. D.","1-(2-Hydroxyethyl)-4-{4,5,6,7-tetrahydro-1-[1-(2-hydroxyethyl)-pyridin-4(1<i>H</i>)-ylidene]-1<i>H</i>-inden-3-yl}pyridinium iodide","Acta Crystallographica Section E","2003","59","4","o589","o590","10.1107/S160053680300686X","","","0.9204","synchrotron","","0.026","0.025","","","0.07","0.071","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201868","16.275","0.006","23.504","0.009","31.712","0.012","103.844","0.006","91.466","0.006","101.585","0.006","11504","8","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","tris(dibenzoylmethanido)(o-phenanthroline)europium(III)","","- C57 H41 Eu N2 O6 -","- C57 H41 Eu N2 O6 -","- C570 H410 Eu10 N20 O60 -","10","5","CI6182","Ahmed, Moawia O.; Liao, Jin-Long; Chen, Xiwen; Chen, Show-An; Kaldis, John H.","Anhydrous tris(dibenzoylmethanido)(<i>o</i>-phenanthroline)europium(III), [Eu(DBM)~3~(Phen)]","Acta Crystallographica Section E","2003","59","1","m29","m32","10.1107/S1600536802023036","","","0.71073","MoKα","","0.1023","0.0504","","","0.0791","0.0945","","","","","","0.987","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201869","5.93","0.003","9.647","0.006","22.331","0.009","90","","90.64","0.05","90","","1277.4","1.1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Succinimido 2-acetoxybenzoate","","- C13 H11 N O6 -","- C13 H11 N O6 -","- C52 H44 N4 O24 -","4","1","CI6183","Zou, Wuxin; Gao, Yu; Sugiyama, Teruki; Matsuura, Teruo; Meng, Jiben","Succinimido 2-acetoxybenzoate","Acta Crystallographica Section E","2003","59","1","o80","o82","10.1107/S1600536802022237","","","0.71073","MoKα","","0.1215","0.0689","","","0.158","0.1867","","","","","","1.112","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201870","8.2794","0.0002","15.3344","0.0002","10.259","0.0002","90","","96.639","0.001","90","","1293.74","0.04","213","2","213","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2a'-Chloro-3,8-dioxo-1',2',2a',8a'-tetrahydrodispiro[cyclopropane- 1,1'-cyclobuta[b]napthalene-2',1""-cyclopropane]","","- C16 H13 Cl O2 -","- C16 H13 Cl O2 -","- C64 H52 Cl4 O8 -","4","1","CI6185","Lei Wang; Anwar Usman; Hoong-Kun Fun; Yan Zhang; Jian-Hua Xu","2a'-Chloro-3,8-dioxo-1',2',2a',8a'-tetrahydrodispiro[cyclopropane-1,1'-cyclobuta[<i>b</i>]napthalene-2',1''-cyclopropane]","Acta Crystallographica Section E","2003","59","2","o106","o107","10.1107/S1600536802023504","","","0.71073","MoKα","","0.1223","0.0653","","","0.1521","0.1679","","","","","","0.93","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201871","23.831","0.002","5.9716","0.0006","8.1549","0.0008","90","","95.195","0.002","90","","1155.75","0.19","293","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Chlorobenzoxazolo[3,2-b]isoquinolin-6-one","","- C15 H8 Cl N O2 -","- C15 H8 Cl N O2 -","- C60 H32 Cl4 N4 O8 -","4","1","CI6186","Anwar Usman; Lei Wang; Hoong-Kun Fun; Ke-Qing Ling; Jian-Hua Xu","3-Chlorobenzoxazolo[3,2-<i>b</i>]isoquinolin-6-one","Acta Crystallographica Section E","2003","59","1","o59","o60","10.1107/S1600536802022778","","","0.71073","MoKα","","0.0924","0.0628","","","0.1355","0.1496","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201872","10.3005","0.0006","13.0905","0.0008","14.6105","0.0009","81.288","0.002","88.4473","0.0019","75.9648","0.0019","1889.1","0.2","105","2","105","2","","","","","","","","5","P -1","-P 1","2","DL-valinium perchlorate","DL-valinium perchlorate","","- C5 H12 Cl N O6 -","- C5 H12 Cl N O6 -","- C40 H96 Cl8 N8 O48 -","8","4","CI6187","B. Sridhar; N. Srinivasan; Bjoern Dalhus; R.K. Rajaram","<small>DL</small>-Valinium perchlorate","Acta Crystallographica Section E","2003","59","1","o28","o30","10.1107/S1600536802022225","","","0.7107","MoKα","","0.0527","0.0355","","","0.0949","0.1048","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201873","6.1359","0.0012","8.9746","0.0018","12.731","0.003","70.54","0.03","85.95","0.03","85.08","0.03","657.9","0.3","123","2","123","2","","","","","","","","6","P -1","-P 1","2","Methioninium trichloroacetate","DL-methiononium trichloroacetate at 123 K","","- C7 H12 Cl3 N O4 S -","- C7 H12 Cl3 N O4 S -","- C14 H24 Cl6 N2 O8 S2 -","2","1","CI6188","K. Rajagopal; R. V. Krishnakumar; A. Mostad; S. Natarajan","<small>DL</small>-Methioninium trichloroacetate at 123K","Acta Crystallographica Section E","2003","59","1","o31","o33","10.1107/S1600536802022298","","","0.71073","MoKα","","0.0344","0.0285","","","0.0821","0.0916","","","","","","1.165","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201874","12.436","0.003","12.715","0.003","16.073","0.003","70.13","0.03","69.23","0.03","66.22","0.03","2116.2","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","2-Bromo-N-[3-bromo-1-(phenylsulfonyl)indol-2-ylmethyl]-4-methylaniline","","- C22 H18 Br2 N2 O2 S -","- C22 H18 Br2 N2 O2 S -","- C88 H72 Br8 N8 O8 S4 -","4","2","CI6189","Govind, M.M.; Govindaraj, J.; Rajakannan, V.; Velmurugan, D.; Moon-Jib Kim; Srinivasan, P.C.; Kannadasan, S.","2-Bromo-<i>N</i>-[3-bromo-1-(phenylsulfonyl)indol-2-ylmethyl]-4-methylaniline","Acta Crystallographica Section E","2003","59","2","o177","o179","10.1107/S1600536802023322","","","0.71069","MoKα","","0.1998","0.0562","","","0.104","0.1347","","","","","","0.952","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201875","12.308","0.003","5.9942","0.0012","18.061","0.004","90","","99.15","0.03","90","","1315.5","0.5","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","DL-phenylalaninium maleate","","","- C13 H15 N O6 -","- C13 H15 N O6 -","- C52 H60 N4 O24 -","4","1","CI6190","M. Alagar; M. Subha Nandhini; R. V. Krishnakumar; A. Mostad; S. Natarajan","<small>DL</small>-Phenylalaninium maleate at 123K","Acta Crystallographica Section E","2003","59","2","o209","o211","10.1107/S160053680202295X","","","0.71073","MoKα","","0.0584","0.0449","","","0.1261","0.1461","","","","","","1.128","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201876","7.387","0.001","5.477","0.001","18.522","0.003","90","","99.36","0.01","90","","739.4","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","DL-aspartic acid hemioxalate","","","- C10 H16 N2 O12 -","- C10 H16 N2 O12 -","- C20 H32 N4 O24 -","2","0.5","CI6191","M. Alagar; R. V. Krishnakumar; M. Subha Nandhini; T. S. Cameron; S. Natarajan","Bis<small>(DL</small>-aspartic acid) oxalate","Acta Crystallographica Section E","2003","59","2","o108","o110","10.1107/S1600536802023334","","","0.71073","MoKα","","0.1179","0.0473","","","0.1451","0.193","","","","","","1.044","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2201877","15.0064","0.0002","9.4052","0.0002","15.7077","0.0002","90","","91.093","0.001","90","","2216.55","0.06","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","8-Chloro-4-[1-(phenylsulfonyl)indol-3-yl]-3a,4,5,9b-tetrahydro-3H- cyclopenta[c]quinoline","","- C26 H21 Cl N2 O2 S -","- C26 H21 Cl N2 O2 S -","- C104 H84 Cl4 N8 O8 S4 -","4","1","CI6192","R. Sankaranarayanan; M. Yogavel; D. Velmurugan; K. Sekar; G. Babu; P. T. Perumal; S. Shanmuga Sundara Raj; H.-K. Fun","8-Chloro-4-[1-(phenylsulfonyl)indol-3-yl]-3a,4,5,9b-tetrahydro-3<i>H</i>-cyclopenta[<i>c</i>]quinoline","Acta Crystallographica Section E","2003","59","1","o49","o51","10.1107/S1600536802022717","","","0.71073","MoKα","","0.0678","0.0451","","","0.1103","0.1239","","","","","","1.027","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201878","9.292","0.0002","9.5524","0.0003","11.3921","0.0003","67.379","0.001","72.821","0.001","74.589","0.001","878.37","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1,2-Bis[1-phenylsulfonyl-3-(phenylthio)indol-2-yl]ethene","","- C42 H30 N2 O4 S4 -","- C42 H30 N2 O4 S4 -","- C42 H30 N2 O4 S4 -","1","0.5","CI6193","R. Sankaranarayanan; M. Yogavel; D. Velmurugan; K. Sekar; P. C. Srinivasan; S. Shanmuga Sundara Raj; Hoong-Kun Fun","1,2-Bis[1-phenylsulfonyl-3-(phenylthio)indol-2-yl]ethene","Acta Crystallographica Section E","2003","59","1","o99","o101","10.1107/S1600536802023188","","","0.71073","MoKα","","0.0462","0.0398","","","0.1156","0.1202","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201879","5.691","0.004","6.902","0.003","34.044","0.002","90","","90","","90","","1337.2","1.1","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2-Hydroxy-2-methyl-3-benzoylchromene","","- C17 H14 O3 -","- C17 H14 O3 -","- C68 H56 O12 -","4","1","CI6194","M. Yogavel; D. Velmurugan; K. Sekar; H. Schenk; J. Fraanje; R. Peschar; S. Srinivasan; P. R. Athappan; Z. A. Rafi","3-Benzoyl-2-hydroxy-2-methylchromene","Acta Crystallographica Section E","2003","59","3","o266","o268","10.1107/S1600536803002411","","","1.5418","CuKα","","0.0542","0.0501","","","0.1587","0.1707","","","","","","1.062","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201880","10.671","0.002","10.974","0.001","11.826","0.002","82.82","0.01","64.04","0.01","78.32","0.01","1218.3","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","5-Amino-4-(4-dimethylaminophenyl)-2-(4-methoxyphenyl)-7-(pyrrolidin-1-yl)- 1,6-naphthyridine-8-carbonitrile","","- C28 H28 N6 O -","- C28 H28 N6 O -","- C56 H56 N12 O2 -","2","1","CI6195","Sundari Bhaskaran; M. Yogavel; V. Rajakannan; R. Krishna; D. Velmurugan; V. Raghukumar","5-Amino-4-(4-dimethylaminophenyl)-2-(4-methoxyphenyl)-7-(pyrrolidin-1-yl)-1,6-naphthyridine-8-carbonitrile","Acta Crystallographica Section E","2003","59","2","o200","o202","10.1107/S1600536803001235","","","1.5418","CuKα","","0.2872","0.0669","","","0.1317","0.1956","","","","","","0.902","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201881","10.1239","0.0001","5.8366","0.0001","26.9176","0.0001","90","","97.403","0.001","90","","1577.28","0.03","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5,5'-dimethyl-2-(4-methylphenylaminocarbomethyl)-1,3-cyclohexanedione","","- C17 H21 N O3 -","- C17 H21 N O3 -","- C68 H84 N4 O12 -","4","1","CI6196","S. Selvanayagam; M. Yogavel; V. Rajakannan; D. Velmurugan; S. Shanmuga Sundara Raj; Hoong-Kun Fun","2-Hydroxy-4,4-dimethyl-<i>N</i>-(4-methylphenyl-6-oxocyclohexanylacetamide","Acta Crystallographica Section E","2003","59","3","o261","o262","10.1107/S1600536803001442","","","0.71073","MoKα","","0.0644","0.0448","","","0.1159","0.1274","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201882","9.7541","0.0014","9.7541","0.0014","10.089","0.002","90","","90","","120","","831.3","0.2","105","2","105","2","","","","","","","","5","P 31","P 31","144","Prolinium trichloroacetate","L-prolinium trichloroacetate","","- C7 H10 Cl3 N O4 -","- C7 H10 Cl3 N O4 -","- C21 H30 Cl9 N3 O12 -","3","1","CI6197","K. Rajagopal; R. V. Krishnakumar; A. Mostad; S. Natarajan","<small>L</small>-Prolinium trichloroacetate at 105K","Acta Crystallographica Section E","2003","59","3","o277","o279","10.1107/S1600536803002332","","","0.71073","MoKα","","0.0266","0.0258","","","0.0683","0.0689","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201883","9.0894","0.0018","25.813","0.003","15.1605","0.001","90","","90","","90","","3557","0.8","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","r-2,c-6-Di(p-tolyl)-t-3,t-5-dimethyltetrahydropyran-4-one","","- C21 H24 O2 -","- C21 H24 O2 -","- C168 H192 O16 -","8","1","CI6198","Krishnamoorthy, Belli Sundaram; Sarangarajan, Thanjavur Ramabhadran; Thanikasalam, Kanagasabapathy; Panchanatheswaran, Krishnaswamy; Jeyaraman, Ramasubbu","<i>r</i>-2,<i>c</i>-6-Bis(<i>p</i>-tolyl)-<i>t</i>-3,<i>t</i>-5-dimethyltetrahydropyran-4-one","Acta Crystallographica Section E","2003","59","4","o461","o462","10.1107/S1600536803005336","","","1.5418","CuKα","","0.1547","0.0744","","","0.1564","0.1976","","","","","","1.109","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201884","13.0142","0.0015","18.102","0.002","14.1367","0.0017","90","","114.328","0.002","90","","3034.6","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[N,N'-bis(2-fluorobenzylidene)ethylenediamine-κ^2^N,N']silver(I) nitrate","","- C32 H28 Ag F4 N5 O3 -","- C32 H28 Ag F4 N5 O3 -","- C128 H112 Ag4 F16 N20 O12 -","4","0.5","CI6199","Anwar Usman; Hoong-Kun Fun; Hai-Liang Zhu; Qiong-Xin Liu","Bis[<i>N,N</i>'-bis(2-fluorobenzylidene)ethylenediamine-κ^2^<i>N,N</i>']silver(I) nitrate","Acta Crystallographica Section E","2003","59","4","m140","m141","10.1107/S1600536803004756","","","0.71073","MoKα","","0.0564","0.0397","","","0.1017","0.1143","","","","","","1.092","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201885","9.9315","0.0002","11.894","0.0004","11.3979","0.0004","90","","97.079","0.014","90","","1336.12","0.08","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-cyano-3-dimethylamino-N-(2,5-methylphenyl)acrylamide","","- C14 H17 N3 O -","- C14 H17 N3 O -","- C56 H68 N12 O4 -","4","1","CI6200","Ompraba; A. Aysha; M. Yogavel; D. Velmurugan; S. Selvi; P. T. Perumal; S. Shanmuga Sundara Raj; H.-K. Fun; Z. A. Rafi","2-Cyano-3-dimethylamino-<i>N</i>-(2,5-dimethylphenyl)acrylamide","Acta Crystallographica Section E","2003","59","3","o353","o355","10.1107/S1600536803002848","","","0.71073","MoKα","","0.106","0.0581","","","0.142","0.1677","","","","","","1.015","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201886","6.126","0.001","9.573","0.001","11.243","0.001","90","","119.23","0.02","90","","575.38","0.17","105","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Trichloroacetic acid","","- C2 H Cl3 O2 -","- C2 H Cl3 O2 -","- C8 H4 Cl12 O8 -","4","1","CI6201","K. Rajagopal; A. Mostad; R. V. Krishnakumar; M. Subha Nandhini; S. Natarajan","Trichloroacetic acid at 105K","Acta Crystallographica Section E","2003","59","3","o316","o318","10.1107/S1600536803002903","","","0.71073","MoKα","","0.0374","0.0313","","","0.0778","0.0814","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201887","12.6447","0.0002","7.7044","0.0001","13.5573","0.0001","90","","92.103","0.001","90","","1319.86","0.03","295","2","295","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","2-(5,7-Dihydroxy-4-oxo-4H-chromen-3-yl)-5-methoxy-1,4-benzoquinone","","- C16 H10 O7 -","- C16 H10 O7 -","- C64 H40 O28 -","4","1","CI6202","Aree, Thammarat; Tip-pyang, Santi; Seesukphronrarak, Surasak; Chaichit, Narongsak","2-(5,7-Dihydroxy-4-oxo-4<i>H</i>-chromen-3-yl)-5-methoxy-1,4-benzoquinone (isoflavonequinone)","Acta Crystallographica Section E","2003","59","3","o363","o365","10.1107/S1600536803003684","","","0.71073","MoKα","","0.0588","0.043","","","0.1141","0.1254","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201888","6.9036","0.0002","12.3647","0.0003","9.5054","0.0001","90","","100.454","0.001","90","","797.92","0.03","295","2","295","2","","","","","","","","3","P 1 21 1","P 2yb","4","Melilotocarpan D monohydrate","3,9-Dimethoxy-6a,11a-dihydro-6H-benzo[4,5]furo[3,2-c]chromene-4,10-diol monohydrate","","- C17 H18 O7 -","- C17 H18 O7 -","- C34 H36 O14 -","2","1","CI6203","Aree, Thammarat; Tip-pyang, Santi; Paramapojn, Sompol; Chaichit, Narongsak","3,9-Dimethoxy-6a,11a-dihydro-6<i>H</i>-benzo[4,5]furo[3,2-<i>c</i>]chromene-4,10-diol monohydrate","Acta Crystallographica Section E","2003","59","3","o381","o383","10.1107/S1600536803004227","","","0.71073","MoKα","","0.0489","0.0376","","","0.0887","0.0947","","","","","","1.037","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201889","8.3865","0.0013","18.273","0.004","10.652","0.002","90","","90","","90","","1632.4","0.5","293","2","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C10 H8 O2 -","- C10 H8 O2 -","- C80 H64 O16 -","8","1","CI6204","A. Thiruvalluvar; S. Silvarani; A. Vadivelu; K. Sithik Ali; V. R. Venkataraman","2-Acetylbenzo[<i>b</i>]furan","Acta Crystallographica Section E","2003","59","4","o395","o396","10.1107/S1600536803004306","","","0.71073","MoKα","","","0.0356","","","","0.0922","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201890","15.013","0.001","9.123","0.0016","25.462","0.004","90","","90","","90","","3487.4","0.9","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","r-2,c-6-di(4-chlorophenyl)-t-3,t-5-dimethyltetrahydropyran-4-one","","- C19 H18 Cl2 O2 -","- C19 H18 Cl2 O2 -","- C152 H144 Cl16 O16 -","8","1","CI6205","Jose Kavitha, Savaridasson; Sarangarajan, Thanjavur Ramabhadran; Thanikasalam, Kanagasabapathy; Panchanatheswaran, Krishnaswamy; Jeyaraman, Ramasubbu","<i>r</i>-2,<i>c</i>-6-Bis(4-chlorophenyl)-<i>t</i>-3,<i>t</i>-5-dimethyltetrahydropyran-4-one","Acta Crystallographica Section E","2003","59","4","o463","o465","10.1107/S1600536803005361","","","0.71069","MoKα","","0.0794","0.0513","","","0.1152","0.1399","","","","","","1.101","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201891","10.3624","0.0006","21.4915","0.0012","13.5314","0.0008","90","","101.492","0.001","90","","2953.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","10-[2-(4-acetylpiperzain-1-yl)ethyl]-9-(4-chlorophenyl)-3,3,6,6-tetramethyl- 3,4,6,7,9,10-hexahydro-2H,5H-acridine-1,8-dione","","- C31 H40 Cl N3 O3 -","- C31 H40 Cl N3 O3 -","- C124 H160 Cl4 N12 O12 -","4","1","CI6207","P.r. Seshadri; M.yogavel; T. Joseph Rajan; D.velmurugan; S.shanmuga Sundara Raj; H.-K.fun","10-[2-(4-Acetylpiperzin-1-yl)ethyl]-9-(4-chlorophenyl)-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydro-2<i>H</i>,5<i>H</i>-acridine-1,8-dione","Acta Crystallographica Section E","2003","59","5","o696","o698","10.1107/S1600536803007530","","","0.71073","MoKα","","0.2386","0.0791","","","0.1606","0.2163","","","","","","0.904","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201892","17.917","0.001","18.126","0.001","7.668","0.001","90","","90","","90","","2490.3","0.4","293","2","293","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","Mansonone H","4-Hydroxy-3,6,9-trimethyl-2,3-dihydrobenzo[de]chromene-7,8-dione","","- C15 H14 O4 -","- C15 H14 O4 -","- C120 H112 O32 -","8","2","CI6209","Xin-Dong Guo; Cheng-Zhu Liao; Lin Ma; Lian-Quan Gu","4-Hydroxy-3,6,9-trimethyl-2,3-dihydrobenzo[<i>de</i>]chromene-7,8-dione","Acta Crystallographica Section E","2003","59","4","o558","o560","10.1107/S1600536803006366","","","0.71073","MoKα","","0.0927","0.0529","","","0.1256","0.1477","","","","","","1.003","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201893","11.4553","0.0003","15.1766","0.0001","16.0597","0.0005","90","","101.826","0.002","90","","2732.76","0.11","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Bis[μ-methylenebis(diphenylphosphine)-P:P']disilver(I) diperchlorate diacetonitrile solvate","","- C54 H50 Ag2 Cl2 N2 O8 P4 -","- C54 H50 Ag2 Cl2 N2 O8 P4 -","- C108 H100 Ag4 Cl4 N4 O16 P8 -","2","0.5","CI6210","Wei, Qiaohua; Yin, Gangqiang; Chen, Zhongning","Bis[μ-methylenebis(diphenylphosphine)-κ^2^<i>P</i>:<i>P</i>']disilver(I) diperchlorate acetonitrile disolvate","Acta Crystallographica Section E","2003","59","5","m232","m233","10.1107/S1600536803007244","","","0.71073","MoKα","","0.1351","0.0664","","","0.1044","0.1314","","","","","","1.143","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201894","7.574","0.002","8.672","0.002","8.789","0.003","106.32","0.03","110.99","0.03","93.28","0.03","509.2","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","3-Acetyl-2-hydroxy-2-methylchromene","","- C12 H12 O3 -","- C12 H12 O3 -","- C24 H24 O6 -","2","1","CI6211","M. Yogavel; D. Velmurugan; K. Sekar; H. Schenk; J. Fraanje; R. Peschar; S. Srinivasan; P. R. Athappan; Z. A. Rafi","3-Acetyl-2-hydroxy-2-methylchromene","Acta Crystallographica Section E","2003","59","5","o591","o593","10.1107/S1600536803006913","","","1.5418","CuKα","","0.069","0.0672","","","0.1933","0.1976","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201895","10.8499","0.0002","10.5171","0.0002","19.0168","0.0003","90","","92.104","0.001","90","","2168.53","0.07","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Methoxy-4-acetamido-5-(3'-phenylthio indol-2-oyl)benzoic acid","","- C25 H20 N2 O5 S -","- C25 H20 N2 O5 S -","- C100 H80 N8 O20 S4 -","4","1","CI6213","V. Rajakannan; S. Selvanayagam; M. Yogavel; L. Govindasamy; D. Velmurugan; S. Shanmuga Sundara Raj; H.-K. Fun; P.C. Srinivasan","4-Acetamido-2-methoxy-5-[3-(phenylsulfanyl)indole-2-carbonyl]benzoic acid","Acta Crystallographica Section E","2003","59","5","o718","o720","10.1107/S1600536803007566","","","0.71073","MoKα","","0.0858","0.0453","","","0.1028","0.1182","","","","","","0.937","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201896","11.0203","0.0007","8.0642","0.0005","31.1269","0.0018","90","","90","","90","","2766.2","0.3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Ethyl 2-phenyl-3-pyridinylacrylate","","- C16 H15 N O2 -","- C16 H15 N O2 -","- C128 H120 N8 O16 -","8","1","CI6214","Yun Li; Anwar Usman; Hoong-Kun Fun; Jian-Hua Xu","Ethyl 2-phenyl-3-(pyridin-2-yl)acrylate","Acta Crystallographica Section E","2003","59","5","o610","o611","10.1107/S1600536803007529","","","0.71073","MoKα","","0.0954","0.0691","","","0.1442","0.1574","","","","","","1.163","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201897","12.988","0.0004","12.988","0.0004","20.9435","0.0012","90","","90","","90","","3532.9","0.3","293","2","293","2","","","","","","","","4","I 41 c d","I 4bw -2c","110","","[Bis(4-maleimidophenyl)]methane","","- C21 H14 N2 O4 -","- C21 H14 N2 O4 -","- C168 H112 N16 O32 -","8","0.5","CI6215","Anwar Usman; Hoong-Kun Fun; Hai-Liang Zhu; Gang Ke","Bis(4-maleimidophenyl)methane","Acta Crystallographica Section E","2003","59","5","o652","o653","10.1107/S1600536803007670","","","0.71073","MoKα","","0.0345","0.032","","","0.0879","0.0915","","","","","","1.078","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201898","9.1333","0.0005","9.8999","0.0005","12.0435","0.0007","74.876","0.001","81.705","0.001","73.137","0.001","1003.26","0.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3,3,6,6-Tetramethyl-9-(4-pyridyl)-3,4,6,7,9,10-hexahydro- 1,8(2H,5H)-acridinedione monohydrate","","- C22 H28 N2 O3 -","- C22 H28 N2 O3 -","- C44 H56 N4 O6 -","2","1","CI6216","P. G. Aravindan; M. Yogavel; D. Velmurugan; P. Murugan; S. Shanmuga Sundara Raj; H.-K. Fun","3,3,6,6-Tetramethyl-9-(4-pyridyl)-3,4,6,7,9,10-hexahydro-1,8(2<i>H</i>,5<i>H</i>)-acridinedione monohydrate","Acta Crystallographica Section E","2003","59","5","o659","o661","10.1107/S1600536803007864","","","0.71073","MoKα","","0.0747","0.051","","","0.1305","0.1455","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201899","7.5949","0.0004","10.0887","0.0006","11.5777","0.0007","85.298","0.001","76.924","0.001","86.166","0.001","860.14","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-[2-(4-Ethoxy-5-methoxy-2-nitrophenyl)vinyl]-1H-indole","","- C19 H18 N2 O4 -","- C19 H18 N2 O4 -","- C38 H36 N4 O8 -","2","1","CI6217","R. Sankaranarayanan; M. Yogavel; D. Velmurugan; P. C. Srinivasan; S. Shanmuga Sundara Raj; Hoong-Kun Fun","2-[2-(5-Ethoxy-4-methoxy-2-nitrophenyl)vinyl]-1<i>H</i>-indole","Acta Crystallographica Section E","2003","59","5","o672","o674","10.1107/S1600536803007876","","","0.71073","MoKα","","0.0912","0.0614","","","0.1644","0.1893","","","","","","1.023","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201900","8.0083","0.0001","11.7242","0.0002","21.915","0.0004","86.474","0.001","89.831","0.001","81.037","0.001","2028.6","0.06","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","3-[2-(2,4-Dichlorophenyl)vinyl]-2-methyl-1-phenylsulfonyl-1H-indole","","- C23 H17 Cl2 N O2 S -","- C23 H17 Cl2 N O2 S -","- C92 H68 Cl8 N4 O8 S4 -","4","2","CI6218","V. K. Ganesh; M. Yogavel; D. Velmurugan; S. Shanmuga Sundar Raj; H.-K. Fun; S. Kannadasan; P. C. Srinivasan","3-[2-(2,4-Dichlorophenyl)vinyl]-2-methyl-1-phenylsulfonyl-1<i>H</i>-indole","Acta Crystallographica Section E","2003","59","5","o703","o705","10.1107/S1600536803007888","","","0.71073","MoKα","","0.0652","0.0432","","","0.1108","0.1213","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201901","12.172","0.001","9.14","0.001","18.081","0.001","90","","106.58","0.01","90","","1927.9","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","[6a,16b]-cis-7,7-Dimethyl-6,6a,7,16b- tetrahydrochromeno[4',3':3,4]pyrano[3,2-c]-α-naphthocoumarin","","- C25 H20 O4 -","- C25 H20 O4 -","- C100 H80 O16 -","4","1","CI6219","R. Krishna; S. Selvanayagam; M. Yogavel; D. Velmurugan; S. Manikandan","[6a,16b]-<i>cis</i>-7,7-Dimethyl-6,6a,7,16b-tetrahydrochromeno[4',3':3,4]pyrano[3,2-<i>c</i>]-α-naphthocoumarin","Acta Crystallographica Section E","2003","59","5","o667","o669","10.1107/S160053680300789X","","","1.5418","CuKα","","0.0733","0.0491","","","0.1339","0.1531","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201902","16.013","0.006","15.627","0.006","16.317","0.006","90","","102.325","0.007","90","","3989","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-(4-Chlorophenyl)-1,3-diphenyl-7-oxa-1,2-diazaspiro[4.4]non-2-en-6-one","","- C24 H19 Cl N2 O2 -","- C24 H19 Cl N2 O2 -","- C192 H152 Cl8 N16 O16 -","8","1","CI6220","Li, Xiao-Fang; Feng, Ya-Qing; Hu, Xiao-Fen; Xu, Mian","4-(4-Chlorophenyl)-1,3-diphenyl-7-oxa-1,2-diazaspiro[4.4]non-2-en-6-one","Acta Crystallographica Section E","2003","59","6","o794","o796","10.1107/S1600536803009759","","","0.71073","MoKα","","0.1225","0.0543","","","","0.131","","","","","","1.001","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201903","10.4039","0.0007","11.0435","0.0008","17.7471","0.0012","90","","90","","90","","2039.1","0.2","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-(2-hydroxyphenyl)-1,3-dithiane","","- C10 H12 O S2 -","- C10 H12 O S2 -","- C80 H96 O8 S16 -","8","1","CI6223","Anwar Usman; Hoong-Kun Fun; Nemai C. Ganguly; Mrityunjoy Datta; Kumaresh Ghosh","2-(2-Hydroxyphenyl)-1,3-dithiane","Acta Crystallographica Section E","2003","59","6","o773","o775","10.1107/S1600536803009401","","","0.71073","MoKα","","0.0769","0.063","","","0.1308","0.1365","","","","","","1.236","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201904","8.8291","0.0004","9.8819","0.0004","18.2053","0.0008","90","","90","","90","","1588.38","0.12","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1,2,3,4,4a,12a-Hexahydro-2,5,5-trimethyl-1-H-[2]benzopyrano[3,2-c]coumarin","","- C19 H22 O3 -","- C19 H22 O3 -","- C76 H88 O12 -","4","1","CI6225","R. Krishna; S. Selvanayagam; M. Yogavel; D. Velmurugan; M. Shanmugasundaram; R. Raghunathan; S. Shanmuga Sundara Raj; H.-K. Fun","1,2,3,4,4a,12a-Hexahydro-2,5,5-trimethyl-1<i>H</i>-[2]benzopyrano[3,2-<i>c</i>]coumarin","Acta Crystallographica Section E","2003","59","6","o808","o809","10.1107/S1600536803009978","","","0.71073","MoKα","","0.0496","0.0418","","","0.1069","0.1138","","","","","","1.085","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201905","6.9856","0.0005","9.2926","0.0011","12.3538","0.0014","78.585","0.005","84.015","0.007","73.74","0.007","753.62","0.14","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","Bis(4,4'-bipyridine)-tetraaquacobalt(II) 2,6-naphathalenedicarboxylate dihydrate","","- C32 H34 Co N4 O10 -","- C32 H34 Co N4 O10 -","- C32 H34 Co N4 O10 -","1","0.5","CM6026","Almeida Paz, Filipe A.; Khimyak, Yaroslav Z.; Klinowski, Jacek","Bis(4,4'-bipyridine)tetraaquacobalt(II) 2,6-naphathalenedicarboxylate dihydrate","Acta Crystallographica Section E","2003","59","1","m8","m10","10.1107/S1600536802022122","","","0.71073","MoKα","","0.0662","0.046","","","0.1044","0.1211","","","","","","1.103","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201906","5.988","0.001","10.668","0.001","36.511","0.003","90","","90","","90","","2332.3","0.5","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","16α,17α-Epoxy-20-oxopregn-5-ene-3β,21-diyl diacetate","","- C25 H34 O6 -","- C25 H34 O6 -","- C100 H136 O24 -","4","1","CM6028","Andrade, L. C. R.; Paixao, J.A.; de Almeida, M. J. M.; Martins, R. M. L. M.; Soares, H. I. M.; Moreno, M. J. S. M.; Sá e Melo, M. L.; Campos Neves, A. S.","16α,17α-Epoxy-20-oxopregn-5-ene-3β,21-diyl diacetate","Acta Crystallographica Section E","2003","59","3","o299","o301","10.1107/S1600536803002721","","","1.5418","CuKα","","0.0732","0.05","","","0.1365","0.1543","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201907","12.657","0.003","13.816","0.003","14.892","0.003","90","","111.15","0.01","90","","2428.7","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H44 Mo8 N8 O30 -","- C28 H44 Mo8 N8 O30 -","- C56 H88 Mo16 N16 O60 -","2","0.5","CM6029","Ying Yan; Chuan-De Wu; Jiu-Hui Liu; Quan-Zheng Zhang; Can-Zhong Lu","Tetrakis[4-amino-<i>N</i>-(2-hydroxyethyl)pyridinium] hexacosaoxooctamolybdate","Acta Crystallographica Section E","2003","59","3","m102","m104","10.1107/S1600536803003155","","","0.71073","MoKα","","0.0495","0.0372","","","0.0917","0.1035","","","","","","1.092","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201908","17.797","0.002","17.797","0.002","20.6","0.002","90","","90","","90","","6524.7","1.2","150","","150","","","","","","","","","5","P 42/n :2","-P 4bc","86","","Tetraaquatetrakis[2-(2-hydroxyethylamino)ethanolato]tetracopper(II) tetranitrate 14/3-hydrate","","- C16 H57.3333 Cu4 N8 O28.6667 -","- C16 H48 Cu4 N8 O28.6667 -","- C96 H288 Cu24 N48 O172 -","6","0.75","CM6031","Vinogradova, Elena A.; Kokozay, Vladimir N.; Vassilyeva, Olga Yu.; Skelton, Brian W.","Tetraaquatetrakis[2-(2-hydroxyethylamino)ethanolato]tetracopper(II) tetranitrate 14/3-hydrate","Acta Crystallographica Section E","2003","59","4","m148","m151","10.1107/S1600536803004690","","","0.71073","MoKα","","0.129","0.064","","0.114","","0.087","","","1.018","","","1.037","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2201909","5.1447","0.0001","12.3264","0.0004","18.5357","0.0007","90","","90","","90","","1175.45","0.06","180","2","180","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1R,2R)-(+)-1,2-Diphenylethylenediamine","","- C14 H16 N2 -","- C14 H16 N2 -","- C56 H64 N8 -","4","1","CM6032","Jones, Matthew D.; Almeida Paz, Filipe A.; Davies, John E.; Johnson, Brian F. G.","(1<i>R</i>,2<i>R</i>)-(+)-1,2-Diphenylethylenediamine","Acta Crystallographica Section E","2003","59","4","o455","o457","10.1107/S1600536803005385","","","0.71073","MoKα","","0.0392","0.0354","","","0.0799","0.0817","","","","","","1.094","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201910","6.7109","0.001","8.6329","0.0012","15.833","0.002","84.144","0.003","79.466","0.003","76.252","0.003","874.3","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-Acetyl-3-(p-chlorobenzyl)-4-benzylidenamino-4,5-dihydro- 1H-1,2,4-triazole-5-one","","- C18 H14 Cl2 N4 O2 -","- C18 H14 Cl2 N4 O2 -","- C36 H28 Cl4 N8 O4 -","2","1","CM6033","Ocak, Nazan; Çoruh, Ufuk; Kahveci, Bahattin; Şaşmaz, Selami; Ag̃ar, Erbil; Vázquez-López, Ezequiel M.; Erdönmez, Ahmet","1-Acetyl-3-(<i>p</i>-chlorobenzyl)-4-(<i>p</i>-chlorobenzylidenamino)-4,5-dihydro-1<i>H</i>-1,2,4-triazol-5-one","Acta Crystallographica Section E","2003","59","6","o750","o752","10.1107/S1600536803007426","","","0.71073","MoKα","","0.0951","0.0598","","","0.1193","0.133","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201911","18.4091","0.0002","18.6585","0.0002","19.8406","0.0003","114.329","0.007","93.926","0.007","95.828","0.007","6131.8","0.4","150","1","150","1","","","","","","","","8","P -1","-P 1","2","","Dimethanoltetrakis[5,10,15,20-tetrakis(2,6-dichlorophenyl)porphinato]manganese hexacyanooctaselenidorhenium tridecahydrate","","- C190 H138 Cl32 Mn4 N22 O21 Re6 Se8 -","- C190 H128 Cl32 Mn4 N22 O16 Re6 Se8 -","- C190 H128 Cl32 Mn4 N22 O16 Re6 Se8 -","1","0.5","CM6034","Park, Seon-Mi; Kim, Sehye; Lough, Alan J.; Kim, Sung-Jin; Kim, Youngmee","Dimethanoltetrakis[5,10,15,20-tetrakis(2,6-dichlorophenyl)porphinato]manganese(III) hexacyanooctaselenidorhenate(III) tridecahydrate","Acta Crystallographica Section E","2003","59","5","m276","m279","10.1107/S1600536803008547","","","0.71073","MoKα","","0.0884","0.071","","","0.187","0.1963","","","","","","1.034","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201912","17.1506","0.0002","9.6464","0.0002","10.4167","0.0002","90","","99.693","0.002","90","","1698.75","0.05","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H22 N2 O -","- C20 H22 N2 O -","- C80 H88 N8 O4 -","4","1","CM6035","Sema Öztürk; Mehmet Akkurt; Mahmure Üstün Özgür; Ayşe Erçağ; Frank W. Heinemann","(3<i>E</i>)-3-[(4-Hexylphenyl)imino]1<i>H</i>-indol-2(3<i>H</i>)-one","Acta Crystallographica Section E","2003","59","4","o569","o571","10.1107/S1600536803006809","","","0.71073","MoKα","","0.0946","0.0497","","","0.1089","0.1318","","","","","","1.046","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201913","9.352","0.005","12.921","0.005","12.908","0.005","90","","104.37","0.005","90","","1511","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(6-Benzoyl-2-oxo-2,3-dihydro-2-benzothiazol-3-yl)propanoic acid","","- C17 H13 N O4 S -","- C17 H13 N O4 S -","- C68 H52 N4 O16 S4 -","4","1","CM6036","Abdullah Aydın; Tíjen Önkol; Cengíz Arıcı; Mehmet Akkurt; M. Fethí Şahín; Dínçer Ülkü","3-(6-Benzoyl-2-oxo-2,3-dihydro-2-benzothiazol-3-yl)propanoic acid","Acta Crystallographica Section E","2003","59","5","o616","o618","10.1107/S1600536803007281","","","0.71069","MoKα","","0.1078","0.056","","","0.158","0.1904","","","","","","1.056","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201914","6.4737","0.0003","6.5302","0.0003","13.8836","0.0006","86.935","0.003","88.987","0.003","64.078","0.003","527.11","0.04","100","2","100","2","","","","","","","","3","P -1","-P 1","2","Cineolic acid","tetrahydro-2,6,6-trimethyl-1,4-pyran-2,5-dicarboxylic acid","","- C10 H16 O5 -","- C10 H16 O5 -","- C20 H32 O10 -","2","1","CM6038","Barnes, John C.; Weakley, Timothy J.R.","Tetrahydro-2,6,6-trimethyl-1,4-pyran-2,5-dicarboxylic acid (cineolic acid)","Acta Crystallographica Section E","2003","59","5","o728","o730","10.1107/S1600536803007657","","","0.71073","MoKα","","0.038","0.0366","","","0.1073","0.1088","","","","","","1.109","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201915","26.5948","0.0014","7.9327","0.0004","12.848","0.0009","90","","102.938","0.002","90","","2641.7","0.3","150","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Ethylenediammonium bis(hydrogen cineolate) dihydrate","Ethylenediammonium bis(tetrahydro-2,6,6-trimethyl-1,4-pyran-2-carboxylate- 5-carboxylic acid) dihydrate","","- C22 H44 N2 O12 -","- C22 H44 N2 O12 -","- C88 H176 N8 O48 -","4","0.5","CM6039","Barnes, John C.","Ethylenediammonium bis(2-carboxylato-3,4,5,6-tetrahydro-2,6,6-trimethyl-2<i>H</i>-pyran-5-carboxylic acid) dihydrate [ethylenediammonium bis(hydrogen cineolate) dihydrate]","Acta Crystallographica Section E","2003","59","5","o731","o733","10.1107/S1600536803007669","","","0.71073","MoKα","","0.0878","0.0495","","","0.1001","0.1135","","","","","","0.98","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201916","14.1855","0.0003","10.639","0.0002","18.3343","0.0004","90","","102.572","0.0009","90","","2700.66","0.1","150","2","150","2","","","","","","","","3","P 1 21 1","P 2yb","4","heptapivaloyl α,α-trehalose","2,2',3,3',4,6,6'-hepta-O-pivalato-α,α'-trehalose","","- C47 H78 O18 -","- C47 H78 O18 -","- C94 H156 O36 -","2","1","CM6040","Thomas C. Baddeley; Simon M. Clow; Philip J. Cox; Iain G. Davidson; Alison M. Murdoch; James L. Wardell","Disordered 2,2',3,3',4,6,6'-hepta-<i>O</i>-pivaloyl-α,α'-trehalose","Acta Crystallographica Section E","2003","59","6","o753","o755","10.1107/S1600536803009474","","","0.71073","MoKα","","0.0939","0.0782","","","0.2174","0.2337","","","","","","1.032","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201917","11.4236","0.001","10.2623","0.0009","21.899","0.003","90","","90","","90","","2567.3","0.5","295","2","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C11 H14 Cl3 N O -","- C11 H14 Cl3 N O -","- C88 H112 Cl24 N8 O8 -","8","1","CM6041","Kaynak, F. Betül; Özbey, Süheyla; Şenöz, Hülya; Tunoḡlu, Nazan","2-Trichloroacetyl-1-(1-pyrrolidinyl)cyclopentene","Acta Crystallographica Section E","2003","59","6","o833","o835","10.1107/S1600536803010535","","","0.71073","MoKα","","","0.0402","","","","0.1239","","","","","","1.079","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201918","14.9188","0.0009","14.9188","0.0009","17.8355","0.0006","90","","90","","90","","3969.7","0.4","150","2","150","2","","","","","","","","3","P 41 21 2","P 4abw 2nw","92","","4,4'-Di-isobutyroyl-2,2',3,3',6,6'-hexacetyl-α,α'-trehalose","","- C32 H46 O19 -","- C32 H46 O19 -","- C128 H184 O76 -","4","0.5","CM6042","Thomas C. Baddeley; Simon M. Clow; Philip J. Cox; Iain G. Davidson; Clare Ryder; James L. Wardell","Disordered 4,4'-di-<i>O</i>-isobutyroyl-2,2',3,3',6,6'-hex-<i>O</i>-acetyl-α,α'-trehalose","Acta Crystallographica Section E","2003","59","6","o848","o850","10.1107/S1600536803010729","","","0.71073","MoKα","","0.1031","0.0534","","","0.1295","0.1545","","","","","","1.013","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201919","8.4379","0.0008","8.9209","0.0009","9.3312","0.0012","64.02","0.003","63.198","0.002","66.178","0.002","544.62","0.1","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","2-Ethyl-3-hydroxy-1-morpholinepyridin-4(1H)-one","","- C11 H16 N2 O3 -","- C11 H16 N2 O3 -","- C22 H32 N4 O6 -","2","1","CV6160","Andreas Decken; David C. Sample; Brock A. Noseworthy; Christopher M. Vogels; Stephen A. Westcott","2-Ethyl-3-hydroxy-1-morpholinopyridin-4(1<i>H</i>)-one","Acta Crystallographica Section E","2003","59","1","o57","o58","10.1107/S1600536802022894","","","0.71073","MoKα","","0.0653","0.0434","","","0.1072","0.1126","","","","","","0.9","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201920","16.57","0.0008","16.57","","15.3576","0.0007","90","0.01","90","0.01","90","0.01","4216.7","0.3","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Hydrazine carbodithioic acid pyridinium-2-yl methylester chloride","","- C7 H10 Cl N3 S2 -","- C7 H10 Cl N3 S2 -","- C112 H160 Cl16 N48 S32 -","16","1","CV6161","Crouse, Karen A.; Chew, Kar Teng; Yamin, Bohari M.; Ng, Seik Weng; Tarafder, M.T.H.","Hydrazine carbodithioic acid pyridinium-2-yl methyl ester chloride","Acta Crystallographica Section E","2003","59","2","o148","o150","10.1107/S160053680300014X","","","0.71073","MoKα","","0.045","0.037","","","0.094","0.096","","","","","","0.928","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201921","22.184","0.003","6.871","0.001","12.063","0.001","90","","94.39","0.01","90","","1833.3","0.4","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4,4',5,5'-tetramethyltetrathiafulvalene 1,4-dinitrobenzene","","- C16 H16 N2 O4 S4 -","- C16 H16 N2 O4 S4 -","- C64 H64 N8 O16 S16 -","4","0.5","CV6162","Batsanov, Andrei S.; Lyubchik, Svetlana B.","4,4',5,5'-Tetramethyltetrathiafulvalene‒1,4-dinitrobenzene (1/1)","Acta Crystallographica Section E","2003","59","2","o155","o157","10.1107/S1600536803000114","","","0.71073","MoKα","","0.0313","0.0278","","","0.077","0.0791","","","","","","1.154","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201922","18.926","0.004","7.096","0.001","12.45","0.003","90","","105.93","0.02","90","","1607.8","0.6","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","4-iodotetrathiafulvalene‒1,4-dinitrobenzene (1/1)","","- C12 H7 I N2 O4 S4 -","- C12 H7 I N2 O4 S4 -","- C48 H28 I4 N8 O16 S16 -","4","1","CV6163","Batsanov, Andrei S.; Lyubchik, Svetlana B.","4-Iodotetrathiafulvalene‒1,4-dinitrobenzene (1/1)","Acta Crystallographica Section E","2003","59","3","o326","o327","10.1107/S1600536803003064","","","0.71073","MoKα","","0.0872","0.0479","","","0.1034","0.1193","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201923","7.3217","0.0004","8.6557","0.0004","11.4876","0.0006","91.129","0.001","95.179","0.001","108.674","0.001","685.97","0.06","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","[2-[(2-hydroxydiethylammonium)aminomethylene]phenolate]zinc(II)dichloride","","- C11 H16 Cl2 N2 O2 Zn -","- C11 H16 Cl2 N2 O2 Zn -","- C22 H32 Cl4 N4 O4 Zn2 -","2","1","CV6164","Anwar Usman; Hoong-Kun Fun; Suchada Chantrapromma; Hai-Liang Zhu; Qiong-Xin Liu","Dichloro{2-[<i>N</i>-(2-hydroxyethylammonioethyl)iminomethyl]phenolate}zinc(II)","Acta Crystallographica Section E","2003","59","2","o215","o217","10.1107/S1600536803001144","","","0.71073","MoKα","","0.0232","0.0215","","","0.0572","0.0583","","","","","","1.063","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201924","4.0333","0.0001","10.8622","0.0002","21.1608","0.0004","90","","93.9045","0.0007","90","","924.91","0.03","160","2","160","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(4-Bromophenyl)-5-methyl-2,3-dihydro-4H-1,2,4-triazol-3-one","","- C9 H8 Br N3 O -","- C9 H8 Br N3 O -","- C36 H32 Br4 N12 O4 -","4","1","CV6165","Thamotharan. S; Parthasarathi. V; Hunnur, Raveendra, K.; Badami, Bharati; Linden, Anthony","2-(4-Bromophenyl)-5-methyl-2,3-dihydro-4<i>H</i>-1,2,4-triazol-3-one","Acta Crystallographica Section E","2003","59","2","o225","o226","10.1107/S1600536803001363","","","0.71073","MoKα","","0.0511","0.0376","","","0.0866","0.0919","","","","","","1.072","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2201925","4.74","0.001","21.968","0.004","13.858","0.003","90","","94.62","0.03","90","","1438.3","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1H-nicotinamidium 3,5-dinitrosalicylate","1H-nicotinamidium 3,5-dinitrosalicylate","","- C13 H10 N4 O8 -","- C13 H10 N4 O8 -","- C52 H40 N16 O32 -","4","1","CV6166","Koman, Marian; Martiška, Ladislav; Valigura, Dušan; Glowiak, Tadeuš","1<i>H</i>-Nicotinamidium 3,5-dinitrosalicylate","Acta Crystallographica Section E","2003","59","4","o441","o442","10.1107/S1600536803005166","","","1.5418","CuKα","","0.0644","0.0399","","","0.101","0.1099","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201926","10.083","0.0007","23.996","0.0016","10.3082","0.0007","90","","90","","90","","2494.1","0.3","293","2","293","2","","","","","","","","7","C m c a","-C 2ac 2","64","","(1,2-Diaminocyclohexane)silver(I) trifluoromethanesulfonate","","- C7 H14 Ag F3 N2 O3 S -","- C7 H14 Ag F3 N2 O3 S -","- C56 H112 Ag8 F24 N16 O24 S8 -","8","","CV6167","Anwar Usman; Hoong-Kun Fun; Hai-Liang Zhu; Xian-Jiang Wang","(1,2-Diaminocyclohexane)silver(I) trifluoromethanesulfonate","Acta Crystallographica Section E","2003","59","3","m131","m133","10.1107/S160053680300240X","","","0.71073","MoKα","","0.0747","0.065","","","0.156","0.1633","","","","","","1.204","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201927","13.846","0.003","5.9486","0.0014","16.972","0.004","90","","103.311","0.004","90","","1360.3","0.5","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N-para-bromophenyl-N'-benzoylthiourea","","- C14 H11 Br N2 O S -","- C14 H11 Br N2 O S -","- C56 H44 Br4 N8 O4 S4 -","4","1","CV6168","Yamin, Bohari M.; Yusof, M. Sukeri M.","<i>N</i>'-Benzoyl-<i>N</i>-<i>p</i>-bromophenylthiourea","Acta Crystallographica Section E","2003","59","3","o340","o341","10.1107/S1600536803003453","","","0.71073","MoKα","","0.05","0.033","","","0.082","0.091","","","","","","0.91","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201928","5.151","0.002","11.468","0.003","6.555","0.003","90","","92.71","0.01","90","","386.8","0.3","150","1","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H6 N4 S2 -","- C6 H6 N4 S2 -","- C12 H12 N8 S4 -","2","0.5","CV6169","Jia-Geng Liu; Duan-Jun Xu; Chen-Hsiung Hung","2,2'-Diamino-4,4'-bi-1,3-thiazole","Acta Crystallographica Section E","2003","59","3","o312","o313","10.1107/S1600536803002940","","","0.71073","MoKα","","0.037","0.033","","","0.081","0.084","","","","","","1.101","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201929","15.1298","0.0002","16.5875","0.0003","19.1186","0.0004","90","","112.723","0.001","90","","4425.7","0.14","180","2","180","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","[1,1'-Bis(diphenylphosphino)ferrocene-κ^2^P,P'](1,5-cyclo-octadiene)rhodium(I) trifluoromethanesulfonate dichloromethane disolvate","","- C45 H44 Cl4 F3 Fe O3 P2 Rh S -","- C45 H44 Cl4 F3 Fe O3 P2 Rh S -","- C180 H176 Cl16 F12 Fe4 O12 P8 Rh4 S4 -","4","1","CV6170","Jones, Matthew D.; Almeida Paz, Filipe A.; Davies, John E.; Johnson, Brian F. G.","[1,1'-Bis(diphenylphosphino)ferrocene-κ^2^<i>P,P</i>'](1,5-cyclooctadiene)rhodium(I) trifluoromethanesulfonate dichloromethane disolvate","Acta Crystallographica Section E","2003","59","3","m111","m113","10.1107/S1600536803003581","","","0.71073","MoKα","","0.1024","0.0823","","","0.2195","0.2337","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201930","9.1222","0.0002","9.1647","0.0002","20.6053","0.0006","90","","90","","90","","1722.65","0.07","180","2","180","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","(η^3^-allyl)[(S)-(+)-(2-pyrrolidinylmethyl)pyrrolidine]palladium(II) trifluomethanesulfonate","","- C13 H23 F3 N2 O3 Pd S -","- C13 H23 F3 N2 O3 Pd S -","- C52 H92 F12 N8 O12 Pd4 S4 -","4","1","CV6171","Jones, Matthew D.; Almeida Paz, Filipe A.; Davies, John E.; Johnson, Brian F. G.","(η^3^-Allyl)[(<i>S</i>)-(+)-(2-pyrrolidinylmethyl)pyrrolidine]palladium(II) trifluoromethanesulfonate","Acta Crystallographica Section E","2003","59","3","m105","m107","10.1107/S1600536803003507","","","0.71073","MoKα","","0.0484","0.0324","","","0.0639","0.0686","","","","","","1.026","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201931","13.984","0.0003","14.0507","0.0002","15.4152","0.0004","86.201","0.006","84.847","0.007","89.898","0.007","3009.96","0.12","180","2","180","2","","","","","","","","4","P 1","P 1","1","","Tetrabutylammonium 2,6-dihydroxybenzoate 2,6-dihydroxybenzoic acid solvate","","- C30 H47 N O8 -","- C30 H47 N O8 -","- C120 H188 N4 O32 -","4","4","CV6172","Almeida Paz, Filipe A.; Soares-Santos, Paula C. R.; Nogueira, Helena I. S.; Trindade, Tito; Klinowski, Jacek","Tetrabutylammonium 2,6-dihydroxybenzoate 2,6-dihydroxybenzoic acid solvate","Acta Crystallographica Section E","2003","59","4","o506","o508","10.1107/S1600536803004987","","","0.71073","MoKα","","0.0573","0.043","","","0.1044","0.1131","","","","","","1.123","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201932","8.631","0.002","8.041","0.002","16.054","0.003","90","","103.51","0.03","90","","1083.3","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(2-pyridyl)-1H,3H-pyrido[1,2-c]pyrimidine-1,3-dione","","- C13 H9 N3 O2 -","- C13 H9 N3 O2 -","- C52 H36 N12 O8 -","4","1","CV6173","Wolska, Irena; Herold, Franciszek; Maj, Marta","4-(2-Pyridyl)-1<i>H</i>,2<i>H</i>-pyrido[1,2-<i>c</i>]pyrimidine-1,3-dione","Acta Crystallographica Section E","2003","59","4","o511","o513","10.1107/S1600536803004999","","","0.71073","MoKα","","0.0476","0.0441","","","0.1227","0.1271","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201933","6.6133","0.0002","8.0737","0.0002","17.8848","0.0005","77.746","0.001","83.211","0.001","80.169","0.001","916.14","0.04","120","2","120","0.2","","","","","","","","5","P -1","-P 1","2","","Methyl (±)-(1α,2β,8α,9α,10β)-2-chloro-3-oxa- 4-azatetracyclo[8.4.0^2,9^0^4,8^]tetradecane-9-carboxylate oxalic acid monohydrate","","- C16 H24 Cl N O8 -","- C16 H24 Cl N O8 -","- C32 H48 Cl2 N2 O16 -","2","1","CV6174","Yufit, Dmitrii S.; Howard, Judith A. K.; Kozhushkov, Sergei I.; Masini, Silvia; Brandi, Alberto; de Meijere, Armin","Methyl (±)-(1α,2β,8α,9α,10β)-2-chloro-4-aza-3-oxatetracyclo[8.4.0.0^2,9^.0^4,8^]tetradecane-9-carboxylate oxalic acid monohydrate","Acta Crystallographica Section E","2003","59","4","o572","o573","10.1107/S1600536803004860","","","0.71073","MoKα","","0.0461","0.033","","","0.0783","0.085","","","","","","1.017","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201934","9.1516","0.0001","21.266","0.0001","12.9498","0.0001","90","","109.154","0.002","90","","2380.74","0.04","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H24 Cu N12 O4 -","- C17 H24 Cu N12 O4 -","- C68 H96 Cu4 N48 O16 -","4","1","CV6175","Díaz, Jesús García; Kožíšek, Jozef; Langer, Vratislav","Bis(cyanamidonitrato-κ<i>N</i>)[tris(3,5-dimethylpyrazole)copper(II)","Acta Crystallographica Section E","2003","59","5","m241","m243","10.1107/S1600536803007761","","","0.71073","MoKα","","0.0563","0.0436","","","0.1122","0.1213","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201935","10.746","0.001","14.319","0.001","10.998","0.001","90","","93.52","0.01","90","","1689.1","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 3-(1-benzoyl-3-phenylaziridin-2-yl)propenoate","","- C20 H19 N O3 -","- C20 H19 N O3 -","- C80 H76 N4 O12 -","4","1","CV6177","Batsanov, Andrei S.; Dutton, William M.; Steel, Patrick G.; Aldous, David J.","Ethyl 3-(1-benzoyl-3-phenylaziridin-2-yl)propenoate","Acta Crystallographica Section E","2003","59","4","o509","o510","10.1107/S1600536803005981","","","0.71073","MoKα","","0.0699","0.0422","","","0.0833","0.0973","","","","","","1.092","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201936","11.2399","0.0005","14.7231","0.0007","19.6858","0.0009","90","","105.754","0.001","90","","3135.4","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(1,2-diphenyl-2-oxo-ethylidene)benzenamine N-oxide","","- C20 H15 N O2 -","- C20 H15 N O2 -","- C160 H120 N8 O16 -","8","2","CV6179","Anwar Usman; Hoong-Kun Fun; Hua-You Hu; Jian-Hua Xu","<i>N</i>-(1,2-Diphenyl-2-oxoethylidene)benzenamine <i>N</i>-oxide","Acta Crystallographica Section E","2003","59","5","o612","o613","10.1107/S160053680300744X","","","0.71073","MoKα","","0.0712","0.0449","","","0.1072","0.1246","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201937","10.52","0.002","14.02","0.003","11.146","0.003","90","","115.02","0.01","90","","1489.7","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Indolylformaldehyde isonicotinoylhydrazone monomethanol","","- C16 H16 N4 O2 -","- C16 H16 N4 O2 -","- C64 H64 N16 O8 -","4","1","CV6180","Xi-Shi Tai; Xian-Hong Yin; Min-Yu Tan; Yi-Zhi Li","3-Indolylformaldehyde isonicotinoylhydrazone methanol solvate","Acta Crystallographica Section E","2003","59","5","o681","o682","10.1107/S1600536803008286","","","0.71073","MoKα","","0.0591","0.0404","","","0.102","0.1071","","","","","","0.961","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201938","7.716","0.004","7.564","0.006","30.037","0.003","90","","95.97","0.02","90","","1743.6","1.7","296.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H14 N2 O5 Zn -","- C20 H14 N2 O5 Zn -","- C80 H56 N8 O20 Zn4 -","4","1","CV6181","Okabe, Nobuo; Muranishi, Yasunori","Aquabis(quinoline-2-carboxylato-κ^2^<i>N,O</i>)zinc(II)","Acta Crystallographica Section E","2003","59","5","m244","m246","10.1107/S1600536803007840","","","0.7107","MoKα","","","0.049","","","","0.1704","","","","","","0.893","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201939","4.631","0.005","11.068","0.005","17.487","0.008","90","","90","","90","","896.3","1.1","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(Z)-Azulene-1-carboxaldehyde oxime","","- C11 H9 N O -","- C11 H9 N O -","- C44 H36 N4 O4 -","4","1","CV6182","Kedziorek Mariusz; Hafner, Klaus; Lindner, Hans J.","(<i>Z</i>)-Azulene-1-carboxaldehyde oxime","Acta Crystallographica Section E","2003","59","5","o657","o658","10.1107/S1600536803008146","","","0.71073","MoKα","","0.1843","0.0582","","","0.1165","0.1568","","","","","","0.925","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201940","33.51","0.009","12.419","0.005","32.946","0.009","90","","95.152","0.008","90","","13655","8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4,11-Bis(4-chlorophenyl)-3,10-bis(2,6-dichlorophenyl)-1,8-dioxa-2,9- diazadispiro[4.1.4.4]pentadeca-2,9-dien-6-one","","- C35 H24 Cl6 N2 O3 -","- C35 H24 Cl6 N2 O3 -","- C560 H384 Cl96 N32 O48 -","16","2","CV6183","Li, Xiao-Fang; Feng, Ya-Qing; Hu Xiao-Fen; Xu Mian","4,11-Bis(4-chlorophenyl)-3,10-bis(2,6-dichlorophenyl)-1,8-dioxa-2,9-diazadispiro[4.1.4.4]pentadeca-2,9-dien-6-one","Acta Crystallographica Section E","2003","59","5","o716","o717","10.1107/S1600536803008535","","","0.71073","MoKα","","0.189","0.065","","","","0.0986","","","","","","0.969","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201941","20.791","0.007","7.606","0.003","13.484","0.005","90","","90.685","0.005","90","","2132.2","1.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-Benzyl-7,7-dimethyl-9-phenyl-1-thia-3-aza-7-azoniaspiro[4.4]nonane-2,4-dione iodide","","- C21 H23 I N2 O2 S -","- C21 H23 I N2 O2 S -","- C84 H92 I4 N8 O8 S4 -","4","1","CV6184","Li, Xiao-Fang; Feng, Ya-Qing; You, Xu-Dong; Xu, Mian","3-Benzyl-7,7-dimethyl-9-phenyl-1-thia-3-aza-7-azoniaspiro[4.4]nonane-2,4-dione iodide","Acta Crystallographica Section E","2003","59","5","o677","o678","10.1107/S1600536803008298","","","0.71073","MoKα","","0.0757","0.0388","","","","0.1035","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201942","12.167","0.002","12.487","0.002","17.04","0.002","102.85","0.02","90.28","0.01","116.39","0.02","2245","0.8","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H42 Co N6 O16 -","- C48 H42 Co N6 O16 -","- C96 H84 Co2 N12 O32 -","2","1","CV6185","Yu Liu; Duan-Jun Xu; Chen-Hsiung Hung","Tris(phenanthroline-κ^2^<i>N,N</i>')cobalt(II) fumarate fumaric acid tetrahydrate","Acta Crystallographica Section E","2003","59","5","m297","m299","10.1107/S1600536803009024","","","0.71069","MoKα","","0.099","0.052","","","0.114","0.135","","","","","","0.858","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201943","8.3475","0.0004","11.8671","0.0006","11.9106","0.0006","74.148","0.001","89.736","0.001","72.344","0.001","1077.59","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4',5a'-Diphenyl-10-oxospiro[phenanthrene[9,2']oxeto[5,4-b]oxazole]","","- C29 H19 N O3 -","- C29 H19 N O3 -","- C58 H38 N2 O6 -","2","1","CV6186","Lei Wang; Anwar Usman; Hoong-Kun Fun; Yan Zhang; Jian-Hua Xu","4',5a'-Diphenyl-10-oxospiro[phenanthrene[9,2']oxeto[5,4-<i>b</i>]oxazole]","Acta Crystallographica Section E","2003","59","5","o721","o722","10.1107/S1600536803008857","","","0.71073","MoKα","","0.0498","0.042","","","0.1075","0.1168","","","","","","1.077","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201944","8.2974","0.0007","8.8446","0.0006","15.789","0.001","95.743","0.004","102.49","0.002","97.897","0.004","1110.42","0.14","93.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H40 Na4 O30 S8 -","- C24 H40 Na4 O30 S8 -","- C24 H40 Na4 O30 S8 -","1","0.5","CV6187","Akashi, Haruo; Yamauchi, Tsutomu","Tetrasodium tetrahydroxytetrathiacalix[4]arenetetrasulfonate tetradecahydrate","Acta Crystallographica Section E","2003","59","6","m336","m338","10.1107/S1600536803009784","","","0.7107","MoKα","","","0.031","","","","0.091","","","","","","0.844","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201945","11.905","0.018","12.046","0.017","15.17","0.02","87.89","0.03","81.2","0.03","70.2","0.03","2023","5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","13-Benzyl-3,10-bis-(2,6-dichloro-phenyl)-4,11-diphenyl -1,8-dioxa-2,9,13-triaza-dispiro[4.1.4.3] tetradeca-2,9-dien-6-one","","- C41 H30 Cl7 N3 O3 -","- C41 H30 Cl7 N3 O3 -","- C82 H60 Cl14 N6 O6 -","2","1","CV6189","Li, Xiao-Fang; Feng, Ya-Qing; Hu, Xiao-Fen; Xu, Mian","13-Benzyl-3,10-bis(2,6-dichlorophenyl)-4,11-diphenyl-1,8-dioxa-2,9,13-triazadispiro[4.1.4.3]tetradeca-2,9-dien-6-one chloroform solvate","Acta Crystallographica Section E","2003","59","6","o797","o798","10.1107/S1600536803009516","","","0.71073","MoKα","","0.1493","0.0638","","","","0.1958","","","","","","1.065","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2201946","15.456","0.0019","6.2183","0.0007","14.8165","0.0018","90","","108.347","0.002","90","","1351.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(p-Fluorobenzylamino)-3-phenyl-4,5-dihydro-1H-1,2,4-triazol-5-one","","- C15 H13 F N4 O -","- C15 H13 F N4 O -","- C60 H52 F4 N16 O4 -","4","1","CV6190","Şamil Işık; Kahveci, Bahattin; Erbil Ag̃ar; Selami Şaşmaz; Vázquez-López, Ezequiel M.","4-(<i>p</i>-Fluorobenzylamino)-3-phenyl-4,5-dihydro-1<i>H</i>-1,2,4-triazol-5-one","Acta Crystallographica Section E","2003","59","6","o804","o805","10.1107/S1600536803010109","","","0.71073","MoKα","","0.1652","0.0432","","","0.0708","0.0885","","","","","","0.749","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201947","14.7949","0.0019","7.7004","0.001","13.9577","0.0018","90","","117.705","0.002","90","","1407.8","0.3","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(N-Benzoyl-hydrazinocarbothioyl)-benzamide","","- C15 H13 N3 O2 S -","- C15 H13 N3 O2 S -","- C60 H52 N12 O8 S4 -","4","1","CV6191","M. Sukeri M. Yusof; Bohari M. Yamin; Mustaffa Shamsudin","<i>N</i>-(<i>N</i>-Benzoylhydrazinocarbothioyl)benzamide","Acta Crystallographica Section E","2003","59","6","o810","o811","10.1107/S1600536803010110","","","0.71073","MoKα","","0.097","0.057","","","0.118","0.133","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201948","8.948","0.005","11.254","0.005","13.724","0.005","110.167","0.005","93.755","0.005","90.106","0.005","1294.1","1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2(R)-Hydroxy-4-(4-methoxybenzoyl)-2-methoxycarbonylmethyl-5-(4-methoxyphenyl)- 1-(2-methylphenyl)-2,3-dihydro-1H-3-pyrrolone","","- C29 H27 N O7 -","- C29 H27 N O7 -","- C58 H54 N2 O14 -","2","1","CV6194","Sema Öztürk; Mustafa Saçmacı; Hakan Üngören; Mehmet Akkurt; Hoong-Kun Fun; Yunus Akçamur","2(<i>R</i>)-Hydroxy-4-(4-methoxybenzoyl)-2-methoxycarbonylmethyl-5-(4-methoxyphenyl)-1-(2-methylphenyl)-2,3-dihydro-1<i>H</i>-3-pyrrolone","Acta Crystallographica Section E","2003","59","6","o881","o882","10.1107/S1600536803011012","","","0.71073","MoKα","","0.1373","0.0778","","","0.2047","0.2571","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201949","12.0961","0.0008","4.775","0.0004","15.3516","0.0012","90","","97.719","0.003","90","","878.66","0.12","160","2","160","2","","","","","","","","4","P 1 21 1","P 2yb","4","","3-(4-Methoxyphenyl)-4-(4-phenyl-1,3-butadienoyl)sydnone","","- C20 H16 N2 O4 -","- C20 H16 N2 O4 -","- C40 H32 N4 O8 -","2","1","CV6197","Thamotharan, S.; Parthasarathi, V.; Sanyal, R.; Badami, Bharati; Linden, Anthony","3-(4-Methoxyphenyl)-4-(5-phenyl-2,4-pentadienoyl)sydnone","Acta Crystallographica Section E","2003","59","6","o894","o896","10.1107/S1600536803011309","","","0.71073","MoKα","","0.0603","0.0444","","","0.1091","0.1195","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201950","12.6392","0.0006","5.147","0.0002","22.545","0.0001","90","","107.744","0.003","90","","1396.87","0.09","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","[2-(tertbutylcarbonylmethyl-amino]-phenyl)acetic acid","","- C14 H19 N O4 -","- C14 H19 N O4 -","- C56 H76 N4 O16 -","4","1","DN6044","Nicolas Raynal; Muriel Amblard; Jean Martinez; Marc Rolland","[2-(<i>tert</i>-Butylcarbonylmethylamino)phenyl]acetic acid","Acta Crystallographica Section E","2003","59","1","o4","o6","10.1107/S1600536802021074","","","0.71073","MoKα","","0.0589","0.0503","","","0.1209","0.1281","","","","","","1.046","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201951","16.359","0.0003","6.254","0.0002","19.456","0.0003","90","0.03","109.238","0.001","90","0.03","1879.37","0.08","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Bis L-valinium monohydrogenphosphite","","","- C10 H28 N2 O10 P2 -","- C10 H28 N2 O10 P2 -","- C40 H112 N8 O40 P8 -","4","1","DN6046","Bendheif, Leulmi; Benali-Cherif, Nourredine; Benguedouar, Lamia; Bouchouit, Karim; Merazig, Hocine","<small>L</small>-Valinium hydrogenphosphite","Acta Crystallographica Section E","2003","59","2","o141","o142","10.1107/S1600536803000795","","","0.71073","MoKα","","0.0434","0.0376","","","0.0953","0.0997","","","","","","1.057","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201952","6.3348","0.0008","7.697","0.001","13.9423","0.0018","99.03","0.002","92.142","0.002","97.528","0.003","664.43","0.15","130","0.2","130","0.2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H16 N2 O4 -","- C13 H16 N2 O4 -","- C26 H32 N4 O8 -","2","1","DN6047","Laura Andrau; Jonathan White","<i>N</i>-Methyl-4-piperidyl <i>p</i>-nitrobenzoate at 130K","Acta Crystallographica Section E","2003","59","1","o77","o79","10.1107/S1600536802022407","","","0.71073","MoKα","","0.06","0.0413","","","0.0902","0.0968","","","","","","0.877","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201953","10.4058","0.0011","6.1448","0.0007","12.9773","0.0014","90","","110.835","0.002","90","","775.53","0.15","130","0.2","130","0.2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C21 H18 Fe2 O -","- C21 H18 Fe2 O -","- C42 H36 Fe4 O2 -","2","0.5","DN6048","Natalie Bratych; Kathryn Hassall; Jonathan White","Redetermination of the structure of diferrocenyl ketone at low temperature","Acta Crystallographica Section E","2003","59","1","m33","m35","10.1107/S1600536802022262","","","0.71073","MoKα","","0.0365","0.0341","","","0.0924","0.0941","","","","","","1.023","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201954","9.2793","0.0002","9.4256","0.0002","20.639","0.0008","84.713","0.001","80.583","0.001","69.21","0.001","1663.73","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H18 Cl N3 O -","- C19 H18 Cl N3 O -","- C76 H72 Cl4 N12 O4 -","4","2","DN6049","Benelbaghdadi, R.; Hasnaoui, R. A.; Lavergne, J. P.; Ait Itto, M.; Pierrot, M.","(<i>Z</i>)-7-Chloro-3-(diméthylaminométhylène)-1-méthyl-5-phényl-1,3-dihydro-2<i>H</i>-[1,4]benzodiazépin-2-one","Acta Crystallographica Section E","2003","59","2","o143","o144","10.1107/S160053680202353X","","","0.71073","MoKα","","0.0523","0.0457","","","0.1092","0.1143","","","","","","1.046","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201955","8.923","0.002","6.082","0.002","19.828","0.005","90","","93.29","0.02","90","","1074.3","0.5","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H28 S6 -","- C16 H28 S6 -","- C32 H56 S12 -","2","0.5","DN6050","Durif, André; Mahjoub, Ahmed; Zantour, Hédi; Masson, Serge; Saquet, Monique; Averbuch-Pouchot, Marie-Thérése","A dithietane of 2-methylpropanedithioic acid","Acta Crystallographica Section E","2003","59","4","o545","o546","10.1107/S1600536803003167","","","0.7107","MoKα","","0.0375","0.0375","","0.0614","","0.0614","","","1.485","","","1.485","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201956","9.263","0.005","11.588","0.005","15.784","0.003","93.971","0.002","100.923","0.005","111.959","0.005","1524.5","1.1","293","","293","2","","","","","","","","6","P -1","-P 1","2","Undecacarbonyl(μ~4~-2-thiodithiobenzoato- κ^4^C,S,S',S'')(trimethylphosphite)tetrafer","","","- C21 H13 Fe4 O14 P S3 -","- C21 H13 Fe4 O14 P S3 -","- C42 H26 Fe8 O28 P2 S6 -","2","1","DN6051","Laifa El Adoui; Nourredine Benali-Cherif; Hocine Merazig","Undecacarbonyl(μ~4~-2-thiodithiobenzoato-κ^4^C,<i>S,S</i>',<i>S</i>'')(trimethylphosphite)tetrafer","Acta Crystallographica Section E","2003","59","3","m108","m110","10.1107/S1600536803003052","","","0.71073","MoKα","","0.0477","0.0333","","","0.0925","0.0969","","","","","","1.063","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2201957","8.994","0.0003","10.202","0.0002","11.044","0.0003","90","","106.04","0.02","90","","973.91","0.11","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Guaninium sulfate monohydrate","","","- C5 H9 N5 O6 S -","- C5 H9 N5 O6 S -","- C20 H36 N20 O24 S4 -","4","1","DN6052","Cherouana, Aouatef; Benali-Cherif, Nourredine; Bendjeddou, Lamia","Guaninium sulfate monohydrate","Acta Crystallographica Section E","2003","59","2","o180","o182","10.1107/S1600536803000953","","","0.71073","MoKα","","0.0372","0.0315","","","0.0782","0.0814","","","","","","1.114","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201958","9.725","0.005","17.954","0.005","22.885","0.005","90","","98.488","0.005","90","","3952","2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Undecacarbonyl(μ~4~-2-thiodithiobenzoato- κ^4^C,S,S',S'')(triphenylphosphine)tetrairon","","","- C36 H19 Fe4 O11 P S3 -","- C36 H19 Fe4 O11 P S3 -","- C144 H76 Fe16 O44 P4 S12 -","4","1","DN6053","Laifa, El Adoui; Benali-Cherif, Nourredine; Berrah, Fadila","Undecacarbonyl(μ~4~-2-thiodithiobenzoato- κ^4^C,<i>S,S</i>',S'')(triphenylphosphine)tetrafer","Acta Crystallographica Section E","2003","59","2","m80","m82","10.1107/S1600536803001545","","","0.71073","MoKα","","0.1107","0.0375","","","0.0457","0.0548","","","","","","0.802","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2201959","6.91","0.003","7.5682","0.001","12.38","0.003","93.13","0.02","98.2","0.02","95.86","0.02","635.9","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-Acetyl-3-methyl-4-(P-chlorobenzylidenamino)-4,5-dihydro- 1H-1,2,4-triazol-5-one","","- C12 H11 Cl N4 O2 -","- C12 H11 Cl N4 O2 -","- C24 H22 Cl2 N8 O4 -","2","1","DN6057","Çoruh, Ufuk; Kahveci, Bahittin; Şaşmaz, Selami; Ag̃ar, Erbil; Youngme Kim","1-Acetyl-4-(<i>p</i>-chlorobenzylideneamino)-3-methyl-4,5-dihydro-1<i>H</i>-1,2,4-triazol-5-one","Acta Crystallographica Section E","2003","59","4","o530","o532","10.1107/S1600536803005129","","","0.71073","MoKα","","0.099","0.0414","","","0.1035","0.1211","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201960","15.4338","0.0004","8.2487","0.0002","13.8748","0.0003","90","","92.7699","0.0008","90","","1764.32","0.07","150","","150","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 N2 -","- C22 H24 N2 -","- C88 H96 N8 -","4","1","DN6058","Gouin, Sebastien G.; Gestin, Jean-François; Meslin, Jean Claude; Deniaud, David; Evain, Michel","8,10-Dibenzylimidazonorbornylene","Acta Crystallographica Section E","2003","59","4","o401","o402","10.1107/S1600536803004501","","","0.71069","MoKα","","0.1016","0.0591","","","0.1328","0.147","","","","","","1.45","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201961","5.0886","0.0002","9.3338","0.0007","10.1159","0.0007","103.904","0.003","95.153","0.005","98.779","0.005","456.9","0.05","223","2","223","2","","","","","","","","5","P -1","-P 1","2","m-carboxyphenylammonium perchlorate","","","- C7 H8 Cl N O6 -","- C7 H8 Cl N O6 -","- C14 H16 Cl2 N2 O12 -","2","1","DN6059","Bendjeddou, Lamia; Cherouana, Aouatef; Berrah, Fadila; Benali-Cherif, Nourredine","(<i>m</i>-Carboxyphenyl)ammonium perchlorate at 223K","Acta Crystallographica Section E","2003","59","4","o574","o576","10.1107/S1600536803006457","","","0.71073","MoKα","","0.0396","0.0359","","","0.1262","0.1398","","","","","","1.267","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201962","13.778","0.001","8.0216","0.0009","15.595","0.001","90","","98.44","0.01","90","","1704.9","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- K2 Mo O9 P2 -","- K2 Mo O9 P2 -","- K16 Mo8 O72 P16 -","8","1","","Zid, Mohamed Faouzi; Driss, Ahmed; Jouini, Tahar","K~2~MoO~2~P~2~O~7~","Acta Crystallographica, Section E","2003","59","","i65","i67","10.1107/S1600536803007001","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2201963","8.069","0.001","6.322","0.002","23.512","0.003","90","","93.38","0.02","90","","1197.3","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","7-nitro-2-phenyl-1,2-benzisoselenazol-3(2H)-one","","- C13 H8 N2 O3 Se -","- C13 H8 N2 O3 Se -","- C52 H32 N8 O12 Se4 -","4","1","DN6061","Dupont, Léon; Messali, Mouslim; Christiaens, Léon","Monoclinic form of 7-nitro-2-phenyl-1,2-benzisoselenazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2003","59","4","o547","o549","10.1107/S1600536803006433","","","1.5418","CuKα","","0.0647","0.0538","","","0.1382","0.1448","","","","","","0.988","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201964","7.605","0.003","10.288","0.004","10.568","0.004","78.311","0.006","70.6","0.006","77.163","0.006","752.9","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C11 H14 Cl N2 O2 P S2 -","- C11 H14 Cl N2 O2 P S2 -","- C22 H28 Cl2 N4 O4 P2 S4 -","2","1","DN6062","Shi, Bojie; Chen, Ruyu; Huang, You","Diethyl [(6-chlorobenzothiazol-2-yl)amino]thiophosphate","Acta Crystallographica Section E","2003","59","6","o870","o872","10.1107/S1600536803008237","","","0.71073","MoKα","","0.0638","0.0431","","","0.1007","0.1124","","","","","","1.018","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201965","12.024","0.001","13.624","0.001","18.08","0.002","90","","92.905","0.005","90","","2958","0.5","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C9 H14 N4 -","- C9 H14 N4 -","- C108 H168 N48 -","12","3","DN6063","Dakir, M.; Auhmani, A.; Akssira, M.; Benharref, A.; Pierrot, M.","6,6,8-Triméthyl-6,7-dihydro-5<i>H</i>-tétrazolo[1,5-<i>a</i>]azepine","Acta Crystallographica Section E","2003","59","5","o643","o645","10.1107/S1600536803007785","","","0.71073","MoKα","","0.1485","0.0975","","","0.1329","0.1487","","","","","","1.184","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201966","7.7777","0.0002","8.5114","0.0002","11.0871","0.0003","88.703","0.002","70.074","0.002","64.789","0.002","617.78","0.03","120","","120","","","","","","","","","5","P -1","-P 1","2","diprotonated adeninium diperchlorate hydrate","","","- C5 H9 Cl2 N5 O9 -","- C5 H9 Cl2 N5 O9 -","- C10 H18 Cl4 N10 O18 -","2","1","DN6064","Bendjeddou, Lamia; Cherouana, Aouatef; Dahaoui, Slimane; Benali-Cherif, Nourredine; Lecomte, Claude","Diprotonated adeninium diperchlorate hydrate at 120K","Acta Crystallographica Section E","2003","59","5","o649","o651","10.1107/S1600536803007906","","","0.71073","MoKα","","0.053","0.0355","","","0.1002","0.1051","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201967","9.2941","0.0001","9.7513","0.0002","17.851","0.0003","90","","90","","90","","1617.83","0.05","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C17 H14 Cl2 N2 S -","- C17 H14 Cl2 N2 S -","- C68 H56 Cl8 N8 S4 -","4","1","DN6065","El Hazazi, S.; Baouid, S.; Hasnaoui, A.; Pierrot, M.","1,1-Dichloro-3-méthylthio-1a-phényl-1,1a,2,9-tétrahydroaziridino[2,1-<i>d</i>][1,5]benzodiazépine","Acta Crystallographica Section E","2003","59","5","o713","o715","10.1107/S1600536803008882","","","0.71073","MoKα","","0.0235","0.0228","","","0.0572","0.0581","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201968","7.1863","0.0006","8.5173","0.0007","9.8959","0.0007","92.088","0.001","91.424","0.001","90.548","0.001","605.08","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Hexaaquabis(4-hydroxyisophthalato)cobalt(II) tetrahydrate","","- C16 H30 Co O20 -","- C16 H30 Co O20 -","- C16 H30 Co O20 -","1","0.5","DN6066","Li, Xing; Bi, Wenhua; Yuan Daqiang; Zhou Youfu; Cao, Rong","Hexaaquacobalt(II) bis(4-hydroxyisophthalate) tetrahydrate","Acta Crystallographica Section E","2003","59","5","m294","m296","10.1107/S1600536803008894","","","0.71073","MoKα","","0.0411","0.0351","","","0.0909","0.0953","","","","","","1.066","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201969","16.439","0.0002","8.999","0.0003","23.975","0.0002","90","","96.529","0.003","90","","3523.73","0.13","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Decacarbonyl(μ~4~-2-thiodithiobenzoato- κ^4^C,S,S',S'')bis(trimethyl phosphite)tetrafer","","","- C23 H22 Fe4 O16 P2 S3 -","- C23 H22 Fe4 O16 P2 S3 -","- C92 H88 Fe16 O64 P8 S12 -","4","1","DN6067","Laifa, El Adoui; Benali-Cherif, Nourredine","Decacarbonyl(μ~4~-2-thiodithiobenzoato- κ^4^C,<i>S,S</i>',<i>S</i>'')bis(trimethyl phosphite)tetrafer","Acta Crystallographica Section E","2003","59","5","m283","m285","10.1107/S1600536803008638","","","0.71073","MoKα","","0.0496","0.0291","","","0.0689","0.0758","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201970","17.502","0.002","10.777","0.001","16.092","0.002","90","","90.959","0.002","90","","3034.8","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tris(2,2'-bipyridine)nickel(II) bis(perchlorate)","","- C30 H24 Cl2 N6 Ni O8 -","- C30 H24 Cl2 N6 Ni O8 -","- C120 H96 Cl8 N24 Ni4 O32 -","4","0.5","DN6068","Youfu Zhou; Xing Li; Yanqing Xu; Rong Cao; Maochun Hong","Tris(2,2'-bipyridine)nickel(II) diperchlorate","Acta Crystallographica Section E","2003","59","5","m300","m302","10.1107/S1600536803008778","","","0.71073","MoKα","","0.0824","0.0576","","","0.1246","0.1417","","","","","","1.079","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201971","10.187","0.002","10.187","0.002","15.497","0.003","90","","90","","90","","1608.2","0.5","293","2","293","2","","","","","","","","5","P 4/n n c :2","-P 4a 2bc","126","","sodium cerium dihydrogenphosphate monohydrate","","- Ce0.1133 H4 Na0.66 O5 P -","- Ce0.11325 H2 Na0.66 O5 P -","- Ce1.812 H32 Na10.56 O80 P16 -","16","1","DN6069","Ben Zarkouna, Emna; Zid, Mohamed Faouzi; Driss, Ahmed","Na~0.6601~Ce~0.1133~(H~2~PO~4~)·H~2~O","Acta Crystallographica Section E","2003","59","6","i92","i94","10.1107/S1600536803010791","","","0.71069","MoKα","","0.0256","0.0245","","","0.067","0.0677","","","","","","1.175","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201972","15.6069","0.0002","9.5596","0.0002","10.5265","0.0002","90","","107.187","0.002","90","","1500.38","0.05","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(3E)-3-[(4-butylphenyl)imino]-1,3-dihydro-2H-indol-2-one","","- C18 H18 N2 O -","- C18 H18 N2 O -","- C72 H72 N8 O4 -","4","1","DN6070","Mehmet Akkurt; Sema Öztürk; Ayşe Erçağ; Mahmure Üstün Özgür; Frank W. Heinemann","(3<i>E</i>)-3-[(4-Butylphenyl)imino]-1,3-dihydro-2<i>H</i>-indol-2-one","Acta Crystallographica Section E","2003","59","6","o780","o782","10.1107/S160053680300953X","","","0.71073","MoKα","","0.0946","0.0492","","","0.1094","0.1279","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201973","12.2242","0.0003","12.2242","0.0003","8.4655","0.0003","90","","90","","90","","1265.01","0.06","220","2","220","2","","","","","","","","3","I -4","I -4","82","Pentaerythritol tetraphenyl ether","1,3-diphenoxy-2,2-bis(phenoxymethyl)propane","","- C29 H28 O4 -","- C29 H28 O4 -","- C58 H56 O8 -","2","0.25","DN6071","Laliberté, Dominic; Maris, Thierry; Wuest, James D.","1,3-Diphenoxy-2,2-bis(phenoxymethyl)propane","Acta Crystallographica Section E","2003","59","6","o799","o801","10.1107/S160053680300998X","","","1.54178","CuKα","","0.0513","0.0501","","","0.1396","0.1411","","","","","","1.076","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201974","6.477","0.005","7.769","0.005","11.675","0.012","98.04","0.07","100.5","0.07","112.71","0.05","518.4","0.8","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C9 H13 N O5 -","- C9 H13 N O5 -","- C18 H26 N2 O10 -","2","1","DN6072","Blake, Alexander J.; McNab, Hamish; Withell, Kirsti","2,2-Dimethyl-5-(<i>N</i>-methyl-<i>N</i>-methoxyaminomethylene)-1,3-dioxane-4,6-dione","Acta Crystallographica Section E","2003","59","6","o841","o842","10.1107/S1600536803010432","","","0.71073","MoKα","","0.0603","0.0435","","","0.1055","0.1193","","","","","","1.12","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201975","9.797","0.005","12.552","0.005","14.087","0.005","90","0.005","94.357","0.005","90","0.005","1727.3","1.3","293","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H42 Cl2 P2 Pd -","- C36 H42 Cl2 P2 Pd -","- C72 H84 Cl4 P4 Pd2 -","2","0.5","FL6010","Anna M. M. Meij; Alfred Muller; Andreas Roodt","<i>trans</i>-Dichlorobis(cyclohexyldiphenylphosphine)palladium(II)","Acta Crystallographica Section E","2003","59","1","m44","m45","10.1107/S1600536802022924","","","0.71069","MoKα","","","0.0417","","","","0.1055","","","","","","0.945","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201976","11.1981","0.0014","8.4864","0.0015","23.853","0.003","90","","90","","90","","2266.8","0.6","142","2","142","2","","","","","","","","3","P n a 21","P 2c -2n","33","","2-cyclopentyl-2-hydroxy-2-phenylacetic acid","","- C13 H16 O3 -","- C13 H16 O3 -","- C104 H128 O24 -","8","2","FL6011","Bats, Jan W.; Walter, Martin; Noe, Christian R.","2-Cyclopentyl-2-hydroxy-2-phenylacetic acid, a pseudosymmetric crystal structure with space group <i>Pna</i>2~1~ and <i>Z</i>' = 2","Acta Crystallographica Section E","2003","59","1","o72","o74","10.1107/S1600536802022961","","","0.71073","MoKα","","0.0396","0.0356","","","0.0956","0.0986","","","","","","1.081","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201977","6.6088","0.001","7.5837","0.0012","34.71","0.005","90","","90","","90","","1739.6","0.5","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","N-phenethylbiguanidium tetrachlorozinc(II)","N-phenethylbiguanidium tetrachlorozinc(II)","","- C10 H17 Cl4 N5 Zn -","- C10 H17 Cl4 N5 Zn -","- C40 H68 Cl16 N20 Zn4 -","4","1","FL6012","Zhu, Miaoli; Yang, Pin; Lu, Liping","<i>N</i>-Phenethylbiguanidium tetrachlorozincate(II)","Acta Crystallographica Section E","2003","59","2","m91","m94","10.1107/S1600536803001557","","","0.71073","MoKα","","0.0333","0.031","","","0.0623","0.0633","","","","","","1.042","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201978","13.612","0.003","5.8536","0.0011","16.9","0.003","90","","112.63","0.01","90","","1242.9","0.4","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","none","(3, 3-dephenoxy-cyclohexyl)-phosphonic acid diphenyl ester","","- C30 H29 O5 P -","- C30 H29 O5 P -","- C60 H58 O10 P2 -","2","1","FL6013","Ilia A. Guzei; Robert Stockland Jr.; Trevor W. Tennis","Diphenyl (3,3-diphenoxycyclohexyl)phosphonate","Acta Crystallographica Section E","2003","59","2","o129","o131","10.1107/S160053680202370X","","","0.71073","MoKα","","0.0842","0.069","","","0.1604","0.1648","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201979","8.7002","0.0009","22.6624","0.0015","9.9711","0.0008","90","","106.01","0.007","90","","1889.7","0.3","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","(Piperidine-κN)[N-(salicylidene)phenylalaninato-κ^3^O,N,O']copper(II)","","- C21 H24 Cu N2 O3 -","- C21 H24 Cu N2 O3 -","- C84 H96 Cu4 N8 O12 -","4","1","FL6014","Butcher, Ray J.; Mockler, Garry M.; McKern, Owen","(Piperidine-κ<i>N</i>)[<i>N</i>-(salicylidene)phenylalaninato-κ^3^<i>O,N,O</i>']copper(II)","Acta Crystallographica Section E","2003","59","2","m61","m63","10.1107/S1600536803000710","","","0.71073","MoKα","","0.0532","0.0355","","","0.0744","0.0819","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201980","9.455","0.009","6.731","0.006","13.399","0.012","90","","97.002","0.015","90","","846.4","1.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dichloro(N,N-dimethylethylenediamine}cadmium(II)","","- C4 H12 Cd Cl2 N2 -","- C4 H12 Cd Cl2 N2 -","- C16 H48 Cd4 Cl8 N8 -","4","1","FL6015","Bian, He-Dong; Gu, Wen; Yan, Shi-Ping; Liao, Dai-Zheng; Jiang, Zong-Hui","Dichloro(<i>N,N</i>-dimethylethylenediamine)cadmium(II): a novel two-dimensional chloro-bridged coordination polymer","Acta Crystallographica Section E","2003","59","3","m122","m124","10.1107/S1600536803003556","","","0.71073","MoKα","","0.0651","0.0459","","","0.1128","0.1245","","","","","","1.096","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201981","13.583","0.003","7.6515","0.0014","23.399","0.005","90","","100.093","0.011","90","","2394.2","0.9","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,4-bis(phenylethynyl)-4-phenyl-1-(4-nitrophenyl)butadiene","","- C32 H21 N O2 -","- C32 H21 N O2 -","- C128 H84 N4 O8 -","4","1","FL6016","Kaafarani, Bilal R.; Wex, Brigitte; Oliver, Allen G.; Krause Bauer, Jeanette A.; Neckers, Douglas C.","π‒π-Stacking and nitro‒π-stacking interactions of 1-(4-nitrophenyl)-4-phenyl-2,4-bis(phenylethynyl)butadiene","Acta Crystallographica Section E","2003","59","2","o227","o229","10.1107/S1600536803001569","","","0.885","synchrotron","","0.0821","0.0587","","","0.143","0.1559","","","","","","1.074","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201982","22.775","0.004","5.381","0.001","10.587","0.002","90","","90","","90","","1297.5","0.4","293","2","","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C16 H14 N2 S -","- C16 H14 N2 S -","- C64 H56 N8 S4 -","4","1","FL6017","Luck, Rudy L.; Li, Kexue; Bates, Dallas K.","6-Methyl-11<i>a</i>,12-dihydro-6<i>H</i>-quino[3,2-<i>b</i>][1,4]benzothiazine: an amidine formed under unusual conditions","Acta Crystallographica Section E","2003","59","3","o302","o303","10.1107/S1600536803002988","","","0.71073","MoKα","","","0.041","","","","0.099","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201983","6.6478","0.0005","12.8381","0.0008","23.3409","0.0009","90","","90","","90","","1992","0.2","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1S,8S,11S,16S,2R,5R,12R,15R,21R)-1-hydroxy-2,12-dimethyl-3-oxo-4,9,18- trioxahexacyclo[14.2.2^15,16^.0^2,21^.0^7,15^.0^8,12^]henicos-6-en-11-yl acetate","","- C22 H28 O7 -","- C22 H28 O7 -","- C88 H112 O28 -","4","1","FL6018","Robert A. Burrow; Ademir F. Morel; Ilmar B. Graebner; David H. Farrar; Alan J. Lough","The acetyl derivative of humirianthol","Acta Crystallographica Section E","2003","59","3","o347","o349","10.1107/S1600536803003374","","","0.71073","MoKα","","0.0865","0.0588","","","0.1308","0.1458","","","","","","1.031","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2201984","8.0961","0.0008","11.2954","0.0018","28.684","0.004","90","","90","","90","","2623.1","0.6","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","diacetylated acrenol","3S,5R,6S,9S,10S,13R,15R,19R-3β,20-epoxy-3α-hydoroxy-15,16-diacetyl-7- pimaren-19,6β-olide 1-(1-hydroxy-2,9-dimethyl-3-oxo-4,15- dioxapentacyclo[11.2.2^15,13^.0^2,18^.0^7,12^]octadec-6-en-9-yl)- 2-methylcarbonyloxyethyl acetate","","- C25 H33 Cl3 O8 -","- C25 H33 Cl3 O8 -","- C100 H132 Cl12 O32 -","4","1","FL6019","Robert A. Burrow; Ademir F. Morel; Ilmar B. Graebner; Alan J. Lough; David H. Farrar","Absolute configuration of diacetylated acrenol as its chloroform solvate","Acta Crystallographica Section E","2003","59","3","o350","o352","10.1107/S1600536803003349","","","0.71073","MoKα","","0.0886","0.063","","","0.1505","0.1608","","","","","","1.087","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201985","10.6555","0.0007","21.3398","0.0005","8.5995","0.0001","91.21","","100.468","0.007","83.566","0.007","1910.75","0.14","200","","200","","","","","","","","","5","P -1","-P 1","2","","","","- C70 H70 Cl14 N6 Pd3 -","- C70 H70 Cl14 N6 Pd3 -","- C70 H70 Cl14 N6 Pd3 -","1","0.5","FL6020","Onoda, Akira; Kawakita, Keiko; Okamura, Taka-aki; Yamamoto, Hitoshi; Ueyama, Norikazu","A distorted square-planar Pd^<b>II^</b> complex with a shortened Pd—Cl bond induced by the bulky terpyridyl ligand 6,6''-dimesityl-2,2':6',2''-terpyridine","Acta Crystallographica Section E","2003","59","5","m291","m293","10.1107/S1600536803008626","","","0.71069","MoKα","","0.0954","0.0533","","","0.1324","0.1444","","","","","","1.002","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201986","19.5507","0.0011","12.7195","0.0007","14.7732","0.0008","90","","93.322","0.001","90","","3667.6","0.4","298","2","298","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","14-n-Butyldibenz[a,h]acridine","","- C25 H21 N -","- C25 H21 N -","- C200 H168 N8 -","8","1","FL6021","Ray, Jayanta Kumar; Roy, Bidhan Chandra; Pan, Dipanjan; Canle, L. M.; Santaballa, J. A.; Mahía, Jose","14-<i>n</i>-Butyldibenz[<i>a,h</i>]acridine","Acta Crystallographica Section E","2003","59","4","o514","o516","10.1107/S1600536803005749","","","0.71073","MoKα","","0.1168","0.0542","","","0.1399","0.1668","","","","","","0.988","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201987","7.7811","0.0007","10.419","0.0009","15.3834","0.0012","90","","90","","90","","1247.15","0.18","296","1","296","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","trans-(3R,2aS)-(-)-3-Phenyl-2,3,5,6,7,8-hexahydro-oxazolo[3,2-a]pyridine- 5-thione","","- C13 H15 N O S -","- C13 H15 N O S -","- C52 H60 N4 O4 S4 -","4","1","FL6022","Roa, Luis-Fernando; Gnecco, Dino; Galindo, Alberto; Juárez, Jorge; Terán, Joel L.; Bernès, Sylvain","<i>trans</i>-(3<i>R</i>,2a<i>S</i>)-({-})-3-Phenyl-2,3,5,6,7,8-hexahydro-oxazolo[3,2-<i>a</i>]pyridine-5-thione","Acta Crystallographica Section E","2003","59","4","o519","o521","10.1107/S1600536803004720","","","0.71073","MoKα","","0.0986","0.0577","","","0.1435","0.1668","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201988","12.761","0.003","8.005","0.002","17.744","0.006","90","","98.84","0.03","90","","1791.1","0.9","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-(2-aminoethyl)-2-hydroxybenzamide picrate","","- C15 H15 N5 O9 -","- C15 H15 N5 O9 -","- C60 H60 N20 O36 -","4","1","FL6023","Yu, Qing; Tang, Yu; Feng, Yan-Hua; Tan, Min-Yu; Yu, Kai-Bei","N—H···O hydrogen bonding in the adduct of <i>N</i>-(2-aminoethyl)-2-hydroxybenzamide with picric acid","Acta Crystallographica Section E","2003","59","4","o577","o578","10.1107/S160053680300655X","","","0.71073","MoKα","","0.093","0.0516","","","0.128","0.1421","","","","","","0.94","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2201989","8.0259","0.0016","18.111","0.004","20.59","0.004","90","","90","","90","","2992.9","1.1","150","1","150","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","1,3-di(2,2':6',2''-terpyridin-4'-yl)benzene dichloromethane solvate","","- C37 H26 Cl2 N6 -","- C37 H26 Cl2 N6 -","- C148 H104 Cl8 N24 -","4","0.5","FL6024","Vaduvescu, Simona; Potvin, Pierre G.","1,3-Bis(2,2':6',2''-terpyridin-4'-yl)benzene, a new dinucleating bis(tridentate) ligand, as its dichloromethane solvate","Acta Crystallographica Section E","2003","59","4","o483","o484","10.1107/S1600536803005622","","","0.71073","MoKα","","0.0961","0.0632","","","0.1535","0.1753","","","","","","1.057","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201990","22.5125","0.0003","13.1916","0.0002","21.6096","0.0003","90","","108.748","0.001","90","","6077.02","0.15","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Cu2 P6 F12 C58 H56 N4","Bis[μ-bis(diphenylphosphino)methane-κ^2^P:P']bis[diacetonitrilecopper(I)] bis(hexafluorophosphate)","","- C58 H56 Cu2 F12 N4 P6 -","- C58 H56 Cu2 F12 N4 P6 -","- C232 H224 Cu8 F48 N16 P24 -","4","0.5","FL6025","Wu, Mei-Mei; Zhang, Li-Yi; Qin, Yong-Hai; Chen, Zhong-Ning","Bis[μ-bis(diphenylphosphino)methane-κ^2^<i>P</i>:<i>P</i>']bis[diacetonitrilecopper(I)] bis(hexafluorophosphate)","Acta Crystallographica Section E","2003","59","4","m195","m196","10.1107/S1600536803006330","","","0.71073","MoKα","","0.0937","0.0679","","","0.1472","0.1692","","","","","","1.226","","","","has coordinates,has Fobs","194596","2020-10-21","18:00:00",""
"2201991","21.2902","0.0019","10.4773","0.0009","8.8835","0.0008","90","","94.325","0.003","90","","1975.9","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,4-diphenyl-2,3-di-3-thienylcyclopentadienone","","","- C25 H16 O S2 -","- C25.0088 H16 O S2.0022 -","- C100.035 H64 O4 S8.0088 -","4","1","","Linehan, Justin; Crundwell, Guy; Herron, Steven R.; Kantardjieff, Katherine A.","1,4-Diphenyl-2,3-dithien-3-ylcyclopentadien-1-one","Acta Crystallographica, Section E","2003","59","","o466","o468","10.1107/S1600536803005737","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2201992","6.004","0.001","10.451","0.001","23.79","0.003","90","","90","","90","","1492.8","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-{[(2-Hydroxyphenyl)methyl]methylamino}-1-phenylpropan-1-ol","","- C17 H21 N O2 -","- C17 H21 N O2 -","- C68 H84 N4 O8 -","4","1","FL6027","Yuan, Fang; Li, Yi-Zhi; Zhu, Chengjian; Pan, Yi; Xu, Lin-Lin","2-{[(2-Hydroxyphenyl)methyl]methylamino}-1-phenylpropan-1-ol","Acta Crystallographica Section E","2003","59","5","o608","o609","10.1107/S1600536803007311","","","0.71073","MoKα","","0.052","0.0409","","","0.0726","0.0743","","","","","","1.078","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201993","9.8886","0.0005","10.0266","0.0005","10.93","0.0005","100.548","0.001","111.312","0.001","103.62","0.001","937.01","0.08","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H24 Cl N Ru S2 -","- C15 H24 Cl N Ru S2 -","- C30 H48 Cl2 N2 Ru2 S4 -","2","1","FL6028","Wen-Rui Yao; Ze-Hua Liu; Qian-Feng Zhang","Chloro(η^6^-<i>p</i>-cymene)(diethyldithiocarbamato-κ^2^<i>S,S</i>)ruthenium(II)","Acta Crystallographica Section E","2003","59","5","m303","m305","10.1107/S1600536803008079","","","0.71073","MoKα","","0.0258","0.0236","","","0.0601","0.0614","","","","","","1.084","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201994","8.1605","0.0016","8.2664","0.0016","14.511","0.003","93.951","0.003","105.664","0.003","96.002","0.003","932.5","0.3","193","","193","","","","","","","","","4","P -1","-P 1","2","fenofibrate","1-methylethyl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate","","- C20 H21 Cl O4 -","- C20 H21 Cl O4 -","- C40 H42 Cl2 O8 -","2","1","FL6029","R. F. Henry; G. Z. Zhang; Y. Gao; I. S . Buckner","Fenofibrate","Acta Crystallographica Section E","2003","59","5","o699","o700","10.1107/S1600536803008274","","","0.71073","MoKα","","0.0564","0.052","","","0.1431","0.1471","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201995","12.7474","0.0008","10.9055","0.001","21.5888","0.0013","90","","94.648","0.007","90","","2991.3","0.4","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Cp2Ti(dddse)","bis(η^5^-cyclopentadien-1-yl)[5,6-dihydro-1,4-dithiine-2,3-diselenolato(2-) -Se,Se']titanium(IV)","","- C14 H14 S2 Se2 Ti -","- C14 H14 S2 Se2 Ti -","- C112 H112 S16 Se16 Ti8 -","8","2","FL6030","Vincendeau, Sandrine; Collière, Vincent; Faulmann, Christophe","Cp~2~Ti(dddse): a well known precursor for Se-containing donors","Acta Crystallographica Section E","2003","59","5","m268","m270","10.1107/S1600536803008262","","","0.71073","MoKα","","0.0475","0.035","","","0.0868","0.0967","","","","","","1.049","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2201996","19.327","0.003","19.327","0.003","10.052","0.002","90","","90","","120","","3251.7","1","213","2","213","2","","","","","","","","6","R 3 2 :H","R 3 2""","155","[H~2~cyclenPO][I]","1,7-Dihydro-1,4,7,10-tetraazacyclododecanephosphine oxide iodide","","- C8 H18 I N4 O P -","- C8 H18 I1.00333 N4 O P -","- C72 H162 I9.03 N36 O9 P9 -","9","0.5","FL6031","Twamley, Brendan; Gupta, O. D.; Shreeve, Jean'ne M.","1,7-Dihydro-1,4,7,10-tetraazacyclododecanephosphine oxide iodide","Acta Crystallographica Section E","2003","59","5","o734","o736","10.1107/S1600536803008936","","","0.71073","MoKα","","0.0498","0.0465","","","0.1147","0.1165","","","","","","1.14","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201997","7.4573","0.0014","7.9472","0.0015","11.748","0.002","96.859","0.003","104.061","0.004","108.599","0.003","625.3","0.2","293","2","293","2","","","","","","","","4","P 1","P 1","1","","(S)-2,2'-Bis(4-nitro-2-pyridyloxy)-1,1'-binaphthalene","","- C30 H18 N4 O6 -","- C30 H18 N4 O6 -","- C30 H18 N4 O6 -","1","1","FL6032","Wang, Ruihu; Xu, Lijin; Chen, Gang; Zhou, Zhongyuan; Hong, Maochun; Cao, Rong; Chan, Albert S. C.","(<i>S</i>)-2,2'-Bis(4-nitro-2-pyridyloxy)-1,1'-binaphthalene","Acta Crystallographica Section E","2003","59","6","o865","o867","10.1107/S1600536803009292","","","0.71073","MoKα","","0.0492","0.0366","","","0.0856","0.092","","","","","","0.969","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201998","8.984","0.003","9.248","0.003","9.33","0.003","66.957","0.004","79.762","0.005","73.983","0.005","683.5","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","8-Tosyloxyquinoline","8-Quinolyl 4-toluenesulfonate","","- C16 H13 N O3 S -","- C16 H13 N O3 S -","- C32 H26 N2 O6 S2 -","2","1","FL6034","Nagarajan Vembu; Maruthai Nallu; Jered Garrison; Wiley J. Youngs","Redetermination of 8-tosyloxyquinoline at 100K: supramolecular aggregation through weak C‒H···O and C‒H···N interactions","Acta Crystallographica Section E","2003","59","6","o776","o779","10.1107/S1600536803009656","","","0.71073","MoKα","","0.0536","0.0486","","","0.1242","0.1277","","","","","","1.097","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2201999","13.515","0.002","9.597","0.002","16.875","0.002","90","","110.01","0.01","90","","2056.6","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-[(5-Chloro-2-hydroxyphenyl)phenylmethyl]-2-(2-pyridyl)-1H-benzimidazole","","- C25 H18 Cl N3 O -","- C25 H18 Cl N3 O -","- C100 H72 Cl4 N12 O4 -","4","1","FL6035","Jian, Pan-Ming; Li, Yi-Zhi; Wu, Xiao-Li; Ma, Yong-Xiang; Pan, Da-Hua; Chen, Bao-Hua","1-[(5-Chloro-2-hydroxyphenyl)(phenyl)methyl]-2-(2-pyridyl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2003","59","6","o814","o816","10.1107/S1600536803009814","","","0.71073","MoKα","","0.0404","0.0335","","","0.0891","0.0923","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202000","6.5606","0.0003","7.3493","0.0003","15.3575","0.0007","79.724","0.002","78.98","0.002","74.194","0.005","693.06","0.06","120","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C17 H13 N O5 -","- C17 H13 N O5 -","- C34 H26 N2 O10 -","2","1","FL6036","Franca, Eduardo de Faria; Machado, Antonio Eduardo da Hora; Oliveira-Campos, Ana Maria Ferreira; Santos Jr, Sauli; Ellena, Javier; Guilardi, Silvana","3-(Benzoxazol-2-yl)-7-hydroxychromen-2-one methanol solvate","Acta Crystallographica Section E","2003","59","6","o820","o822","10.1107/S1600536803010407","","","0.71073","MoKα","","","0.0478","","","","0.1212","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202001","8.9673","0.0018","10.528","0.002","19.971","0.004","90","","90","","90","","1885.4","0.6","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","N,N'-Bis(4-biphenylyl)urea","N,N'-Bis(4-biphenylyl)urea","","- C25 H20 N2 O -","- C25 H20 N2 O -","- C100 H80 N8 O4 -","4","1","FL6037","Sumod George; Ashwini Nangia","<i>N,N</i>'-Bis(4-biphenylyl)urea","Acta Crystallographica Section E","2003","59","6","o901","o902","10.1107/S1600536803010948","","","0.71073","MoKα","","0.1038","0.0432","","","0.0896","0.1334","","","","","","0.84","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202002","8.1368","0.0006","10.2645","0.0008","19.351","0.002","90","","92.088","0.001","90","","1615.1","0.2","148.2","","148.2","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H22 Cl N O -","- C18 H22 Cl N O -","- C72 H88 Cl4 N4 O4 -","4","2","FL6038","Christopher M. Beaudry; Jenny Pehl; Karen M. Wovkulich","(9-Anthrylmethyl)trimethylammonium chloride monohydrate","Acta Crystallographica Section E","2003","59","6","o897","o898","10.1107/S1600536803011280","","","0.7107","MoKα","","0.0606","0.0439","","0.0565","0.0535","0.0535","","","","","","1.536","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202003","10.0319","0.0013","10.0487","0.0011","10.1973","0.0014","81.973","0.01","72.624","0.009","78.31","0.009","957.3","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Aqua(pyridine-κN)(N-salicylidenetyrosinato-κ^3^O,N,O')copper(II)","","- C21 H20 Cu N2 O5 -","- C21 H20 Cu N2 O5 -","- C42 H40 Cu2 N4 O10 -","2","1","LH6018","Butcher, Ray J.; Mockler, Garry M.; McKern, Owen","Aqua(pyridine-κ<i>N</i>)(<i>N</i>-salicylidenetyrosinato-κ^3^<i>O,N,O</i>')copper(II)","Acta Crystallographica Section E","2003","59","1","m20","m22","10.1107/S1600536802022043","","","0.71073","MoKα","","0.0389","0.0307","","","0.0776","0.0816","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202004","9.798","0.003","7.7742","0.0011","11.372","0.004","90","","94.36","0.02","90","","863.7","0.4","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","3α,4β-Dihydroxy-5β-androstan-17-one","","- C19 H30 O3 -","- C19 H30 O3 -","- C38 H60 O6 -","2","1","LH6020","Andrade, L.C.R.; Paixão, J.A.; de Almeida, M. J. M.; Fernandes Roleira, F. M.; Sá e Melo, M. L.; Campos Neves, A. S.; Tavares da Silva, E. J.","3α,4β-Dihydroxy-5β-androstan-17-one","Acta Crystallographica Section E","2003","59","1","o21","o23","10.1107/S1600536802022055","","","1.5418","CuKα","","0.0354","0.0349","","","0.1073","0.1079","","","","","","1.093","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202005","7.7955","0.0014","23.362","0.004","10.6973","0.0019","90","","102.297","0.003","90","","1903.5","0.6","170","2","170","2","","","","","","","","3","P 1 21 1","P 2yb","4","Agatholic Acid","","","- C20 H32 O3 -","- C20 H32 O3 -","- C80 H128 O12 -","4","2","LH6021","Bates, Robert B.; Cai, Sheng; Cantor, Ryan S.; Carducci, Michael D.; Irvine, Anthony K.; Jiorle, Beth V.; Nakkiew, Pichaya; Setzer, William N.; Trinh, Long N.","Agatholic acid","Acta Crystallographica Section E","2003","59","1","o97","o98","10.1107/S1600536802023164","","","0.71073","MoKα","","0.104","0.051","","","0.108","0.126","","","","","","0.995","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202006","9.7575","0.0002","13.8091","0.0003","18.427","0.0001","90","","99.964","0.001","90","","2445.45","0.07","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4-Bis{2-hydroxy-3-[N-(2-hydroxyethyl)imino]-5-methylbenzyl}piperazine","","- C26 H36 N4 O4 -","- C26 H36 N4 O4 -","- C104 H144 N16 O16 -","4","1","LH6022","M. Yogavel; S. Selvanayagam; D. Velmurugan; S. Shanmuga Sundara Raj; Hoong-Kun Fun; M. Marappan; M. Kandaswamy","1,4-Bis{2-hydroxy-3-[<i>N</i>-(2-hydroxyethyl)imino]-5-methylbenzyl}piperazine","Acta Crystallographica Section E","2003","59","1","o83","o85","10.1107/S1600536802022560","","","0.71073","MoKα","","0.1074","0.0595","","","0.1627","0.1904","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202007","22.6091","0.0007","5.3506","0.0002","11.0871","0.0004","90","","117.328","0.001","90","","1191.54","0.07","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","","Phyllanthin from the plant phyllanthus amarus","","- C24 H34 O6 -","- C24 H34 O6 -","- C48 H68 O12 -","2","0.5","LH6023","V. Rajakannan; M. S. Sripathi; S. Selvanayagam; D. Velmurugan; Uma. D. Murthy; M. Vishwas; S. P. Thyagarajan; S. Shanmuga Sundara Raj; Hoong-Kun Fun","Phyllanthin from the plant <i>Phyllanthus amarus</i>","Acta Crystallographica Section E","2003","59","2","o203","o205","10.1107/S1600536803001119","","","0.71073","MoKα","","0.0818","0.0656","","","0.171","0.1814","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202008","14.7524","0.0008","15.2702","0.0008","22.7615","0.0014","90","","102.634","0.002","90","","5003.4","0.5","208","2","208","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(O-Ethyldithiocarbonato)[tris(p-methoxyphenyl)phosphine]gold(I)","","- C24 H26 Au O4 P S2 -","- C24 H26 Au O4 P S2 -","- C192 H208 Au8 O32 P8 S16 -","8","1","LH6024","Ho, Soo Yei; Tiekink, Edward R. T.","(<i>O</i>-Ethyldithiocarbonato)[tris(<i>p</i>-methoxyphenyl)phosphine]gold(I)","Acta Crystallographica Section E","2003","59","2","m53","m54","10.1107/S1600536802023565","","","0.71069","MoKα","","0.038","0.028","","","0.064","0.068","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202009","12.0144","0.0004","7.275","0.0004","30.364","0.002","90","","99.565","0.002","90","","2617.1","0.2","100","2","100","2","","","","","","","","3","C 1 2 1","C 2y","5","methyl katononate","3-oxo-olean-12-en-20-alpha-methylcarboxylate","","- C31 H48 O3 -","- C31 H48 O3 -","- C124 H192 O12 -","4","1","LH6025","Doriguetto, Antonio C.; Duarte, Lucienir P.; Ellena, Javier A.; Silva, Grácia D. F.; Mascarenhas, Yvonne P.; Cota, André B.","3-Oxoolean-12-en-20-yl α-methylcarboxylate","Acta Crystallographica Section E","2003","59","2","o164","o166","10.1107/S1600536803000965","","","0.7107","MoKα","","","0.055","","","","0.159","","","","","","1.092","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202010","15.4344","0.0007","11.8116","0.0005","22.4469","0.001","90","","95.632","0.001","90","","4072.4","0.3","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 Au Cl F15 P -","- C18 Au Cl F15 P -","- C144 Au8 Cl8 F120 P8 -","8","2","LH6026","Chen, Hsiao Wei; Tiekink, Edward R. T.","Chloro[tris(perfluorophenyl)phosphine]gold(I)","Acta Crystallographica Section E","2003","59","2","m50","m52","10.1107/S1600536802023425","","","0.71069","MoKα","","0.049","0.031","","","0.068","0.074","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202011","10.1079","0.0007","11.4087","0.001","14.0354","0.0009","90","","90","","90","","1618.5","0.2","293","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H22 N2 O3 -","- C16 H22 N2 O3 -","- C64 H88 N8 O12 -","4","1","LH6027","Gregory M. Ferrence; Joel M. Esken; Jennifer R. Blackburn; Shawn R. Hitchcock","(5<i>S</i>,6<i>R</i>)-4,5-Dimethyl-6-phenyl-3-trimethylacetyl-2<i>H</i>-1,3,4-oxadiazinan-2-one","Acta Crystallographica Section E","2003","59","2","o212","o214","10.1107/S1600536803001314","","","0.71073","MoKα","","","0.0364","","","","0.0968","","","","","","1.044","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202012","7.131","0.0004","12.917","0.0008","10.959","0.0005","90","","130.293","0.003","90","","769.95","0.08","100","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C2 H4 N2 Ni S4 -","- C2 H4 N2 Ni S4 -","- C8 H16 N8 Ni4 S16 -","4","1","LH6028","Santos Jr, Sauli; Guilardi, Silvana; Resende, Jackson A. L. C.; Rubinger, Mayura M. M.; Oliveira, Marcelo R. L.; Ellena, Javier","Redetermination of nickel bis(dithiocarbamate) at 100K","Acta Crystallographica Section E","2003","59","2","m77","m79","10.1107/S1600536803001600","","","0.71073","MoKα","","","0.0329","","","","0.0936","","","","","","0.93","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202013","10.033","0.002","7.27","0.02","13.538","0.003","90","","90.64","0.02","90","","987","3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 4-amino-2-oxo-1,2-dihydroquinoline-3-carboxylate","","- C11 H10 N2 O3 -","- C11 H10 N2 O3 -","- C44 H40 N8 O12 -","4","1","LH6030","Rybakov, Victor B.; Chernyshev, Vladimir V.; Ukrainets, Igor V.; Bezugly, Peter A.; Sidorenko, Lyudmila V.; Nicola Skaif","Methyl 4-amino-2-oxo-1,2-dihydroquinoline-3-carboxylate","Acta Crystallographica Section E","2003","59","4","o412","o414","10.1107/S1600536803004379","","","0.71073","MoKα","","0.0689","0.0446","","","0.1106","0.119","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202014","7.804","0.002","9.123","0.004","13.523","0.005","74.313","0.008","78.473","0.008","74.265","0.008","883.8","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-[(2,6-Dichlorophenyl)(hydroxyimino)methyl]-1,5-dimethyl-2-phenyl-1,2- dihydropyrazol-3-one","","- C18 H15 Cl2 N3 O2 -","- C18 H15 Cl2 N3 O2 -","- C36 H30 Cl4 N6 O4 -","2","1","LH6031","Li, Xiao-Fang; Feng, Ya-Qing; Zhuang, Jun-Peng; Hu, Xiao-Fen","4-[(2,6-Dichlorophenyl)(hydroxyimino)methyl]-1,5-dimethyl-2-phenyl-1,2-dihydropyrazol-3-one","Acta Crystallographica Section E","2003","59","3","o272","o274","10.1107/S1600536803002423","","","0.71073","MoKα","","0.0451","0.0353","","","","0.0902","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202015","6.2634","0.0011","8.2355","0.0015","10.9828","0.0018","88.282","0.004","87.215","0.004","78.268","0.003","553.91","0.17","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","N-(4-bromophenyl)pyridine-2-carboxamide","","- C12 H9 Br N2 O -","- C12 H9 Br N2 O -","- C24 H18 Br2 N4 O2 -","2","1","LH6032","Qi, Jian Ying; Yang, Qi Yun; Lam, Kim Hung; Zhou, Zhong Yuan; Chan, Albert S. C.","<i>N</i>-(4-Bromophenyl)pyridine-2-carboxamide","Acta Crystallographica Section E","2003","59","3","o374","o375","10.1107/S1600536803004057","","","0.71073","MoKα","","0.0825","0.0408","","","0.0739","0.0799","","","","","","1.032","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202016","25.14","0.005","8.5779","0.0017","8.5295","0.0017","90","","94.46","0.03","90","","1833.8","0.6","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N,N'-Di-4-methylphenylpyridine-2,6-dicarboxamide","","- C21 H19 N3 O2 -","- C21 H19 N3 O2 -","- C84 H76 N12 O8 -","4","0.5","LH6033","Qi, Jian Ying; Yang, Qi Yun; Lam, Kim Hung; Zhou, Zhong Yuan; Chan, Albert S. C.","<i>N,N</i>'-Bis(4-methylphenyl)pyridine-2,6-dicarboxamide","Acta Crystallographica Section E","2003","59","4","o415","o416","10.1107/S1600536803004604","","","0.71073","MoKα","","0.1989","0.0893","","","0.1593","0.1806","","","","","","1.021","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202017","9.291","0.004","9.589","0.003","27.175","0.013","90","","99.53","0.03","90","","2387.6","1.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,3-Dimethyl 5-isopropyl 1-ethoxymethyl-6-methyl-4-(3-nitrophenyl)-1,4- dihydropyridine-2,3,5-tricarboxylate","","- C23 H28 N2 O9 -","- C23 H28 N2 O9 -","- C92 H112 N8 O36 -","4","1","LH6034","Vrabel, Victor; Oktavec, Drahomír; Marchalín, Štefan","2,3-Dimethyl 5-isopropyl 1-ethoxymethyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-2,3,5-tricarboxylate","Acta Crystallographica Section E","2003","59","3","o306","o307","10.1107/S1600536803003015","","","0.71073","MoKα","","0.2424","0.0588","","","0.0736","0.0834","","","","","","0.928","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202018","11.521","0.003","5.2071","0.0014","22.745","0.007","90","","103.681","0.004","90","","1325.8","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2,3-Di-(2-Thienyl)Quinoxaline","2,3-Dithien-2-ylquinoxaline","","- C16 H10 N2 S2 -","- C16 H10 N2 S2 -","- C64 H40 N8 S8 -","4","1","LH6035","Crundwell, Guy; Sayers, David; Herron, Steven R.; Kantardjieff, Katherine A.","2,3-Dithien-2-ylquinoxaline","Acta Crystallographica Section E","2003","59","3","o314","o315","10.1107/S1600536803002976","","","0.71073","MoKα","","0.084","0.061","","","0.115","0.122","","","","","","1.188","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202019","12.928","0.002","12.928","0.002","21.981","0.005","90","","90","","120","","3181.6","1","298","2","298","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C8 H48 N24 O24 Pt W6 -","- C8 H48 N24 O24 Pt W6 -","- C24 H144 N72 O72 Pt3 W18 -","3","0.166667","LH6036","Lee, Uk; Jang, Soon‒Jung; Joo, Hea‒Chung; Park, Ki‒Min","Anhydrous octaguanidinium hexatungstoplatinate(IV)","Acta Crystallographica Section E","2003","59","3","m116","m118","10.1107/S160053680300360X","","","0.71069","MoKα","","0.0929","0.0486","","","0.0849","0.1056","","","","","","1.179","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202020","10.351","0.003","12.475","0.003","13.424","0.004","113.89","0.03","102.18","0.02","102.786","0.018","1455.1","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H40 Cl12 N6 O16 Pr2 -","- C42 H40 Cl12 N6 O16 Pr2 -","- C42 H40 Cl12 N6 O16 Pr2 -","1","0.5","LH6037","Shu-Yan Zhang; Zhan Shi; Long-Guan,Zhu; Ru-Ren Xu; Wen-Qin Pang","Di-μ-acetato-κ^3^<i>O,O</i>':<i>O</i>'-di-μ-trichloroacetato-κ^2^<i>O</i>:<i>O</i>'-bis[aqua(trichloroacetato)(1,10-phenanthroline-κ^2^<i>N,N</i>')praseodymium(III)] dimethylformamide disolvate","Acta Crystallographica Section E","2003","59","4","m142","m144","10.1107/S1600536803004744","","","0.71073","MoKα","","0.0341","0.031","","","0.0762","0.0783","","","","","","1.056","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202021","13.3935","0.0007","13.4828","0.0008","15.2291","0.0008","90","","90","","90","","2750.1","0.3","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","2,4-dinitrophenyl p-toluenesulfonate","2,4-dinitrophenyl 4-toluenesulfonate","","- C13 H10 N2 O7 S -","- C13 H10 N2 O7 S -","- C104 H80 N16 O56 S8 -","8","1","LH6038","Nagarajan Vembu; Maruthai Nallu; Jered Garrison; Wiley J. Youngs","2,4-Dinitrophenyl 4-toluenesulfonate: molecular aggregation through weak C—H···O interactions","Acta Crystallographica Section E","2003","59","3","o378","o380","10.1107/S1600536803004197","","","0.71073","MoKα","","0.0337","0.0301","","","0.0847","0.0867","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202022","12.028","0.0007","10.206","0.0006","26.1366","0.0014","90","","95.695","0.002","90","","3192.6","0.3","110","","110","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","μ-ethylene-1,2-di-4-pyridyl-κ^2^N:N'-bis[fac-tricarbonyl(4,4'-tert-butyl- 2,2'-bipyridine)rhenium(I)] hexafluorophosphate dichloromethane solvate","","- C56 H64 Cl4 F12 N6 O6 P2 Re2 -","- C56 H64 Cl4 F12 N6 O6 P2 Re2 -","- C112 H128 Cl8 F24 N12 O12 P4 Re4 -","2","0.5","LH6039","Sun, Shih-Sheng; Tran, Dat T.; Zavalij, Peter Y.; Oliver, Scott R. J.; Lees, Alistair J.","A dinuclear rhenium complex, {[(C~18~H~24~N~2~)Re(CO)~3~]~2~(μ-C~12~H~12~N~2~)}(PF~6~)~2~·2CH~2~Cl~2~","Acta Crystallographica Section E","2003","59","3","m134","m136","10.1107/S1600536803004094","","","0.71073","MoKα","","0.0398","0.0349","","","0.0964","0.0993","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202023","12.0951","0.0006","7.3006","0.0003","13.0038","0.0006","90","","110.28","0.001","90","","1077.07","0.09","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(5-Bromopyrrol-3-yl)cyclohexylmethanone","","","- C11 H14 Br N O -","- C11 H14 Br N O -","- C44 H56 Br4 N4 O4 -","4","1","LH6040","Thomas J. Emge; Matthew J. Clements; David S. Myers; Spencer Knapp","(5-Bromopyrrol-3-yl)cyclohexylmethanone","Acta Crystallographica Section E","2003","59","4","o425","o427","10.1107/S1600536803004598","","","0.71073","MoKα","","0.0282","0.0233","","","0.0537","0.0559","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202024","6.834","0.003","11.358","0.004","21.303","0.009","90","","90","","90","","1653.6","1.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","[Dicarbonyl](eta-5-cyclopentadienyl)iron(II)]-mu-2-1,3-propandiyl- [dicarbonyl](eta-5-cyclopentadienyl)ruthenium(II)]","","- C17 H16 Fe O4 Ru -","- C17 H16 Fe O4 Ru -","- C68 H64 Fe4 O16 Ru4 -","4","1","LH6042","Friedrich, Holger B.; Howie, R. Alan; Onani, Martin O.","[Dicarbonyl(η^5^-cyclopentadienyl)iron(II)]-μ~2~-1,3-propanediyl-[dicarbonyl(η^5^-cyclopentadienyl)ruthenium(II)]","Acta Crystallographica Section E","2003","59","4","m145","m147","10.1107/S1600536803004732","","","0.71073","MoKα","","0.0259","0.0245","","","0.0615","0.0619","","","","","","1.107","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202025","9.416","0.0013","9.589","0.001","11.3024","0.0016","90","","96.091","0.017","90","","1014.7","0.2","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Di-μ-iodo-bis[dicarbonylrhodium(I)]","","- C4 I2 O4 Rh2 -","- C4 I2 O4 Rh2 -","- C16 I8 O16 Rh8 -","4","1","LH6043","Burger, Sylvain; Therrien, Bruno; Süss-Fink, Georg","Di-μ-iodo-bis[dicarbonylrhodium(I)]","Acta Crystallographica Section E","2003","59","4","i53","i54","10.1107/S1600536803005439","","","0.71073","MoKα","","0.0583","0.053","","","0.1324","0.1413","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202026","10.4257","0.0007","10.051","0.0007","30.025","0.002","90","","94.265","0.001","90","","3137.6","0.4","158","2","158","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Aquatripheny(trifluoroacetato)ltin‒2,2':6',2""-terpyridine (1/1)","","- C35 H28 F3 N3 O3 Sn -","- C35 H28 F3 N3 O3 Sn -","- C140 H112 F12 N12 O12 Sn4 -","4","1","LH6044","Chee, Chin Fei; Lo, Kong Mun; Ng, Seik Weng","Aquatriphenyl(trifluoroacetato)tin‒2,2':6',2''-terpyridine (1/1)","Acta Crystallographica Section E","2003","59","4","m174","m175","10.1107/S160053680300583X","","","0.71073","MoKα","","0.042","0.027","","","0.058","0.062","","","","","","0.954","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202027","10.464","0.002","17.142","0.003","8.4481","0.0017","90","","90","","90","","1515.4","0.5","180","2","180","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","catena-[1,3-Diammoniopropane di-μ~2~-hydroxo-di-μ~4~-phosphato-trioxotrivanadium dihydrate]","","- C3 H18 N2 O15 P2 V3 -","- C3 H18 N2 O15 P2 V3 -","- C12 H72 N8 O60 P8 V12 -","4","0.5","LH6045","Almeida Paz, Filipe A.; Shi, Fa-Nian; Trindade, Tito; Rocha, Joao; Klinowski, Jacek","<i>catena</i>-[1,3-Diammoniopropane di-μ~2~-hydroxo-di-μ~4~-phosphato-trioxotrivanadium dihydrate]: a redetermination at 180(2)K","Acta Crystallographica Section E","2003","59","4","m179","m182","10.1107/S1600536803005828","","","0.71073","MoKα","","0.0353","0.0292","","","0.0706","0.0733","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202028","14.4131","0.0004","10.1848","0.0002","24.7099","0.0007","90","","98.915","0.001","90","","3583.46","0.16","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Sb Pt P F6 N2 C38 H32","(4,4'-dimethyl-2,2'-bipyridine)(ethynylbenzene)(triphenylphosphine)platinum(II) hexafluoroantimonate","","- C38 H32 F6 N2 P Pt Sb -","- C38 H32 F6 N2 P Pt Sb -","- C152 H128 F24 N8 P4 Pt4 Sb4 -","4","1","LH6047","Wu, Mei-Mei; Zhang, Li-Yi; Qin, Yong-Hai; Chen, Zhong-Ning","(4,4'-Dimethyl-2,2'-bipyridine)(ethynylbenzene)(triphenylphosphine)platinum(II) hexafluoroantimonate","Acta Crystallographica Section E","2003","59","4","m210","m211","10.1107/S1600536803006834","","","0.71073","MoKα","","0.0718","0.0408","","","0.0924","0.1099","","","","","","1.193","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202029","10.3917","0.0006","11.1154","0.0007","12.33","0.0008","110.611","0.001","97.621","0.001","97.198","0.001","1298.37","0.14","168","2","168","2","","","","","","","","5","P -1","-P 1","2","Bis(aquatrifluoroacetatotriphenyltin).15-crown-5","Bis(aquatrifluoroacetatotriphenyltin)‒1,4,7,10,13-pentaoxacyclopentadecane (1/1)","","- C50 H54 F6 O11 Sn2 -","- C50 H54 F6 O11 Sn2 -","- C50 H54 F6 O11 Sn2 -","1","0.5","LH6050","Chee, Chin Fei; Lo, Kong Mun; Ng, Seik Weng","Aqua(trifluoroacetato)triphenyltin‒15-crown-5 (2/1)","Acta Crystallographica Section E","2003","59","4","m202","m204","10.1107/S1600536803006548","","","0.71073","MoKα","","0.025","0.022","","","0.055","0.056","","","","","","0.981","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202031","9.2561","0.0001","10.0669","0.0002","11.5351","0.0002","104.62","0.001","108.441","0.001","109.692","0.001","879.06","0.03","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","(Z)-α-Chloromethyl-3,3'4,4'-tetramethoxystilbene","","- C19 H21 Cl O4 -","- C19 H21 Cl O4 -","- C38 H42 Cl2 O8 -","2","1","LH6052","Stomberg, Rolf; Langer, Vratislav; Li, Shiming; Lundquist, Knut","(<i>Z</i>)-α-Chloromethyl-3,3',4,4'-tetramethoxystilbene","Acta Crystallographica Section E","2003","59","4","o583","o585","10.1107/S1600536803006536","","","0.71073","MoKα","","0.0471","0.0384","","","0.1058","0.113","","","","","","1.018","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202032","4.5893","0.0018","8.105","0.004","14.641","0.007","97.77","0.04","91.18","0.04","103.48","0.03","524","0.4","297","2","297","2","","","","","","","","4","P -1","-P 1","2","","[(2-methoxyanilino)methylene]malononitrile","","- C11 H9 N3 O -","- C11 H9 N3 O -","- C22 H18 N6 O2 -","2","1","LH6053","Vladimir N. Nesterov; Elena A. Viltchinskaia; Svitlana V. Nesterova","[(2-Methoxyanilino)methylene]malononitrile","Acta Crystallographica Section E","2003","59","5","o625","o627","10.1107/S1600536803007293","","","0.71073","MoKα","","0.0916","0.0688","","","0.1692","0.1826","","","","","","1.099","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202033","4.5268","0.0003","7.4711","0.0005","9.1856","0.0006","90","","100.631","0.002","90","","305.33","0.04","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Guanidinium dihydrogen phosphite","","- C H8 N3 O3 P -","- C H8 N3 O3 P -","- C2 H16 N6 O6 P2 -","2","1","LH6055","Harrison, William T. A.","Guanidinium dihydrogen phosphite","Acta Crystallographica Section E","2003","59","6","o769","o770","10.1107/S1600536803009644","","","0.71073","MoKα","","0.0323","0.029","","","0.0737","0.0756","","","","","","0.994","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202034","7.884","0.004","8.1279","0.0017","14.5","0.003","90","","100.47","0.02","90","","913.7","0.5","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Acetylphenylboronic acid monohydrate","","- C8 H11 B O4 -","- C8 H11 B O4 -","- C32 H44 B4 O16 -","4","1","LH6056","Ganguly, Anusree; Meyers, Cal Y.; Robinson, Paul D.","2-Acetylphenylboronic acid monohydrate","Acta Crystallographica Section E","2003","59","6","o759","o761","10.1107/S1600536803009310","","","0.71069","MoKα","","0.053","0.034","","","0.091","0.101","","","","","","1.02","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2202035","11.617","0.002","8.03","0.002","12.961","0.003","90","","100.17","0.03","90","","1190.1","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","manganese(II) 2,2'-bipryidine-3,3'-dicarboxylate dihydrate","catena-poly-[[diaquamanganese(II)]-μ-(2,2'-bipyridyl-3,3'- dicarboxylato-κ^4^N,N':O,O')]","","- C12 H10 Mn N2 O6 -","- C12 H10 Mn N2 O6 -","- C48 H40 Mn4 N8 O24 -","4","0.5","LH6058","Hong-Tao Zhang; Ting Shao; Hua-Qin Wang; Xiao-Zeng You","A one-dimensional double-wavelike chain coordination polymer: <i>catena</i>-poly[[diaquamanganese(II)]-μ-(2,2'-bipyridyl-3,3'-dicarboxylato-κ^4^<i>N,N</i>':<i>O,O</i>')]","Acta Crystallographica Section E","2003","59","6","m342","m344","10.1107/S1600536803009838","","","0.71073","MoKα","","0.0463","0.0352","","","0.0879","0.0932","","","","","","1.012","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202036","24.417","0.004","7.5713","0.001","10.013","0.002","90","","109.268","0.01","90","","1747.4","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","DL-valine hemifumaric acid","","- C14 H26 N2 O8 -","- C14 H26 N2 O8 -","- C56 H104 N8 O32 -","4","0.5","LH6060","M. Alagar; R. V. Krishnakumar; M. Subha Nandhini; S. Natarajan","<small>DL</small>-Valine-fumaric acid (2/1)","Acta Crystallographica Section E","2003","59","6","o857","o859","10.1107/S1600536803010560","","","0.71073","MoKα","","0.0648","0.058","","","0.1474","0.1537","","","","","","1.071","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2202037","9.5745","0.0013","10.3359","0.0012","17.132","0.002","85.693","0.01","75.609","0.01","72.102","0.01","1562.7","0.4","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C9 H8 N2 -","- C9 H8 N2 -","- C72 H64 N16 -","8","4","LH6063","Haghiri, Alilreza; Lerner, Hans-Wolfram; Bolte, Michael","A new polymorph of 3-phenylpyrazole","Acta Crystallographica Section E","2003","59","6","o873","o874","10.1107/S160053680301078X","","","0.71073","MoKα","","0.0883","0.0434","","","0.082","0.092","","","","","","0.878","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202038","5.3664","0.0005","5.3846","0.0006","18.8262","0.0019","90","","92.319","0.002","90","","543.55","0.1","293","2","293","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","","","- Al Ba Ca F7 -","- Al Ba Ca F7 -","- Al4 Ba4 Ca4 F28 -","4","1","","Werner, Franz; Weil, Matthias","α-BaCaAlF~7~","Acta Crystallographica, Section E","2003","59","","i17","i19","10.1107/S1600536803001259","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2202039","6.827","0.003","7.333","0.003","7.57","0.003","80.753","0.008","72.547","0.008","83.442","0.008","356","0.2","292","2","292","2","","","","","","","","5","P -1","-P 1","2","potasium zinc dihydrogendiphosphate hydrate","","","- H8 K2 O16 P4 Zn -","- H8 K2 O16 P4 Zn -","- H8 K2 O16 P4 Zn -","1","0.5","","Alaoui Tahiri, Aziz; Ouarsal, Rachid; Lachkar, Mohammed; Zavalij, Peter Y.; El Bali, Brahim","Dipotassium zinc bis(dihydrogendiphosphate) dihydrate, K~2~Zn(H~2~P~2~O~7~)~2~.2H~2~O","Acta Crystallographica, Section E","2003","59","","i50","i52","10.1107/S1600536803005440","","","","","","","","","","","","","","","","","","","","","has coordinates","277836","2022-09-14","17:02:02",""
"2202040","7.2187","0.0009","7.2187","0.0009","10.4639","0.0013","90","","90","","90","","545.27","0.12","295","2","295","2","","","","","","","","4","P 42/n m c :2","-P 4ac 2a","137","hexaaquamagnesium(II) bis(hypophosphite)","hexaaquamagnesium(II) bis(hypophosphite)","","- H16 Mg O10 P2 -","- H16 Mg O10 P2 -","- H32 Mg2 O20 P4 -","2","0.125","MG6022","Kuratieva, Natalia V.; Naumova, Marina I.; Naumov, Dmitry Yu.; Podberezskaya, Nina V.","A new polymorph of hexaaquamagnesium(II) bis(hypophosphite)","Acta Crystallographica Section E","2003","59","6","i89","i91","10.1107/S160053680300758X","","","0.71073","MoKα","","0.0677","0.0209","","","0.0379","0.0481","","","","","","0.739","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202041","8.508","0.001","8.516","0.001","9.338","0.001","90","","116.869","0.01","90","","603.54","0.13","293","","293","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- Li3 O4 Ta -","- Li3 O4 Ta -","- Li24 O32 Ta8 -","8","1","","Douglas du Boulay; Akito Sakaguchi; Katsumi Suda; Nobuo Ishizawa","Reinvestigation of β-Li~3~TaO~4~","Acta Crystallographica, Section E","2003","59","","i80","i82","10.1107/S1600536803009061","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2202042","11.5443","0.0005","11.7528","0.0005","12.5534","0.0006","110.307","0.001","109.523","0.001","91.279","0.001","1486.98","0.12","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","Cyclopentadienylmangenesetricarbonyl","","- C26 H42 K Mn N2 O9 -","- C26 H42 K Mn N2 O9 -","- C52 H84 K2 Mn2 N4 O18 -","2","1","NA6170","Shao, Li; Geib, Steven J.; Cooper, N. John","A potassium cryptate-2,2,2 salt of tricarbonyl(η^4^-cyclopentadiene)manganese","Acta Crystallographica Section E","2003","59","2","m69","m71","10.1107/S1600536802023024","","","0.71073","MoKα","","0.0398","0.0365","","","0.099","0.1009","","","","","","1.257","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202043","10.735","0.002","11.603","0.002","11.843","0.002","90","","105.87","0.01","90","","1418.9","0.4","293","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Piperazinium bis(Hydrogen maleate)","","- C12 H18 N2 O8 -","- C12 H18 N2 O8 -","- C48 H72 N8 O32 -","4","1","NA6173","Zhi Min Jin; Mao Lin Hu; Kui Wu Wang; Liang Shen; Mei Chao Li","Strong symmetrical intramolecular hydrogen bonds in diprotonated piperazinium bis(hydrogenmaleate)","Acta Crystallographica Section E","2003","59","1","o1","o3","10.1107/S1600536802021803","","","0.71073","MoKα","","0.0857","0.0423","","","0.0899","0.1022","","","","","","0.905","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202044","8.2279","0.0001","15.1992","0.0002","11.6764","0.0002","90","","107.781","0.0007","90","","1390.47","0.03","160","2","160","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dimethyl 1-(3-chloro-4-methylphenyl)pyrazole-3,4-dicarboxylate","","- C14 H13 Cl N2 O4 -","- C14 H13 Cl N2 O4 -","- C56 H52 Cl4 N8 O16 -","4","1","NA6182","Thamotharan, S.; Parthasarathi, V.; Sanyal, R.; Badami Bharati, V.; Linden, Anthony","Dimethyl 1-(3-chloro-4-methylphenyl)pyrazole-3,4-dicarboxylate","Acta Crystallographica Section E","2003","59","1","o44","o45","10.1107/S1600536802020718","","","0.71073","MoKα","","0.0625","0.0414","","","0.1046","0.1165","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202045","12.6968","0.0004","11.1886","0.0003","7.9872","0.0002","90","","95.446","0.001","90","","1129.54","0.05","160","2","160","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(4-Chlorophenyl)-4-(2-hydroxyethyl)-5-methyl-2,4-dihydro- 3H-1,2,4-triazol-3-one","","- C11 H12 Cl N3 O2 -","- C11 H12 Cl N3 O2 -","- C44 H48 Cl4 N12 O8 -","4","1","NA6186","Thamotharan, S.; Parthasarathi, V.; Sunagar, Vinay; Badami, Bharati; Linden, Anthony","2-(4-Chlorophenyl)-4-(2-hydroxyethyl)-5-methyl-2,4-dihydro-3<i>H</i>-1,2,4-triazol-3-one","Acta Crystallographica Section E","2003","59","1","o75","o76","10.1107/S1600536802023012","","","0.71073","MoKα","","0.0786","0.0433","","","0.105","0.1221","","","","","","1.063","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2202046","9.4849","0.0011","11.0024","0.0013","11.4028","0.0013","75.09","0.002","73.748","0.002","71.05","0.002","1062.2","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H24 Cl O2 P -","- C24 H24 Cl O2 P -","- C48 H48 Cl2 O4 P2 -","2","1","NA6187","Blake, Alexander J.; Garner, C. David; Tunney, Josephine M.","Tetraphenylphosphonium chloride dihydrate","Acta Crystallographica Section E","2003","59","1","o9","o10","10.1107/S1600536802021682","","","0.71073","MoKα","","0.0514","0.0373","","","0.0918","0.0975","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202047","5.881","0.002","8.182","0.002","15.983","0.003","78.03","0.02","89.28","0.02","72.49","0.02","716.5","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","5-methoxy-4-(4-methoxyphenyl)isochroman-3-ol","","- C17 H18 O4 -","- C17 H18 O4 -","- C34 H36 O8 -","2","1","NA6188","Palusiak, Marcin; Małecka, Magdalena; Rybarczyk-Pirek, Agnieszka; Epsztajn, Jan; Bieniek, Adam; Kowalska, Justyna A.","5-Methoxy-4-(4-methoxyphenyl)isochroman-3-ol","Acta Crystallographica Section E","2003","59","1","o11","o13","10.1107/S1600536802021852","","","1.54178","CuKα","","0.0494","0.0385","","","0.1126","0.1141","","","","","","1.124","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202048","8.5471","0.0007","27.547","0.002","9.0485","0.0008","90","","90","","90","","2130.4","0.3","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","Diacetatobis(2-aminobenzothiazolato)zinc(II)","","- C18 H18 N4 O4 S2 Zn -","- C18 H18 N4 O4 S2 Zn -","- C72 H72 N16 O16 S8 Zn4 -","4","1","NA6189","Anwar Usman; Hoong-Kun Fun; Suchada Chantrapromma; Ming Zhang; Zhen-Feng Chen; Yuan-Zhi Tang; Shao-Ming Shi; Hong Liang","Diacetatobis(2-aminobenzothiazole)zinc(II)","Acta Crystallographica Section E","2003","59","1","m41","m43","10.1107/S1600536802021864","","","0.71073","MoKα","","0.0295","0.0239","","","0.0577","0.0603","","","","","","1.062","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202049","11.3422","0.0002","15.6889","0.0003","24.1716","0.0005","90","","92.437","0.001","90","","4297.36","0.14","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-(Benzo[1,3]dioxol-5-yl)-7-(4-chloro-phenyl)-3-methyl-1-phenyl-1,6,7,8- tetrahydropyrazolo[3,4-b][1,4]diazepine","","- C26 H21 Cl N4 O2 -","- C26 H21 Cl N4 O2 -","- C208 H168 Cl8 N32 O16 -","8","2","NA6190","Low, John Nicolson; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo; Insuasty, Braulio; Mosquera, Mónica","5-(Benzo[1,3]dioxol-5-yl)-7-(4-chlorophenyl)-3-methyl-1-phenyl-1,6,7,8-tetrahydropyrazolo[3,4-<i>b</i>][1,4]diazepine","Acta Crystallographica Section E","2003","59","1","o18","o20","10.1107/S1600536802022092","","","0.71073","MoKα","","0.1022","0.056","","","0.1304","0.1502","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202050","6.4009","0.0002","8.3596","0.0003","13.2794","0.0005","92.778","0.001","94.382","0.001","95.039","0.003","704.66","0.04","120","1","120","1","","","","","","","","4","P -1","-P 1","2","","2-(Benzotriazol-1-ylmethyl)-1-phenyl-3-pyrazolidinone","","- C16 H15 N5 O -","- C16 H15 N5 O -","- C32 H30 N10 O2 -","2","1","NA6191","Low, John Nicolson; Quesada, A.; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo; Abonia, Rodrigo; Meier, Herbert","2-(Benzotriazol-1-ylmethyl)-1-phenyl-3-pyrazolidinone: two weak hydrogen bonds combine to form molecular ladders","Acta Crystallographica Section E","2003","59","1","o66","o69","10.1107/S1600536802022948","","","0.71073","MoKα","","0.052","0.0413","","","0.1035","0.1097","","","","","","1.057","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202051","8.471","0.002","9.282","0.001","11.271","0.001","90","","90","","90","","886.2","0.2","200","2","200","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(6S)-Methyl-3(3)-methylethyl-piperazine-2-one","","- C8 H16 N2 O -","- C8 H16 N2 O -","- C32 H64 N8 O4 -","4","1","NA6192","Sawatzki, Peter; Mikeska, Thomas; Sandhoff, Konrad; Nieger, Martin; Kolter, Thomas","6(<i>S</i>)-Methyl-3(<i>S</i>)-(1-methylethyl)piperazin-2-one","Acta Crystallographica Section E","2003","59","2","o171","o173","10.1107/S1600536803000862","","","1.54178","CuKα","","0.0321","0.0315","","","0.0721","0.0728","","","","","","1.122","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202052","7.8114","0.0002","21.6075","0.0007","16.6606","0.0005","90","","91.4634","0.0007","90","","2811.14","0.14","296.2","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H24 Cl2 F6 Ir N4 P -","- C24 H24 Cl2 F6 Ir N4 P -","- C96 H96 Cl8 F24 Ir4 N16 P4 -","4","1","NA6193","Naokazu Yoshikawa; Jun Sakamoto; Nobuko Kanehisa; Yasushi Kai; Takeko Matsumura-Inoue","<i>cis</i>-Dichlorobis(4,4'-dimethyl-2,2'-bipyridine)iridium(III) hexafluorophosphate","Acta Crystallographica Section E","2003","59","4","m155","m156","10.1107/S160053680300429X","","","0.7107","MoKα","","","0.0533","","","","0.1259","","","","","","1.407","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202053","14.645","0.003","6.4302","0.0013","20.954","0.004","90","","98.67","0.03","90","","1950.7","0.7","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Amino-4-(4-chlorophenylthio)-5-phenyl-6-(1-piperidyl)pyrimidine","","- C21 H21 Cl N4 S -","- C21 H21 Cl N4 S -","- C84 H84 Cl4 N16 S4 -","4","1","NA6194","Daniel E. Lynch; Ian McClenaghan","2-Amino-4-(4-chlorophenylthio)-5-phenyl-6-(1-piperidyl)pyrimidine","Acta Crystallographica Section E","2003","59","2","o222","o224","10.1107/S1600536803001405","","","0.71073","MoKα","","0.0665","0.0473","","","0.114","0.1243","","","","","","1.085","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202054","17.001","0.002","6.5492","0.001","17.145","0.003","90","","110.584","0.005","90","","1787.1","0.5","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(4-Methoxyphenyl)-5-(4-methylpent-3-enyl)-2,3,3a,4,7,7a-hexahydro- 1H-isoindole-1,3-dione","","- C21 H25 N O3 -","- C21 H25 N O3 -","- C84 H100 N4 O12 -","4","1","NA6195","Daniel E. Lynch; Ian McClenaghan","2-(4-Methoxyphenyl)-5-(4-methylpent-3-enyl)-2,3,3a,4,7,7a-hexahydro-1<i>H</i>-isoindole-1,3-dione","Acta Crystallographica Section E","2003","59","2","o198","o199","10.1107/S160053680300120X","","","0.71073","MoKα","","0.1819","0.0737","","","0.1687","0.2233","","","","","","0.941","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2202055","9.5206","0.0001","14.7738","0.0002","14.6958","0.0002","90","","129.182","0.001","90","","1602.25","0.04","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(rac-2SR,3RS,5SR)-Spiro[3-methoxycarbonyl-1-azabicyclo[3.3.0]octane-2,1'- acenaphthylen]-2'-one","","- C20 H19 N O3 -","- C20 H19 N O3 -","- C80 H76 N4 O12 -","4","1","NA6196","Sundar, T. V.; Parthasarathi, V.; Álvarez-Rúa, C.; García-Granda, S.; Sharma, I.; Pardasani, R. T.; Mehrotra, R. C.","(<i>rac</i>-2<i>SR</i>,3<i>RS</i>,5<i>SR</i>)-Spiro[3-methoxycarbonyl-1-azabicyclo[3.3.0]octane-2,1'-acenaphthylen]-2'-one","Acta Crystallographica Section E","2003","59","3","o280","o282","10.1107/S1600536803002344","","","1.5418","CuKα","","0.0566","0.0473","","","0.1286","0.1369","","","","","","1.071","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202056","22.652","0.001","10.5508","0.0003","15.7162","0.0007","90","","114.921","0.004","90","","3406.4","0.3","293","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Ethyl 5-ethoxymethylene-2-methyl-6-oxo-4-phenyl-1,4,5,6-tetrahydropyridine-3- carboxylate","","- C18 H21 N O4 -","- C18 H21 N O4 -","- C144 H168 N8 O32 -","8","1","NA6197","Novoa de Armas, Héctor; Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J.; Suárez Navarro, Margarita; Verdecia Reyes, Yamila; Ochoa Rodríguez, Estael; Salfrán, Esperanza","Ethyl 5-ethoxymethylene-2-methyl-6-oxo-4-phenyl-1,4,5,6-tetrahydropyridine-3-carboxylate","Acta Crystallographica Section E","2003","59","2","o230","o231","10.1107/S1600536803001624","","","1.54184","CuKα","","0.0706","0.0667","","0.2193","","0.2193","","","0.983","","","0.983","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202057","10.0744","0.0003","6.2583","0.0002","28.9244","0.0009","90","","101.041","0.0013","90","","1789.89","0.1","120","1","120","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-tert-butyl-5-[(4-methoxybenzylidene)amino]-1-phenylpyrazole","","- C21 H23 N3 O -","- C21 H23 N3 O -","- C84 H92 N12 O4 -","4","1","NA6198","Low, John Nicolson; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo; Rengifo, Emerson; Abonia, Rodrigo","3-<i>tert</i>-Butyl-5-[(4-methoxybenzylidene)amino]-1-phenylpyrazole","Acta Crystallographica Section E","2003","59","2","o250","o252","10.1107/S1600536803001909","","","0.71073","MoKα","","0.0797","0.0515","","","0.1216","0.1349","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202058","10.5267","0.0002","10.7688","0.0003","10.9397","0.0003","77.646","0.002","72.743","0.002","62.7565","0.0012","1048.45","0.05","120","1","120","1","","","","","","","","5","P -1","-P 1","2","","1-(4-bromophenyl)-3-[2-(2-hydroxyethyl)amino-5-nitroanilino]-1-propanone","","- C20 H25 Br N4 O5 -","- C20 H25 Br N4 O5 -","- C40 H50 Br2 N8 O10 -","2","1","NA6199","Low, John Nicolson; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo; Insuasty, Braulio; Caldas, Yupanqui","Ladders in the supramolecular structure of 1-(4-bromophenyl)-3-[2-(2-hydroxyethyl)amino-5-nitroanilino]-1-propanone dimethylformamide solvate","Acta Crystallographica Section E","2003","59","3","o296","o298","10.1107/S1600536803002538","","","0.71073","MoKα","","0.0494","0.037","","","0.0824","0.0877","","","","","","1.052","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202059","14.4635","0.0007","17.337","0.001","29.388","0.002","90","","90","","90","","7369.1","0.7","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","6^I^,6^II^-dideoxy-6^I^-(p-methylbenzylthio)-6^II^-phenylthio-β-cyclodextrin tetradecahydrate","","- C56 H110 O47 S2 -","- C56 H110 O47 S2 -","- C224 H440 O188 S8 -","4","1","NA6200","Lichtenthaler, Frieder W.; Lindner, Hans J.; Fujita, Kahee; Yuan, De-Qi; Ren, Yong","Guest differentiation in a 6^<b>I^</b>,6^<b>II^</b>-disubstituted β-cyclodextrin","Acta Crystallographica Section E","2003","59","4","o408","o411","10.1107/S1600536803004409","","","0.71073","MoKα","","0.1782","0.0962","","","0.2159","0.2553","","","","","","1.095","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2202060","7.3995","0.0005","24.4481","0.0018","14.2649","0.0008","90","","99.116","0.005","90","","2548","0.3","211","2","211","2","","","","","","","","3","P 1 21 1","P 2yb","4","per-(3-deoxy)-α-cyclomannin","cyclohexakis[(1\ρightarrow4)-3-deoxy-α-D-arabino-hexopyranosyl]","","- C40 H82 O31 -","- C40 H72 O31 -","- C80 H144 O62 -","2","1","NA6201","Lindner, Hans J.; Lichtenthaler, Frieder W.; Fujita, Kahee; Yang, Cheng; Yuan, De-Qi; Nogami, Yasuyoshi","Per(3-deoxy)-α-cyclomannin: an <i>n</i>-butanol hexahydrate inclusion complex","Acta Crystallographica Section E","2003","59","3","o387","o389","10.1107/S1600536803003763","","","0.71073","MoKα","","0.0657","0.0386","","","0.0717","0.0764","","","","","","0.992","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202061","11.6099","0.0007","14.2132","0.0008","17.0508","0.001","90","","90","","90","","2813.6","0.3","150","","150","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Chloro(P-{2-[N-(2,6-diisopropylphenyl)iminomethyl]phenyl}- P,P-diphenylphosphine-κ^2^N,P)methylpalladium(II)","","- C32 H35 Cl N P Pd -","- C32 H35 Cl N P Pd -","- C128 H140 Cl4 N4 P4 Pd4 -","4","1","NA6202","Spek, Anthony L.","Chloro(<i>P</i>-{2-[<i>N</i>-(2,6-diisopropylphenyl)iminomethyl]phenyl}-<i>P,P</i>-diphenylphosphine-κ^2^<i>N,P</i>)methylpalladium(II)","Acta Crystallographica Section E","2003","59","3","m97","m98","10.1107/S160053680300299X","","","0.71073","MoKα","","0.0247","0.0227","","","0.0526","0.0533","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202062","7.7809","0.0004","9.8572","0.0004","24.548","0.001","90","","97.222","0.005","90","","1867.84","0.15","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,5-diethoxycarbonyl-6-methyl-4-phenylthieno[2,3-b]pyridine","","- C20 H19 N O4 S -","- C20 H19 N O4 S -","- C80 H76 N4 O16 S4 -","4","1","NA6203","Novoa de Armas, Héctor; Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J.; Salfrán, Esperanza; Suárez Navarro, Margarita; Ochoa Rodríguez, Estael; Verdecia Reyes, Yamila","2,5-Diethoxycarbonyl-6-methyl-4-phenylthieno[2,3-<i>b</i>]pyridine","Acta Crystallographica Section E","2003","59","3","o321","o323","10.1107/S1600536803003222","","","1.5418","CuKα","","0.062","0.0512","","0.1482","","0.1482","","","1.048","","","1.048","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202063","5.5167","0.0003","17.7388","0.0011","8.2217","0.0005","90","","94.139","0.003","90","","802.47","0.08","120","0.2","120","0.2","","","","","","","","4","P 1 21 1","P 2yb","4","","6(R)-Acetoxymethyl-5(S)-acetyl-2(S)-(benzotriazol-1-yl)-5,6-dihydro-2H-pyran","","- C16 H17 N3 O5 -","- C16 H17 N3 O5 -","- C32 H34 N6 O10 -","2","1","NA6204","Low, John Nicolson; Cobo, Justo; López, M. Dolores; Nogueras, Manuel; Sánchez, Adolfo","Benzotriazol-1-yl 4,6-di-<i>O</i>-acetyl-2,3-dideoxy-α-<small>D</small>-<i>erythro</i>-hex-2-enpyranoside","Acta Crystallographica Section E","2003","59","3","o334","o336","10.1107/S1600536803003362","","","0.71073","MoKα","","0.0839","0.0457","","","0.0828","0.0936","","","","","","1.002","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202064","9.1929","0.0008","4.838","0.0005","13.2467","0.0011","90","","93.073","0.007","90","","588.3","0.09","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","betaine of aminoguanidine monohydrate","","- C2 H8 N4 O3 -","- C2 H8 N4 O3 -","- C8 H32 N16 O12 -","4","1","NA6205","Tsonko Kolev; Rosica Petrova","Zwitterionic 2-guanidinium-1-aminocarboxylate monohydrate","Acta Crystallographica Section E","2003","59","4","o447","o449","10.1107/S1600536803004203","","","0.71065","MoKα","","0.0627","0.0399","","","0.1041","0.1154","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202065","7.8114","0.0006","11.2988","0.0006","45.353","0.002","90","","90","","90","","4002.8","0.4","293","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Diethyl 4-(4-bromophenyl)-6-methylthieno[2,3-b]pyridine-2,5-dicarboxylate","","- C20 H18 Br N O4 S -","- C20 H18 Br N O4 S -","- C160 H144 Br8 N8 O32 S8 -","8","2","NA6206","Héctor Novoa de Armas; Oswald M. Peeters; Norbert M. Blaton; Camiel J. De Ranter; Margarita Suárez Navarro; Esperanza Salfrán Solano; Yamila Verdecia Reyes; Estael Ochoa Rodríguez","4-(4-Bromophenyl)-2,5-diethoxycarbonyl-6-methylthieno[2,3-<i>b</i>]pyridine","Acta Crystallographica Section E","2003","59","3","o384","o386","10.1107/S1600536803004100","","","1.5418","CuKα","","0.0498","0.0456","","0.1324","","0.1324","","","1.045","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202066","12.7415","0.0011","6.9924","0.0006","17.9671","0.0015","90","","98.641","0.002","90","","1582.6","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(4-Bromo-2-nitrophenyl)-N-methyl-N'-(quinolin-4-ylmethylene)hydrazine","","- C17 H13 Br N4 O2 -","- C17 H13 Br N4 O2 -","- C68 H52 Br4 N16 O8 -","4","1","NA6207","Sema Öztürk; Mehmet Akkurt; Ercan Aydemír; Hoong-Kun Fun","<i>N</i>-(4-Bromo-2-nitrophenyl)-<i>N</i>-methyl-<i>N</i>'-(quinolin-4-ylmethylene)hydrazine","Acta Crystallographica Section E","2003","59","4","o488","o489","10.1107/S1600536803005348","","","0.71073","MoKα","","0.1203","0.044","","","0.0821","0.1069","","","","","","1.043","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202067","6.835","0.0003","7.1253","0.0003","7.2235","0.0004","75.012","0.004","72.355","0.004","79.185","0.004","321.55","0.03","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Iron(II) ethylenediammonium bis(sulfate) tetrahydrate","Iron ethylenediammonium bis(sulfate) tetrahydrate","","- C2 H18 Fe N2 O12 S2 -","- C2 H18 Fe N2 O12 S2 -","- C2 H18 Fe N2 O12 S2 -","1","0.5","NA6208","Held, Peter","Ethylenediammonium tetraaquabis(sulfato)iron(II)","Acta Crystallographica Section E","2003","59","4","m197","m198","10.1107/S1600536803004628","","","0.71073","MoKα","","0.0272","0.0224","","","0.0594","0.0625","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202068","6.6117","0.0014","9.1388","0.0015","11.3024","0.0019","90","","100.45","0.017","90","","671.6","0.2","173","2","173","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","2,2,6,6-tetramethyl-4-piperidonium trifluoroacetate","","- C11 H18 F3 N O3 -","- C11 H18 F3 N O3 -","- C22 H36 F6 N2 O6 -","2","0.5","NA6209","Breitung, Sven; Lerner, Hans-Wolfram; Bolte, Michael","2,2,6,6-Tetramethyl-4-oxopiperidinium trifluoroacetate","Acta Crystallographica Section E","2003","59","4","o445","o446","10.1107/S1600536803004938","","","0.71073","MoKα","","0.0673","0.0494","","","0.1315","0.1409","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202069","13.3208","0.0005","12.5015","0.0004","8.9448","0.0004","90","","102.859","0.003","90","","1452.22","0.1","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6-Methyl-4-phenylthieno[2,3-b]pyridine-2,5-dicarboxylic acid","","- C16 H11 N O4 S -","- C16 H11 N O4 S -","- C64 H44 N4 O16 S4 -","4","1","NA6210","Héctor Novoa de Armas; Oswald M. Peeters; Norbert M. Blaton; Camiel J. De Ranter; Margarita Suárez Navarro; Esperanza Salfrán Solano; Yamila Verdecia Reyes; Estael Ochoa Rodríguez","6-Methyl-4-phenylthieno[2,3-<i>b</i>]pyridine-2,5-dicarboxylic acid","Acta Crystallographica Section E","2003","59","4","o450","o452","10.1107/S1600536803005464","","","1.5418","CuKα","","0.0981","0.0549","","0.1671","","0.1671","","","1.111","","","1.111","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202070","5.428","0.012","10.368","0.006","17.625","0.009","102.82","0.05","94.1","0.14","100.5","0.09","944","2","100","","","","","","","","","","","3","P -1","-P 1","2","","(RS)-phenylsuccinic acid","","- C10 H10 O4 -","- C10 H10 O4 -","- C40 H40 O16 -","4","2","NA6211","Andreas Fischer; Veronica M. Profir","(<i>RS</i>)-Phenylsuccinic acid","Acta Crystallographica Section E","2003","59","4","o485","o487","10.1107/S1600536803005658","","","0.71073","MoKα","","0.107","0.0562","","","0.113","0.1334","","","","","","1.032","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202071","9.7007","0.0019","14.114","0.003","15.61","0.003","90","","97.32","0.03","90","","2119.8","0.7","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4,4'-Dibromobiphenyl","","- C12 H8 Br2 -","- C12 H8 Br2 -","- C96 H64 Br16 -","8","2","NA6212","Mohamed, Ajax; Auner, Norbert; Bolte, Michael","Redetermination of 4,4'-dibromobiphenyl","Acta Crystallographica Section E","2003","59","4","o476","o477","10.1107/S1600536803005579","","","0.71073","MoKα","","0.0664","0.0364","","","0.0704","0.0769","","","","","","0.874","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202072","17.7766","0.0002","20.4108","0.0001","32.0452","0.0002","90","","90","","90","","11627.1","0.16","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(5,11,17,23-Tetra-t-butyl-26,28-dihydroxy-25,27-bis(ethoxycarbonylmethoxy)-pen tacyclo(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) clathrate chloroform solvate","","- C54 H70 Cl6 O8 -","- C54 H70 Cl6 O8 -","- C432 H560 Cl48 O64 -","8","1","NA6213","Bolte, Michael; Danila, Crenguta; Böhmer, Volker","Redetermination of 5,11,17,23-tetra-<i>tert</i>-butyl-25,27-di(ethoxycarbonylmethoxy)-26,28-dihydroxycalix[4]arene chloroform disolvate at low temperature","Acta Crystallographica Section E","2003","59","4","o533","o534","10.1107/S1600536803006032","","","0.71073","MoKα","","0.1345","0.0945","","","0.2619","0.2973","","","","","","1.008","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202073","14.0208","0.0009","10.2305","0.0007","16.9031","0.0011","90","","109.63","0.005","90","","2283.7","0.3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tris(N,N-diethyldithiocarbamato-κ^2^S,S')nickel(II)","","- C15 H30 N3 Ni S6 -","- C15 H30 N3 Ni S6 -","- C60 H120 N12 Ni4 S24 -","4","0.5","NA6214","Mohamed, Ajax K.; Auner, Norbert; Bolte, Michael","Tris(<i>N,N</i>-diethyldithiocarbamato-κ^2^<i>S,S</i>')nickel(II)","Acta Crystallographica Section E","2003","59","4","m188","m189","10.1107/S1600536803006044","","","0.71073","MoKα","","0.03","0.0224","","","0.0585","0.0605","","","","","","0.955","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202074","27.735","0.002","12.3703","0.0007","17.8281","0.0012","90","","100.829","0.006","90","","6007.7","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","bis(N,N-diethyldithiocarbamato-κS)dimethyltin(IV)","","- C12 H26 N2 S4 Sn -","- C12 H26 N2 S4 Sn -","- C144 H312 N24 S48 Sn12 -","12","1.5","NA6215","Mohamed, Ajax K.; Auner, Norbert; Bolte, Michael","Redetermination of bis(<i>N,N</i>-diethyldithiocarbamato-κ<i>S</i>)dimethyltin(IV) at low temperature","Acta Crystallographica Section E","2003","59","4","m190","m191","10.1107/S1600536803006056","","","0.71073","MoKα","","0.0455","0.0262","","","0.0503","0.052","","","","","","0.965","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202075","10.8485","0.0002","14.4584","0.0004","14.0433","0.0004","90","","106.84","0.001","90","","2108.26","0.09","120","0.2","120","0.2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-(Benzotriazol-1-ylmethyl)-5-(4-dimethylaminophenyl)-3- phenyl-4,5-dihydro-1H-pyrazole","","- C24 H24 N6 -","- C24 H24 N6 -","- C96 H96 N24 -","4","1","NA6216","Low, John Nicolson; Cobo, Justo; Arroyabe, Frank; Torres, Harlen; Abonia, Rodrigo; Nogueras, Manuel","1-(Benzotriazol-1-ylmethyl)-5-(4-dimethylaminophenyl)-3-phenyl-4,5-dihydro-1<i>H</i>-pyrazole","Acta Crystallographica Section E","2003","59","4","o517","o518","10.1107/S1600536803006068","","","0.71073","MoKα","","0.0927","0.0548","","","0.1201","0.1376","","","","","","1.026","","","","has coordinates,has Fobs","201369","2020-10-21","18:00:00",""
"2202076","11.43","0.002","12.24","0.002","12.96","0.003","65.33","0.03","80.6","0.03","69.44","0.03","1542.4","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","8-[N-(tert-Butoxycarbonyl)-L-glycyl]quinolin-8-amine","","- C16 H19 N3 O3 -","- C16 H19 N3 O3 -","- C64 H76 N12 O12 -","4","2","NA6217","Ying Shao; Chao Tu; Junyong Zhang; Zijian Guo","8-[<i>N</i>-(<i>tert</i>-Butoxycarbonyl)-<small>L</small>-glycyl]quinolin-8-amine","Acta Crystallographica Section E","2003","59","4","o527","o529","10.1107/S160053680300607X","","","0.71073","MoKα","","0.0895","0.0494","","","0.153","0.1776","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202077","31.7081","0.0008","7.8174","0.0002","15.4208","0.0005","90","","104.344","0.001","90","","3703.27","0.18","120","0.2","120","0.2","","","","","","","","5","C 1 c 1","C -2yc","9","1-chloroacetyl-2,4-diphenyl-2,3-dihydro-1H-1,5-benzodiazepine","2-chloro-1-(2,4-diphenyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)-1-ethanone","","- C23 H19 Cl N2 O -","- C23 H19 Cl N2 O -","- C184 H152 Cl8 N16 O8 -","8","2","NA6218","Low, John Nicolson; Cobo, Justo; Insuasty, Braulio; Insuasty, Henry; Díaz, Emilso; Escobar, Henry","1-Chloroacetyl-2,4-diphenyl-2,3-dihydro-1<i>H</i>-1,5-benzodiazepine","Acta Crystallographica Section E","2003","59","5","o603","o605","10.1107/S1600536803007220","","","0.71073","MoKα","","0.108","0.0685","","","0.1667","0.2013","","","","","","1.043","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202078","10.828","0.0002","9.8064","0.0002","10.1768","0.0002","90","","94.307","0.001","90","","1077.56","0.04","190","","190","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,4,4-trifluoro-trans-2-butenoic acid","","- C4 H3 F3 O2 -","- C4 H3 F3 O2 -","- C32 H24 F24 O16 -","8","2","NA6219","Hulme, Ashley T.; David Watkin","4,4,4-Trifluoro-<i>trans</i>-2-butenoic acid","Acta Crystallographica Section E","2003","59","5","o665","o666","10.1107/S1600536803007700","","","0.71073","MoKα","","0.05","0.0393","","0.0999","0.0951","0.0999","","","","","","0.9878","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202079","6.811","0.002","9.95","0.001","13.442","0.002","88.14","0.01","79.12","0.02","89.54","0.01","894.1","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","N'-(4-Chlorobenzoyl)-N,N-diphenylthiourea","","- C20 H15 Cl N2 O S -","- C20 H15 Cl N2 O S -","- C40 H30 Cl2 N4 O2 S2 -","2","1","NA6220","Arslan, Hakan; Flörke, Ulrich; Külcü, Nevzat","<i>N</i>'-(4-Chlorobenzoyl)-<i>N,N</i>-diphenylthiourea","Acta Crystallographica Section E","2003","59","5","o641","o642","10.1107/S1600536803007992","","","0.71073","MoKα","","0.0659","0.0411","","","0.1013","0.1216","","","","","","1.078","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202080","10.2608","0.0008","10.991","0.0006","11.2485","0.0008","63.656","0.004","63.573","0.003","77.08","0.005","1017.49","0.13","120","0.2","120","0.2","","","","","","","","4","P -1","-P 1","2","","5-(1,3-benzodioxol-5-yl)-3-methyl-1,7-diphenyl-1,6,7,8-tetrahydropyrazolo [3,4-b][1,4]diazepine","","- C26 H22 N4 O2 -","- C25.995 H22 N4 O2 -","- C51.99 H44 N8 O4 -","2","1","NA6221","Low, John Nicolson; Insuasty, Braulio; Mosquera, Mónica; Cobo, Justo","5-(1,3-Benzodioxol-5-yl)-3-methyl-1,7-diphenyl-1,6,7,8-tetrahydropyrazolo[3,4-<i>b</i>][1,4]diazepine","Acta Crystallographica Section E","2003","59","5","o614","o615","10.1107/S1600536803007542","","","0.71073","MoKα","","0.0978","0.056","","","0.1328","0.151","","","","","","1.035","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202081","8.533","0.004","14.753","0.006","16.241","0.007","90","","90","","90","","2044.5","1.5","183","2","183","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","[Dimethyl(dimethylamino)silicyl]benzyl-κ^2^C,N](N,N,N,N-tetramethylenediamine- κ^2^N,N)lithium(I)","","- C17 H34 Li N3 Si -","- C17 H34 Li N3 Si -","- C68 H136 Li4 N12 Si4 -","4","1","NA6222","He-Ping Shi; Dian-Sheng Liu; Shu-Ping Huang","[Benzyldimethyl(dimethylamino)silyl-κ^2^<i>C,N</i>](<i>N,N,N,N</i>-tetramethylenediamine-κ^2^<i>N,N</i>)lithium(I)","Acta Crystallographica Section E","2003","59","6","m319","m321","10.1107/S1600536803008997","","","0.71073","MoKα","","0.1656","0.0765","","","0.0817","0.1037","","","","","","0.834","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202082","7.8382","0.0002","17.5688","0.0006","9.1123","0.0002","90","","113.269","0.001","90","","1152.77","0.06","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N-Dimethyl-N'-phenylformamidinium perchlorate","","- C9 H13 Cl N2 O4 -","- C9 H13 Cl N2 O4 -","- C36 H52 Cl4 N8 O16 -","4","1","NA6223","M. Yogavel; P. G. Aravindan; D. Velmurugan; P. T. Perumal; S. Shanmuga Sundara Raj; H.-K. Fun","<i>N,N</i>-Dimethyl-<i>N</i>'-phenylformamidinium perchlorate","Acta Crystallographica Section E","2003","59","5","o662","o664","10.1107/S1600536803007633","","","0.71073","MoKα","","0.0821","0.0508","","","0.1334","0.1532","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202083","6.992","0.007","9.539","0.002","10.098","0.002","84.36","0.02","79.54","0.04","74.71","0.06","638","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Pyridinuim oxalate oxalic acid dihydrate","Pyridinium oxalate oxalic acid dihydrate","","- C9 H13 N O10 -","- C9 H13 N O10 -","- C18 H26 N2 O20 -","2","1","NA6224","K. Rajagopal; R. V. Krishnakumar; S. Natarajan","Pyridinium oxalate(1‒) oxalic acid dihydrate","Acta Crystallographica Section E","2003","59","6","o742","o744","10.1107/S1600536803009164","","","0.71073","MoKα","","0.043","0.037","","","0.1059","0.1127","","","","","","1.092","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202084","14.2924","0.0017","5.406","0.0006","25.969","0.003","90","","96.53","0.002","90","","1993.5","0.4","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C11 H16 O2 -","- C11 H16 O2 -","- C88 H128 O16 -","8","2","NA6225","Kayal, Nijhuma; McKee, Vickie","6,7-Dimethyl-3,4,4a,7,8,8a-hexahydroisochromen-1-one","Acta Crystallographica Section E","2003","59","5","o701","o702","10.1107/S160053680300864X","","","0.71073","MoKα","","0.0628","0.04","","","0.0899","0.0998","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202085","17.083","0.003","4.549","0.001","14.279","0.003","90","","102.44","0.03","90","","1083.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-benzoyl-N'-(2-hydroxyethyl)-Thiourea","","- C10 H12 N2 O2 S -","- C10 H12 N2 O2 S -","- C40 H48 N8 O8 S4 -","4","1","NA6226","Zhang, You-Ming; Xian, Liang; Wei, Tai-Bao; Cai, Li-Xiang","<i>N</i>-Benzoyl-<i>N</i>'-(2-hydroxyethyl)thiourea","Acta Crystallographica Section E","2003","59","6","o817","o819","10.1107/S1600536803010213","","","0.71073","MoKα","","0.056","0.0445","","","0.1236","0.138","","","","","","1.085","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202086","25.086","0.005","7.1225","0.0014","8.2529","0.0017","90","","104.87","0.003","90","","1425.2","0.5","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C14 H16 N2 O6 -","- C14 H16 N2 O6 -","- C56 H64 N8 O24 -","4","0.5","NA6227","Itzia I. Padilla-Martínez; María Chaparro-Huerta; Francisco J. Martínez-Martínez; Herbert Höpfl; Efrén V. García-Báez","Diethyl <i>N</i>,<i>N</i>'-<i>m</i>-phenylenedioxamate","Acta Crystallographica Section E","2003","59","6","o825","o827","10.1107/S1600536803010225","","","0.71073","MoKα","","0.0633","0.0576","","","0.1212","0.1239","","","","","","1.22","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202087","16.0813","0.0001","18.0049","0.0002","28.1089","0.0003","90","","95.417","0.001","90","","8102.37","0.14","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","Sb Ag3 Cl4 S2 P6 F6 C77 H72","","","- C77 H72 Ag3 Cl4 F6 P6 S2 Sb -","- C77 H72 Ag3 Cl4 F6 P6 S2 Sb -","- C308 H288 Ag12 Cl16 F24 P24 S8 Sb4 -","4","1","NA6228","Qin, Yong-Hai; Wu, Mei-Mei; Chen, Zhong-Ning","Tris[μ-bis(diphenylphosphino)methane-κ^2^<i>P</i>:<i>P</i>']di-μ~3~-sulfanido-trisilver(I) hexafluoroantimonate dichloromethane disolvate","Acta Crystallographica Section E","2003","59","6","m317","m318","10.1107/S1600536803009668","","","0.71073","MoKα","","0.1215","0.0802","","","0.1766","0.2096","","","","","","1.209","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202088","7.311","0.0014","17.5535","0.0015","7.7836","0.0015","90","","104.984","0.014","90","","964.9","0.3","170","2","170","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[1,2-Bis(methylthio)ethane-S,S']dichlorozinc(II)","[1,2-Bis(methylthio)ethane-S,S']dichlorozinc(II)","","- C4 H10 Cl2 S2 Zn -","- C4 H10 Cl2 S2 Zn -","- C16 H40 Cl8 S8 Zn4 -","4","1","NA6229","Parvez, Masood; Clark, Peter D.; Yao, Hong","[1,2-Bis(methylthio)ethane-κ^2^<i>S,S</i>']dichlorozinc(II)","Acta Crystallographica Section E","2003","59","6","m313","m314","10.1107/S1600536803009498","","","0.71069","MoKα","","0.088","0.04","","","0.101","0.117","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202089","11.138","0.006","8.102","0.002","13.307","0.002","90","","91.82","0.02","90","","1200.2","0.7","170","2","170","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","trans-2,3-bis(methylsulfonyl)indane","trans-2,3-bis(methylsulfonyl)indane","","- C11 H14 O4 S2 -","- C11 H14 O4 S2 -","- C44 H56 O16 S8 -","4","1","NA6230","Parvez, Masood; Clark, Peter D.; Primak, Alex","<i>trans</i>-2,3-Bis(methylsulfonyl)indane","Acta Crystallographica Section E","2003","59","6","o783","o785","10.1107/S1600536803009504","","","0.71069","MoKα","","0.151","0.042","","","0.1","0.134","","","","","","0.98","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202090","7.93","0.005","8.147","0.005","20.58","0.005","90","","90","","90","","1329.6","1.2","293","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C8 H12 Br3 N Pb -","- C8 H12 Br3 N Pb -","- C32 H48 Br12 N4 Pb4 -","4","1","NA6231","Billing, David G.; Lemmerer, Andreas","Bis[(<i>S</i>)-β-phenethylammonium] tribromoplumbate(II)","Acta Crystallographica Section E","2003","59","6","m381","m383","10.1107/S1600536803010985","","","0.71069","MoKα","","","0.0331","","","","0.065","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202091","25.6017","0.0013","9.5475","0.0004","23.6965","0.0016","90","","105.343","0.005","90","","5585.7","0.5","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C20 H33 Cl2 N2 O6.5 P2 Pt -","- C20 H33 Cl2 N2 O6.5 P2 Pt -","- C160 H264 Cl16 N16 O52 P16 Pt8 -","8","1","NA6232","Chęcińska, Lilianna; Małecka, Magdalena; Ochocki, Justyn; Aranowska, Katarzyna","<i>cis</i>-Dichlorobis(diethyl 2-pyridylmethylphosphonate-κ<i>N</i>)platinum(II) hemihydrate, <i>cis</i>-[PtCl~2~(2-pmpe)~2~]·0.5H~2~O","Acta Crystallographica Section E","2003","59","6","m350","m352","10.1107/S160053680301002X","","","0.71073","MoKα","","0.052","0.0362","","","0.0816","0.0891","","","","","","1.015","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2202092","5.6712","0.001","8.1749","0.0014","10.1055","0.0017","104.74","0.014","104.392","0.013","98.097","0.014","428.33","0.14","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H10 N2 O -","- C10 H10 N2 O -","- C20 H20 N4 O2 -","2","1","NA6233","Abourichaa, Said; Benchat, Noureddine; Anaflous, Abderahlmane; Melhaoui, Amina; Ben-Hadda, Taibi; Oussaid, Boualem; El Bali, Brahim; Bolte, Michael","6-Phenyl-4,5-dihydropyridazin-3(2<i>H</i>)-one","Acta Crystallographica Section E","2003","59","6","o802","o803","10.1107/S1600536803010018","","","0.71073","MoKα","","0.0378","0.034","","","0.0966","0.0984","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202093","21.106","0.001","6.935","0.0003","8.4284","0.0005","90","","97.5468","0.0018","90","","1222.98","0.11","150","","150","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C4 H12 N2 O9 S U -","- C4 H12 N2 O9 S U -","- C16 H48 N8 O36 S4 U4 -","4","0.5","NA6235","Doran, Michael B.; Norquist, Alexander J.; O'Hare, Dermot","<i>catena</i>-Poly[tetramethylammonium [[(nitrato-κ^2^<i>O,O</i>')dioxouranium]-μ~3~-sulfato]]","Acta Crystallographica Section E","2003","59","6","m373","m375","10.1107/S1600536803010808","","","0.71073","MoKα","","","0.0245","","","","0.0483","","","","","","0.8619","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202094","8.982","0.0009","10.935","0.002","11.296","0.002","114.15","0.01","103.67","0.01","101.72","0.01","925.7","0.3","233","1","233","1","","","","","","","","4","P -1","-P 1","2","","[Bis(μ-di-tert-butylphosphido)bis(triethylphosphine)palladium(I)]","","- C28 H66 P4 Pd2 -","- C28 H66 P4 Pd2 -","- C28 H66 P4 Pd2 -","1","0.5","NA6236","Englert, Ulli; Matern, Eberhard; Olkowska-Oetzel, Jolanta; Pikies, Jerzy","Bis(μ-di-<i>tert</i>-butylphosphido)bis[(triethylphosphine)palladium(I)](<i>Pd</i>—<i>Pd</i>)","Acta Crystallographica Section E","2003","59","6","m376","m377","10.1107/S160053680301081X","","","0.71073","MoKα","","0.0481","0.0435","","","0.1325","0.1341","","","","","","1.025","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202095","9.761","0.0003","5.2219","0.0002","14.1713","0.0004","90","","90","","90","","722.32","0.04","298","2","298","2","","","","","","","","5","P 21 c a","P -2ac 2a","29","","Diaquaiminodiacetatonickel(II)","","- C4 H9 N Ni O6 -","- C4 H9 N Ni O6 -","- C16 H36 N4 Ni4 O24 -","4","1","NA6238","Wu, Yan-Rong; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","Diaquaiminodiacetatonickel(II)","Acta Crystallographica Section E","2003","59","6","m390","m392","10.1107/S1600536803011279","","","0.71073","MoKα","","0.055","0.054","","","0.105","0.105","","","","","","1.25","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202096","12.1315","0.0009","11.7075","0.0019","26.177","0.003","90","","99.728","0.009","90","","3664.4","0.8","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","r-2,c-6-bis(4-chlorophenyl)-3,5-dimethyltetrahydropyran-t-4-ol","","- C19 H20 Cl2 O2 -","- C19 H20 Cl2 O2 -","- C152 H160 Cl16 O16 -","8","2","OB6197","Krishnamoorthy, Belli Sundaram; Sarangarajan, Thanjavur Ramabhadran; Thanikachalam, Kanagasabapathy; Panchanatheswaran, Krishnaswamy; Jeyaraman, Ramasubbu","<i>r</i>-2,<i>c</i>-6-Bis(4-chlorophenyl)-3,5-dimethyltetrahydropyran-<i>t</i>-4-ol","Acta Crystallographica Section E","2003","59","2","o111","o113","10.1107/S1600536802023310","","","0.71069","MoKα","","0.0724","0.0526","","","0.1275","0.1463","","","","","","1.063","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202097","8.438","0.002","10.76","0.003","12.538","0.003","90.26","0.03","98.22","0.02","109.54","0.03","1060.1","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Trimethoprim terephthalate terephthalic acid","2,4-diamino-5-(3,4,5-trimethoxybenzyl)pyrimidin-1-ium terephthalate terephthalic acid","","- C44 H48 N8 O14 -","- C44 H48 N8 O14 -","- C44 H48 N8 O14 -","1","0.5","OB6198","Madhukar Hemamalini; Packianathan Thomas Muthiah; Gabriele Bocelli; Andrea Cantoni","Hydrogen-bonded supramolecular motifs in trimethoprim‒terephthalate‒terephthalic acid (2/1/1)","Acta Crystallographica Section E","2003","59","1","o14","o17","10.1107/S1600536802021670","","","0.71069","MoKα","","0.0629","0.0453","","","0.1265","0.1356","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202098","7.982","0.001","12.364","0.002","13.978","0.002","105.43","0.01","92.45","0.01","108.34","0.01","1250.1","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H13 N2 Ni O2 S10 -","- C19 H13 N2 Ni O2 S10 -","- C38 H26 N4 Ni2 O4 S20 -","2","1","OB6200","Tong, Wen-Jun; Liu, Ling; Meng, Qing-Jin; Li, Yi-Zhi; Yao, Yuan-Gen","1-Methyl-<i>N</i>-(4-nitrobenzyl)pyridinium bis(2-thioxo-1,3-dithiole-4,5-dithiolato)nickelate(III)","Acta Crystallographica Section E","2003","59","1","m3","m5","10.1107/S1600536802022006","","","0.71073","MoKα","","0.1065","0.0558","","","0.0921","0.1022","","","","","","1.012","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202099","9.261","0.001","14.422","0.002","10.929","0.001","90","","90","","90","","1459.7","0.3","295","","295","","","","","","","","","7","I b a m","-I 2 2c","72","","catena-Poly[bis(ethylenediamine)platinum(II,IV)-μ-chloro bis(hydrogensulfate)]","","- C8 H36 Cl2 N8 O16 Pt2 S4 -","- C8 H36 Cl2 N8 O16 Pt2 S4 -","- C16 H72 Cl4 N16 O32 Pt4 S8 -","2","0.125","OB6201","Matsushita, Nobuyuki","A one-dimensional Cl-bridged Pt^II/IV^ mixed-valence complex, <i>catena</i>-poly[[bis(ethylenediamine)platinum(II)-μ-chloro-bis(ethylenediamine)platinum(IV)-μ-chloro] tetrakis(hydrogensulfate)]","Acta Crystallographica Section E","2003","59","1","m26","m28","10.1107/S1600536802022584","","","0.71069","MoKα","","","0.0236","","","0.0479","0.0479","","","","","","1.143","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202100","11.2032","0.001","12.349","0.002","18.973","0.005","108.89","0.01","105.09","0.01","91.66","0.01","2379.4","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Spiro[3,4-di(4-chlorophenyl)-4,5-dihydroisoxazole-5,3'-flavan-4'-one]","","- C29 H19 Cl2 N O3 -","- C29 H19 Cl2 N O3 -","- C116 H76 Cl8 N4 O12 -","4","2","OB6202","A. Jeyabharathi; M. N. Ponnuswamy; S. Manikandan; R. Raghunathan","Spiro[3,4-bis(4-chlorophenyl)-4,5-dihydroisoxazole-5,3'-flavan-4'-one]","Acta Crystallographica Section E","2003","59","2","o237","o239","10.1107/S1600536803001387","","","1.5418","CuKα","","0.0695","0.0436","","","0.1228","0.1386","","","","","","1.017","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202101","14.139","0.002","10.939","0.002","16.139","0.003","90","","99.809","0.013","90","","2459.7","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Spiro[3-(4-chlorophenyl)-4-(4-methylphenyl)-4,5-dihydroisoxazole-5,3'- flavan-4'-one]","","- C30 H22 Cl N O3 -","- C30 H22 Cl N O3 -","- C120 H88 Cl4 N4 O12 -","4","1","OB6203","A. Jeyabharathi; M. N. Ponnuswamy; S. Manikandan; R. Raghunathan","Spiro[3-(4-chlorophenyl)-4-(4-methylphenyl)-4,5-dihydroisoxazole-5,3'-flavan-4'-one]","Acta Crystallographica Section E","2003","59","2","o240","o241","10.1107/S1600536803001399","","","1.5418","CuKα","","0.127","0.0468","","","0.1184","0.1484","","","","","","0.981","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202102","7.509","0.001","26.634","0.002","7.854","0.001","90","","117.34","0.01","90","","1395.3","0.3","180","2","180","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","N-[3,5-bis(trifluoromethyl)benzene]-salicylaldimine","","- C15 H9 F6 N O -","- C15 H9 F6 N O -","- C60 H36 F24 N4 O4 -","4","1","OB6204","Karadayı, Nevzat; Gözüyes̨il, Sanem; Güzel, Bilgehan; Büyükgüngör, Orhan","<i>N</i>-[3,5-Bis(trifluoromethyl)phenyl]salicylaldimine","Acta Crystallographica Section E","2003","59","2","o161","o163","10.1107/S1600536803000722","","","0.71073","MoKα","","0.1209","0.0631","","","0.1507","0.1912","","","","","","1.063","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202103","12.8492","0.0011","5.1963","0.0005","19.5971","0.0018","90","","104.484","0.002","90","","1266.9","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-Benzoyl- N'-Phenylthiourea","","- C14 H12 N2 O S -","- C14 H12 N2 O S -","- C56 H48 N8 O4 S4 -","4","1","OB6205","Bohari M. Yamin; M. Sukeri M. Yusof","<i>N</i>-Benzoyl-<i>N</i>'-phenylthiourea","Acta Crystallographica Section E","2003","59","2","o151","o152","10.1107/S1600536802023711","","","0.71073","MoKα","","0.056","0.0449","","","0.1166","0.1252","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202104","21.7363","0.001","12.9552","0.0006","3.9938","0.0005","90","","90","","90","","1124.65","0.16","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","4,5-ethylenedioxy[1,2,5]thiadiazolotetrathiafulvalene","5-(4,5-ethylenedioxy-1,3-dithiol-2-ylidene)-1,3,2,4,6-diazatrithiapentalene","","- C8 H4 N2 O2 S5 -","- C8 H4 N2 O2 S5 -","- C32 H16 N8 O8 S20 -","4","1","OB6206","Tomura, Masaaki; Yamashita, Yoshiro","An unsymmetrical tetrathiafulvalene with a fused 1,2,5-thiadiazole ring and an ethylenedioxy group","Acta Crystallographica Section E","2003","59","2","o145","o147","10.1107/S1600536802023723","","","1.54178","CuKα","","0.1509","0.0631","","","0.1416","0.1735","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202105","5.3279","0.001","8.9739","0.0017","12.195","0.002","99.734","0.003","92.495","0.004","100.19","0.004","563.99","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H16 Cu N4 O4 -","- C26 H16 Cu N4 O4 -","- C26 H16 Cu N4 O4 -","1","0.5","OB6207","Hong-Yin He; Long-Guan Zhu","<i>catena</i>-Poly[[bis(4-cyanobenzoato)copper(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2003","59","2","o174","o176","10.1107/S1600536803000989","","","0.71073","MoKα","","0.0634","0.0514","","","0.0913","0.0962","","","","","","0.952","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202106","5.47","0.005","11.413","0.007","12.131","0.009","80.493","0.006","79.839","0.008","76.896","0.009","719.8","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H11 N5 O6 S -","- C12 H11 N5 O6 S -","- C24 H22 N10 O12 S2 -","2","1","OB6208","Ning Ma; Zhengming Li; Jianguo Wang; Haibin Song","1-(4-Methoxypyrimidin-2-yl)-3-(2-nitrophenylsulfonyl)urea","Acta Crystallographica Section E","2003","59","3","o275","o276","10.1107/S1600536803001181","","","0.71073","MoKα","","0.1009","0.0522","","","0.1009","0.1171","","","","","","1.017","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202107","5.9476","0.0008","14.613","0.008","12.85","0.006","90","","97.436","0.006","90","","1107.4","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-(3-chlorophenyl)-α-(2-hydroxyphenyl)nitrone","","- C13 H10 Cl N O2 -","- C13 H10 Cl N O2 -","- C52 H40 Cl4 N4 O8 -","4","1","OB6209","Mothi Mohamed, Ebrahim; Chandrasekar, Srinivasan; Panchanatheswaran, Krishnaswamy","<i>N</i>-(3-Chlorophenyl)-α-(2-hydroxyphenyl)nitrone: supramolecular aggregation through π‒π and C‒H···π interactions","Acta Crystallographica Section E","2003","59","2","o234","o236","10.1107/S1600536803001326","","","1.5418","CuKα","","0.0414","0.034","","","0.0903","0.0974","","","","","","1.056","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202108","4.928","0.003","11.103","0.003","14.462","0.002","90","","98.39","0.02","90","","782.8","0.5","223.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","trans-N,N'-dimethylquinacridone","","","- C22 H16 N2 O2 -","- C22 H16 N2 O2 -","- C44 H32 N4 O4 -","2","0.5","OB6210","Mizuguchi, Jin; Senju, Takatoshi","Reinvestigation of 5,12-dihydro-5,12-dimethylquino[2,3-<i>b</i>]acridine-7,4-dione","Acta Crystallographica Section E","2003","59","2","o232","o233","10.1107/S1600536803001612","","","0.7107","MoKα","","","0.0441","","","","0.1263","","","","","","1.589","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202109","22.278","0.004","10.076","0.003","13.496","0.002","90","","102.29","0.03","90","","2960.1","1.2","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","Zinc ferron pentahydrate","μ-7-iodo-8-hydroxyquinoline-5-sulfonato-κ^3^N,O:O')bis[triaquazinc(II)] tetrahydrate","","- C18 H28 I2 N2 O18 S2 Zn2 -","- C18 H28 I2 N2 O18 S2 Zn2 -","- C72 H112 I8 N8 O72 S8 Zn8 -","4","0.5","OB6211","Savarimuthu Francis; Packianathan Thomas Muthiah; Gabriele Bocelli; Andrea Cantoni","Bis(μ-8-hydroxy-7-iodoquinoline-5-sulfonato-κ^3^<i>N,O</i>:<i>O</i>')bis[triaquazinc(II)] tetrahydrate","Acta Crystallographica Section E","2003","59","2","m87","m90","10.1107/S1600536803001922","","","0.71069","MoKα","","0.054","0.0276","","","0.0554","0.0612","","","","","","0.896","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202110","10.87","0.002","18.932","0.002","22.135","0.003","90","","90","","90","","4555.2","1.1","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(Benzoylmethyl)triphenylphosphonium iodide","","- C26 H22 I O P -","- C26 H22 I O P -","- C208 H176 I8 O8 P8 -","8","1","OB6212","Mahimaidoss Baby Mariyatra; Balasubramanian Kalyanasundari; Krishanaswamy Panchanatheswaran; Goeta, Andres E.","(Benzoylmethyl)triphenylphosphonium iodide: supramolecular zigzag chains <i>via</i> C—H···O hydrogen bonding stabilized by C—H···I interactions","Acta Crystallographica Section E","2003","59","2","o255","o257","10.1107/S1600536803002137","","","0.71073","MoKα","","0.033","0.0258","","","0.055","0.0573","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202111","7.5844","0.0011","10.0804","0.0014","12.1698","0.0016","90","","105.726","0.003","90","","895.6","0.2","293","2","570","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","[4](1)(2,3-diazabuta-1,3-dien)ferrocenophane","","- C22 H20 Fe2 N2 -","- C22 H20 Fe2 N2 -","- C44 H40 Fe4 N4 -","2","0.5","OB6213","Bohari M. Yamin; Ali, Noorshida M.","[4](1)(2,3-Diazabuta-1,3-diene)ferrocenophane","Acta Crystallographica Section E","2003","59","3","m95","m96","10.1107/S1600536803002691","","","0.71073","MoKα","","0.093","0.059","","","0.124","0.136","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202112","4.667","0.001","19.72","0.003","7.037","0.001","90","","107.08","0.01","90","","619.07","0.19","288","2","288","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,1'-(1,2-Ethanediyl)bis(2,3-dihydro-3-methyl-1H-imidazole-2-thione)","","- C10 H14 N4 S2 -","- C10 H14 N4 S2 -","- C20 H28 N8 S4 -","2","0.5","OB6214","Qingjian Liu; Daqing Shi; Kaibei Yu; Jianhua Xu","1,1'-(1,2-Ethanediyl)bis(2,3-dihydro-3-methyl-1<i>H</i>-imidazole-2-thione)","Acta Crystallographica Section E","2003","59","3","o356","o357","10.1107/S1600536803003623","","","0.71073","MoKα","","0.0585","0.0387","","","0.0967","0.1036","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202113","6.4127","0.0011","15.486","0.003","12.805","0.002","90","","93.971","0.003","90","","1268.6","0.4","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N,N'-Bis(benzamidothiocarbonyl)hydrazine dimethyl sulfoxide disolvate","","- C20 H26 N4 O4 S4 -","- C20 H26 N4 O4 S4 -","- C40 H52 N8 O8 S8 -","2","0.5","OB6215","Bohari M. Yamin; M.Sukeri M. Yusof","<i>N,N</i>'-Bis(benzamidothiocarbonyl)hydrazine dimethyl sulfoxide disolvate","Acta Crystallographica Section E","2003","59","3","o358","o359","10.1107/S1600536803003635","","","0.71073","MoKα","","0.084","0.055","","","0.121","0.135","","","","","","1.03","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202114","8.9441","0.0018","11.222","0.002","11.489","0.002","69.21","0.03","71.47","0.03","83.99","0.03","1022.1","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Diethyl 2-methyl-6-(2-thiazolidinyl)-4-(2-thienyl-1,4-dihydropyridine- -3,5-dicarboxylate","","- C19 H24 N2 O4 S2 -","- C19 H24 N2 O4 S2 -","- C38 H48 N4 O8 S4 -","2","1","OB6216","Vrábel, Viktor; Kožíšek, Jozef; Marchalín, Štefan","Diethyl 2-methyl-6-(2-thiazolidinyl)-4-(2-thienyl)-1,4-dihydropyridine-3,5-dicarboxylate","Acta Crystallographica Section E","2003","59","3","o376","o377","10.1107/S1600536803004124","","","0.71073","MoKα","","0.1397","0.0551","","","0.1094","0.125","","","","","","0.955","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202115","6.2129","0.0013","17.801","0.004","19.442","0.004","90","","90.765","0.004","90","","2150","0.8","183","2","183","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","bis-N-methylpyrrole dipeptides","Dimethyl{3-[1-methyl-4-(1-methyl-4-nitropyrrole-2-carboxamido)pyrrole-2- carboxamido]propyl}ammonium chloride monomethanol","","- C18 H29 Cl N6 O5 -","- C18 H29 Cl N6 O5 -","- C72 H116 Cl4 N24 O20 -","4","1","OB6217","Lu, Liping; Zhu, Miaoli; Li, Jianfeng; Yang, Pin","Dimethyl{3-[1-methyl-4-(1-methyl-4-nitropyrrole-2-carboxamido)pyrrole-2-carboxamido]propyl}ammonium chloride methanol solvate","Acta Crystallographica Section E","2003","59","4","o417","o419","10.1107/S1600536803004677","","","0.71073","MoKα","","0.1186","0.0682","","","0.0805","0.0965","","","","","","0.98","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202116","7.659","0.002","7.1731","0.0017","20.468","0.004","90","","95.454","0.018","90","","1119.4","0.5","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H11 N O5 -","- C12 H11 N O5 -","- C48 H44 N4 O20 -","4","1","OB6218","Takeo Fukunaga; Setsuo Kashino; Hiroyuki Ishida","3-Hydroxypyridinium 2,5-dihydroxybenzoate","Acta Crystallographica Section E","2003","59","4","o420","o422","10.1107/S1600536803004525","","","0.71073","MoKα","","0.066","0.056","","0.179","","0.179","","","1.1","","","1.1","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202117","12.798","0.002","10.466","0.001","19.215","0.003","90","","108.1","0.01","90","","2446.4","0.6","93.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H28 N2 O6 -","- C28 H28 N2 O6 -","- C112 H112 N8 O24 -","4","1","OB6220","Mizuguchi, Jin","The β-form of di-<i>tert</i>-butyl 1,4-dioxo-3,6-diphenyl-1,2,4,5-tetrahydropyrrolo[3,4-<i>c</i>]pyrrole-2,5-dicarboxylate","Acta Crystallographica Section E","2003","59","4","o469","o471","10.1107/S1600536803005300","","","1.5418","CuKα","","","0.0575","","","","0.1255","","","","","","0.883","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202118","7.148","0.001","14.148","0.003","13.065","0.002","90","","95.729","0.008","90","","1314.7","0.4","93.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H32 N2 O6 -","- C30 H32 N2 O6 -","- C60 H64 N4 O12 -","2","0.5","OB6221","Mizuguchi, Jin","Di-<i>tert</i>-butyl 3,6-bis(2-methylphenyl)-1,4-dioxo-1,2,4,5-tetrahydropyrrolo[3,4-<i>c</i>]pyrrole-2,5-dicarboxylate","Acta Crystallographica Section E","2003","59","4","o472","o473","10.1107/S1600536803005312","","","1.5418","CuKα","","","0.0477","","","","0.1068","","","","","","0.868","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202119","14.02","0.002","6.5225","0.0008","14.153","0.002","90","","106.704","0.009","90","","1239.6","0.3","93.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H28 N2 O6 -","- C30 H28 N2 O6 -","- C60 H56 N4 O12 -","2","0.5","OB6222","Mizuguchi, Jin","Di-<i>tert</i>-butyl 7,14-dihydro-7,14-dioxoquino[2,3-<i>b</i>]acridine-5,12-dicarboxylate","Acta Crystallographica Section E","2003","59","4","o474","o475","10.1107/S1600536803005324","","","1.5418","CuKα","","","0.0419","","","","0.0754","","","","","","1.219","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202120","10.902","0.002","6.906","0.001","18.577","0.003","90","","94.85","0.01","90","","1393.6","0.4","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-amino-4-phenyl-5,6-dihydrobenzo[h]quinazoline","","- C18 H15 N3 -","- C18 H15 N3 -","- C72 H60 N12 -","4","1","OB6223","Xiangshan Wang; Daqing Shi; Shujiang Tu; Kaibei Yu","2-Amino-4-phenyl-5,6-dihydrobenzo[<i>h</i>]quinazoline","Acta Crystallographica Section E","2003","59","4","o423","o424","10.1107/S1600536803004616","","","0.71073","MoKα","","0.0526","0.0376","","","0.0973","0.1023","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202121","10.9072","0.0018","4.9003","0.0008","16.767","0.003","90","","104.868","0.003","90","","866.2","0.3","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 N2 S4 -","- C18 H16 N2 S4 -","- C36 H32 N4 S8 -","2","0.5","OB6224","Chunlong Chen; Chengyong Su; Huaxin Zhang; Anwu Xu; Beisheng Kang","1,4-Bis(2-mercaptobenzothiazolyl)butane","Acta Crystallographica Section E","2003","59","4","o453","o454","10.1107/S1600536803005452","","","0.71073","MoKα","","","0.0422","","","","0.0809","","","","","","0.843","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202122","13.818","0.001","17.793","0.002","19.292","0.002","90","","104.85","0.01","90","","4584.8","0.8","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Di-μ~3~-bromo-dibromotetrakis[μ-diphenyl(2-pyridyl)phosphine)]tetracopper(I) hexakisdichloromethane solvate","","- C74 H68 Br4 Cl12 Cu4 N4 P4 -","- C74 H68 Br4 Cl12 Cu4 N4 P4 -","- C148 H136 Br8 Cl24 Cu8 N8 P8 -","2","0.5","OB6225","Zhou, Jian-Liang; Li, Yi-Zhi; Zheng, He-Gen; Xin, Xin-Quan; Xu, Lin-Lin","Di-μ~3~-bromo-dibromotetrakis[μ-diphenyl(2-pyridyl)phosphine)]tetracopper(I) dichloromethane hexasolvate","Acta Crystallographica Section E","2003","59","4","m176","m178","10.1107/S1600536803005725","","","0.71073","MoKα","","0.037","0.0319","","","0.1548","0.1572","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202123","14.7891","0.0011","10.8965","0.0008","15.4391","0.0011","90","","90","","90","","2488","0.3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Methyl (3SR,4RS)-3-benzyl-4-hydroxy-2-oxopyrrolidine-3-carboxylate","","- C13 H15 N O4 -","- C13 H15 N O4 -","- C104 H120 N8 O32 -","8","1","OB6226","Ahmad Sazali Hamzah; Zurina Shaameri; Izwan A. Adziz; Bohari M. Yamin","Methyl (3<i>SR</i>,4<i>RS</i>)-3-benzyl-4-hydroxy-2-oxopyrrolidine-3-carboxylate","Acta Crystallographica Section E","2003","59","5","o737","o738","10.1107/S1600536803009103","","","0.71073","MoKα","","0.0485","0.0426","","","0.1218","0.128","","","","","","1.058","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202124","6.3886","0.0003","8.4876","0.0003","8.9485","0.0003","102.688","0.001","107.056","0.001","98.926","0.001","439.83","0.03","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(thiosemicarbazido-κ^2^N,S)nickel(II)‒succinate‒succinic acid (1/1/1)","","- C10 H20 N6 Ni O8 S2 -","- C10 H20 N6 Ni O8 S2 -","- C10 H20 N6 Ni O8 S2 -","1","0.5","OB6227","Sheng-Li Li; Anwar Usman; Ibrahim A. Razak; Azhar A. Rahman; Hoong-Kun Fun; Jie-Ying Wu; Yu-Peng Tian; Min-Hua Jiang; Zu-Yao Chen","Bis(thiosemicarbazido-κ^2^<i>N,S</i>)nickel(II)‒succinate‒succinic acid (1/1/1)","Acta Crystallographica Section E","2003","59","4","m199","m201","10.1107/S160053680300641X","","","0.71073","MoKα","","0.0742","0.0652","","","0.1676","0.1737","","","","","","1.011","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202125","7.359","0.001","10.261","0.001","10.005","0.001","90","","101.3","0.01","90","","740.84","0.15","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Carbazoyl-5-methylpyridazin-6(1H)-one","","- C6 H8 N4 O2 -","- C6 H8 N4 O2 -","- C24 H32 N16 O8 -","4","1","OB6228","Cheng, Xin-Guo; Li, Yi-Zhi; Fu, Xing-Guo; Cao, Lei; Hu, Zhi-De","3-Carbazoyl-5-methylpyridazin-6(1<i>H</i>)-one","Acta Crystallographica Section E","2003","59","5","o601","o602","10.1107/S1600536803007165","","","0.71073","MoKα","","0.0424","0.0394","","","0.1005","0.1024","","","","","","1.089","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202126","12.8014","0.0009","10.4027","0.0008","28.503","0.0019","90","","90","","90","","3795.7","0.5","173","2","173","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","3-(Anthracen-9-ylmethylene)-2,4-dimethyl-3H-benzo[1,5]diazepine","","- C26 H20 N2 -","- C26 H20 N2 -","- C208 H160 N16 -","8","2","OB6229","Megzari, Ahmed; El Bali, Brahim; Janati, Tajdine; Kerbal, Abdelali; Benlarbi, Najib; Benhadda, Taibi; Mimouni, Mustapha; Bolte, Michael","3-(Anthracen-9-ylmethylene)-2,4-dimethyl-3<i>H</i>-benzo[1,5]diazepine","Acta Crystallographica Section E","2003","59","5","o606","o607","10.1107/S1600536803007207","","","0.71073","MoKα","","0.067","0.0505","","","0.1185","0.1232","","","","","","0.941","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202127","8.162","0.0005","9.7458","0.0006","19.5727","0.0011","90","","90","","90","","1556.91","0.16","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Triaqua(1,10-phenanthroline)sulfatocadmium(II)","","- C12 H14 Cd N2 O7 S -","- C12 H14 Cd N2 O7 S -","- C48 H56 Cd4 N8 O28 S4 -","4","1","OB6230","Li, Xing; Cao, Rong; Bi, Wenhua; Sun, Daofeng; Hong, Maochun","Triaqua(1,10-phenanthroline)sulfatocadmium(II)","Acta Crystallographica Section E","2003","59","5","m230","m231","10.1107/S1600536803007360","","","0.71073","MoKα","","","0.0425","","","0.1048","0.1092","","","","","","1.069","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202128","8.6703","0.0002","7.8597","0.0002","21.5279","0.0002","90","","90.916","0.001","90","","1466.85","0.05","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Orotato(1,10-phenanthroline)copper(II)","","- C17 H10 Cu N4 O4 -","- C17 H10 Cu N4 O4 -","- C68 H40 Cu4 N16 O16 -","4","1","OB6231","Li, Xing; Cao, Rong; Bi, Wenhua; Sun, Daofeng; Hong, Maochun","Orotato(1,10-phenanthroline)copper(II)","Acta Crystallographica Section E","2003","59","5","m228","m229","10.1107/S1600536803007451","","","0.71073","MoKα","","","0.0384","","","0.0961","0.1056","","","","","","1.079","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202129","11.317","0.003","23.592","0.004","12.873","0.002","90","","92.45","0.016","90","","3433.8","1.2","296","","296","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C35 H34 Cu F6 N4 P -","- C35 H34 Cu F6 N4 P -","- C140 H136 Cu4 F24 N16 P4 -","4","1","OB6234","Onoda, Akira; Kawakita, Keiko; Okamura, Taka-aki; Yamamoto, Hitoshi; Ueyama, Norikazu","(Acetonitrile)(6,6''-dimesityl-2,2':6',2''-terpyridine)copper(I) hexafluorophosphate","Acta Crystallographica Section E","2003","59","5","m266","m267","10.1107/S1600536803008249","","","0.71069","MoKα","","0.3012","0.0521","","","0.1421","0.2274","","","","","","0.91","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202130","12.224","0.001","5.341","0.002","15.191","0.001","90","","97.625","0.007","90","","983","0.4","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 N2 O8 Zn -","- C20 H20 N2 O8 Zn -","- C40 H40 N4 O16 Zn2 -","2","0.5","OB6235","Okabe, Nobuo; Muranishi, Yasunori","<i>trans</i>-Diaquabis(isoquinoline-1-carboxylato-κ^2^<i>N,O</i>)zinc(II) dihydrate","Acta Crystallographica Section E","2003","59","5","m247","m248","10.1107/S1600536803008006","","","0.7107","MoKα","","","0.036","","","","0.1287","","","","","","0.818","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202131","9.336","0.0019","11.013","0.002","12.02","0.002","71.36","0.03","81.26","0.03","72.34","0.03","1113.8","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H26 Cu Fe N12 O2 -","- C15 H26 Cu Fe N12 O2 -","- C30 H52 Cu2 Fe2 N24 O4 -","2","1","OB6236","Peng, Xi; Kou, Hui-Zhong; Xiong, Ming; Wang, Ru-Ji","A cyano-bridged binuclear Cu‒Fe complex based on nitroprusside","Acta Crystallographica Section E","2003","59","5","m252","m254","10.1107/S160053680300792X","","","0.71073","MoKα","","0.0537","0.0406","","","0.0865","0.0912","","","","","","0.907","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202132","6.3475","0.0011","10.779","0.002","7.4326","0.0012","90","","106.971","0.013","90","","486.39","0.15","100","2","100","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C4 H8 Al Br3 O -","- C4 H8 Al Br3 O -","- C8 H16 Al2 Br6 O2 -","2","0.5","OB6237","Scholz, Stefan; Lerner, Hans-Wolfram; Bolte, Michael","Tribromo(tetrahydrofuran)aluminium(III)","Acta Crystallographica Section E","2003","59","5","m289","m290","10.1107/S1600536803008614","","","0.71073","MoKα","","0.0804","0.0575","","","0.1024","0.11","","","","","","1.11","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202133","7.7","0.002","19.601","0.005","7.332","0.002","90","","112.58","0.02","90","","1021.8","0.5","93.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H10 N2 S2 -","- C11 H10 N2 S2 -","- C44 H40 N8 S8 -","4","1","OB6238","Tomoshige Kobayashi; Takashi Moriwaki; Motoo Shiro","4,5,9,10-Tetrahydro-4,9-methanodithieno[3,2-<i>b</i>:3',2'-<i>f</i>][1,5]diazocine","Acta Crystallographica Section E","2003","59","6","o745","o746","10.1107/S1600536803008961","","","0.7107","MoKα","","","0.0432","","","","0.1013","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202134","5.486","0.006","5.389","0.007","27.827","0.004","90","","93.38","0.04","90","","821.2","1.4","296","1","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H28 Br2 -","- C14 H28 Br2 -","- C28 H56 Br4 -","2","0.5","OB6239","Kenjiro Uno; Naotake Nakamura","1,14-Dibromotetradecane","Acta Crystallographica Section E","2003","59","5","o708","o710","10.1107/S1600536803008924","","","1.54178","CuKα","","","0.043","","","","0.099","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202135","8.535","0.003","11.441","0.004","15.682","0.006","102.027","0.007","92.423","0.007","100.637","0.007","1466.8","0.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1''-Benzyl-5''-benzylidene-1'-methyl-4'-phenyl-1H-indole-3-spiro-2'- pyrrolidine-3'-spiro-3''-piperidine-2(3H),3''-dione","","- C36 H33 N3 O2 -","- C36 H33 N3 O2 -","- C72 H66 N6 O4 -","2","1","OB6240","Li, Xiao-Fang; Feng, Ya-Qing; Hu, Xiao-Fen; Xu, Mian","1''-Benzyl-5''-benzylidene-1'-methyl-4'-phenyl-1<i>H</i>-indole-3-spiro-2'-pyrrolidine-3'-spiro-3''-piperidine-2(3<i>H</i>),3''-dione","Acta Crystallographica Section E","2003","59","5","o711","o712","10.1107/S1600536803008985","","","0.71073","MoKα","","0.1252","0.0632","","","","0.1806","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202136","10.1817","0.0018","14.221","0.002","14.664","0.003","114.362","0.003","96.804","0.003","105.61","0.003","1798","0.6","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C26 H42 Cl4 N4 O4 Ru2 S4 -","- C26 H42 Cl4 N4 O4 Ru2 S4 -","- C52 H84 Cl8 N8 O8 Ru4 S8 -","2","1","OB6241","Masui, Dai; Yamaguchi, Motowo; Yamagishi, Takamichi","<i>trans</i>(<i>Cl,N</i>~amino~)-Chloro(dimethyl sulfoxide-κ<i>S</i>)[tris(2-pyridylmethyl)amine-κ^4^<i>N</i>]ruthenium(II) trichlorotris(dimethyl sulfoxide-κ<i>S</i>)ruthenate(II)","Acta Crystallographica Section E","2003","59","6","m308","m309","10.1107/S1600536803009395","","","0.71073","MoKα","","0.0313","0.0268","","","0.0645","0.0659","","","","","","0.977","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202137","7.894","0.006","21.037","0.004","9.879","0.006","90","","112.39","0.04","90","","1516.9","1.6","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H16 N4 O6 -","- C13 H16 N4 O6 -","- C52 H64 N16 O24 -","4","1","OB6242","Lee, Ting Wai; Lau, Jasmine Po Kwan; Szeto, Lap","4,4'-Trimethylenedipyridinium dinitrate","Acta Crystallographica Section E","2003","59","6","o792","o793","10.1107/S1600536803009589","","","0.7107","MoKα","","","0.0438","","","","0.0484","","","","","","1.461","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202138","14.778","0.005","5.6665","0.0018","16.133","0.005","90","","108.049","0.005","90","","1284.5","0.7","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-methoxylphenyl p-toluenesulfonate","4-Methoxyphenyl 4-toluenesulfonate","","- C14 H14 O4 S -","- C14 H14 O4 S -","- C56 H56 O16 S4 -","4","1","OB6243","Nagarajan Vembu; Maruthai Nallu; Jered Garrison; Khadijah Hindi; Wiley J. Youngs","4-Methoxyphenyl 4-toluenesulfonate: supramolecular aggregation through C—H···O and C—H···π interactions","Acta Crystallographica Section E","2003","59","6","o830","o832","10.1107/S1600536803010444","","","0.71073","MoKα","","0.0649","0.0583","","","0.1252","0.1282","","","","","","1.235","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202139","10.553","0.0017","11.0533","0.0018","13.494","0.002","71.698","0.003","75.434","0.003","63.279","0.002","1323.5","0.4","293","","293","","","","","","","","","5","P -1","-P 1","2","","3,3'-Bis(3-cyanopropyl)-1,1'-propylenedi(benzimidazolium) dichloride dihyrate","","- C25 H32 Cl2 N6 O2 -","- C25 H32 Cl2 N6 O2 -","- C50 H64 Cl4 N12 O4 -","2","1","OB6244","Mehmet Akkurt; Sema Öztürk; Hasan Küçükbay; Naíf Okuyucu; Hoong-Kun Fun","3,3'-Bis(3-cyanopropyl)-1,1'-propylenedi(benzimidazolium) dichloride dihydrate","Acta Crystallographica Section E","2003","59","6","o786","o788","10.1107/S1600536803009851","","","0.71073","MoKα","","0.0658","0.0486","","","0.1378","0.1536","","","","","","1.001","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202140","10.0632","0.0002","16.5301","0.0003","10.2627","0.0001","90","","101.991","0.001","90","","1669.91","0.05","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Bis{2-[(2-aminoethylimino)(phenyl)methyl]pyridine-κ^3^N}nickel(II) diperchlorate","","- C30 H34 Cl2 N6 Ni O8 -","- C30 H34 Cl2 N6 Ni O8 -","- C60 H68 Cl4 N12 Ni2 O16 -","2","1","OB6246","Anwar Usman; Hoong-Kun Fun; Tapan K. Karmakar; Barindra K. Ghosh; Swapan K. Chandra","Bis{2-[(2-aminoethylimino)(phenyl)methyl]pyridine-κ^3^<i>N</i>}nickel(II) diperchlorate","Acta Crystallographica Section E","2003","59","6","m387","m389","10.1107/S1600536803010869","","","0.71073","MoKα","","0.0742","0.0677","","","0.1923","0.1992","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202141","6.227","0.005","9.817","0.008","8.292","0.005","90","","102.56","0.05","90","","494.8","0.6","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","1'-deoxy-1'-hydroxymethyl-1,2'-O-isopropylidene-β-D-arabinofuranose","","- C9 H16 O5 -","- C9 H16 O5 -","- C18 H32 O10 -","2","1","OM6123","Bogdan Doboszewski; Alexander Y. Nazarenko","1'-Deoxy-1'-hydroxymethyl-1,2'-<i>O</i>-isopropylidene-β-<small>D</small>-arabinofuranose","Acta Crystallographica Section E","2003","59","2","o158","o160","10.1107/S1600536803000692","","","0.71073","MoKα","","0.049","0.0359","","","0.0752","0.0807","","","","","","1.055","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202142","10.567","0.006","11.856","0.002","4.6321","0.0011","93.303","0.018","100.25","0.03","99.14","0.03","561.6","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","Coumarin 500","7-ethylamino-4-trifluoromethyl coumarin","","- C12 H10 F3 N O2 -","- C12 H10 F3 N O2 -","- C24 H20 F6 N2 O4 -","2","1","OM6124","Jerry P. Jasinski; John M. Jasinski; Yu Li; Daniel J. Crosby","7-Ethylamino-4-(trifluoromethyl)coumarin","Acta Crystallographica Section E","2003","59","2","o153","o154","10.1107/S1600536803000709","","","0.71069","MoKα","","0.2596","0.0621","","","0.1178","0.1677","","","","","","0.895","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202143","8.386","0.002","31.076","0.006","7.072","0.001","90","","92.13","0.03","90","","1841.7","0.6","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","bis(4-dimethylaminopyridinium) 1,2-difluorodiphosphate","","","- C14 H22 F2 N4 O5 P2 -","- C14 H22 F2 N4 O5 P2 -","- C56 H88 F8 N16 O20 P8 -","4","1","OM6125","Radek Sluka; Marek Nečas; Miloš Černík","Bis(4-dimethylaminopyridinium) 1,2-difluorodiphosphate","Acta Crystallographica Section E","2003","59","2","o190","o192","10.1107/S1600536803001004","","","0.71073","MoKα","","0.0641","0.0455","","","0.1221","0.1421","","","","","","1.282","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202144","8.4278","0.0002","9.2848","0.0002","11.349","0.0003","100.223","0.0009","105.536","0.001","94.4063","0.0013","834.76","0.04","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H32 Cl4 N6 O16 -","- C26 H32 Cl4 N6 O16 -","- C26 H32 Cl4 N6 O16 -","1","0.5","OM6127","Shamila S. Gunatilleke; Richard E. Norman","<i>N,N,N</i>',<i>N</i>'-Tetrakis(2-pyridiniomethyl)ethylenediamine tetraperchlorate","Acta Crystallographica Section E","2003","59","3","o269","o271","10.1107/S1600536803002447","","","0.7107","MoKα","","0.0742","0.0612","","0.1354","","0.111","","","0.969","","","1.046","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202145","28.5692","0.0004","4.6529","0.0001","26.4989","0.0004","90","","113.137","0.001","90","","3239.17","0.1","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Bis[(3,5-dimethylpyrazol-1-yl)ethyl] disulfide","","- C14 H22 N4 S2 -","- C14 H22 N4 S2 -","- C112 H176 N32 S16 -","8","1","OM6128","Mills, Allison M.; Chalbot, Marie-Cécile; Bouwman, Elisabeth; Spek, Anthony L.","Bis[(3,5-dimethylpyrazol-1-yl)ethyl] disulfide","Acta Crystallographica Section E","2003","59","3","o258","o260","10.1107/S1600536803002289","","","0.71073","MoKα","","0.0555","0.0385","","","0.094","0.1013","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202146","29.7331","0.0005","5.3499","0.0001","17.4428","0.0003","90","","99.099","0.001","90","","2739.7","0.08","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H15 N O3 S2 -","- C12 H15 N O3 S2 -","- C96 H120 N8 O24 S16 -","8","1","OM6129","Deschamps, Jeffrey R.; Suwandi, Lita S.; Konaklieva, Monika","3,3-Bis(methylthio)-2-oxo-<i>N</i>-phenylpropanamide","Acta Crystallographica Section E","2003","59","3","o308","o309","10.1107/S1600536803002769","","","1.54178","CuKα","","0.0494","0.0438","","","0.1152","0.1196","","","","","","1.049","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202147","5.0052","0.0011","9.9004","0.0016","12.1749","0.0012","90","","92.199","0.015","90","","602.86","0.17","298","2","298","2","","","","","","","","4","P 1 c 1","P -2yc","7","","","","- C13 H11 N3 O3 -","- C13 H11 N3 O3 -","- C26 H22 N6 O6 -","2","1","OM6130","Shang Shan; Duan-Jun Xu; Jing-Yun Wu; Michael Y. Chiang","Salicylaldehyde 4-nitrophenylhydrazone","Acta Crystallographica Section E","2003","59","3","o342","o343","10.1107/S1600536803003350","","","0.71073","MoKα","","0.073","0.032","","","0.076","0.091","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202148","11.136","0.0004","11.1049","0.0003","22.8774","0.0009","90","","91.9072","0.0012","90","","2827.55","0.17","150","1","150","1","","","","","","","","3","C 1 c 1","C -2yc","9","","2-Hydroxycyclohexene-1-carboxylic acid","","- C7 H10 O3 -","- C7 H10 O3 -","- C112 H160 O48 -","16","4","OM6131","Kresge, A. Jerry; Lough, Alan J.; Zhu, Yu","2-Hydroxycyclohexene-1-carboxylic acid: the enol isomer of 2-oxocyclohexane-1-carboxylic acid","Acta Crystallographica Section E","2003","59","3","o344","o346","10.1107/S1600536803003568","","","0.71073","MoKα","","0.0655","0.046","","","0.1078","0.1184","","","","","","1.031","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202149","32.326","0.004","7.1937","0.0012","15.4134","0.0019","90","","104.022","0.009","90","","3477.5","0.9","296","","296","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","(±)-anti-7-Ethyl-1-(4-methoxyphenyl)-5,5,syn-8-trimethyl-2- oxabicyclo[2.2.2]octan-3-one","","- C19 H26 O3 -","- C19 H26 O3 -","- C152 H208 O24 -","8","1","OM6133","Xie, Songwen; Hou, Yuqing; Meyers, Cal Y.; Robinson, Paul D.","(±)-<i>anti</i>-7-Ethyl-1-(4-methoxyphenyl)-5,5,<i>syn</i>-8-trimethyl-2-oxabicyclo[2.2.2]octan-3-one, a bicyclic δ-lactone","Acta Crystallographica Section E","2003","59","4","o403","o405","10.1107/S1600536803004276","","","0.71069","MoKα","","0.096","0.041","","","0.106","0.129","","","","","","1.018","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202150","18.318","0.002","7.597","0.003","12.0935","0.0013","90","","91.86","0.01","90","","1682.1","0.7","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(±)-5-Ethyl-endo-4-(4-methoxyphenyl)-2,2,anti-8-trimethyl-6- oxabicyclo[3.2.1]octan-7-one","","- C19 H26 O3 -","- C19 H26 O3 -","- C76 H104 O12 -","4","1","OM6134","Xie, Songwen; Hou, Yuqing; Meyers, Cal Y.; Robinson, Paul D.","(±)-5-Ethyl-<i>endo</i>-4-(4-methoxyphenyl)-2,2,<i>anti</i>-8-trimethyl-6-oxabicyclo[3.2.1]octan-7-one, a bicyclic γ-lactone","Acta Crystallographica Section E","2003","59","4","o406","o407","10.1107/S1600536803004288","","","0.71069","MoKα","","0.063","0.038","","","0.098","0.113","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202151","7.487","0.003","8.675","0.004","10.277","0.004","95.378","0.006","97.886","0.006","96.404","0.006","653","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","2-chlorophenyl p-toluenesulfonate","2-chlorophenyl 4-toluenesulfonate","","- C13 H11 Cl O3 S -","- C13 H11 Cl O3 S -","- C26 H22 Cl2 O6 S2 -","2","1","OM6135","Nagarajan Vembu; Maruthai Nallu; Jered Garrison; Wiley J. Youngs","2-Chlorophenyl 4-toluenesulfonate: molecular aggregration through weak C—H···O interactions","Acta Crystallographica Section E","2003","59","4","o503","o505","10.1107/S1600536803005841","","","0.71073","MoKα","","0.0485","0.0377","","","0.0933","0.096","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202152","8.5144","0.0008","8.778","0.001","10.712","0.001","90","","90.082","0.005","90","","800.61","0.14","173.2","","173.2","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C9 H10 O3 -","- C9 H10 O3 -","- C36 H40 O12 -","4","1","OM6136","Guibin Ma; Brian O. Patrick; Thomas Q. Hu; Brian R. James","4'-Hydroxy-3'-methoxyacetophenone (acetovanillone)","Acta Crystallographica Section E","2003","59","4","o579","o580","10.1107/S1600536803006408","","","0.7107","MoKα","","0.0708","0.041","","0.1216","","0.1216","","","1.204","","","1.204","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202153","13.4146","0.0009","6.6414","0.0005","10.0118","0.0006","90","","90","","90","","891.97","0.1","293","2","293","2","","","","","","","","4","C m c 21","C 2c -2","36","","","","- C7 H7 N2 O6 -","- C7 H7 N2 O6 -","- C28 H28 N8 O24 -","4","0.5","OM6137","Sema Öztürk; Bülent Büyükkıdan; Ramazan Erenler; Mehmet Akkurt; Osman Çakmak; Hoong-Kun Fun","3,5-Dinitroxytricyclo[2.2.1.0^2,6^]heptane","Acta Crystallographica Section E","2003","59","4","o550","o552","10.1107/S1600536803006524","","","0.71073","MoKα","","0.0523","0.0458","","","0.1082","0.112","","","","","","1.128","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202154","8.281","0.002","13.216","0.004","19.737","0.006","90","","90","","90","","2160.1","1.1","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Flavone","","","- C15 H10 O2 -","- C15 H10 O2 -","- C120 H80 O16 -","8","2","OM6138","Waller, Mark P.; Hibbs, David E.; Overgaard, Jacob; Hanrahan, Jane R.; Hambley, Trevor W.","Flavone","Acta Crystallographica Section E","2003","59","6","o767","o768","10.1107/S160053680300730X","","","0.71073","MoKα","","0.0418","0.0377","","","0.1043","0.1076","","","","","","1.078","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202155","14.26","0.005","9.66","0.002","12.789","0.005","90","","120.878","0.012","90","","1512","0.9","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","catena-poly[[[(1,10-phenanthroline)copper(II)]-μ-dicyanamido] perchlorate]","","- C14 H8 Cl Cu N5 O4 -","- C14 H8 Cl Cu N5 O4 -","- C56 H32 Cl4 Cu4 N20 O16 -","4","1","OM6139","A.-Qing Wu; Fa-Kun Zheng; Li-Zhen Cai; Guo-Cong Guo; Jiang-Gao Mao; Jin-Shun Huang","One-dimensional chain structure of <i>catena</i>-poly[[[(1,10-phenanthroline)copper(II)]-μ-dicyanamido] perchlorate]","Acta Crystallographica Section E","2003","59","5","m257","m259","10.1107/S1600536803007438","","","0.71073","MoKα","","0.0556","0.045","","","0.1092","0.1147","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202156","7.6482","0.0013","16.307","0.002","10.2114","0.0017","90","","110.233","0.003","90","","1195","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","2-Bromo-N(p-Toluenesulfonyl)pyrrole","2-Bromo-N(p-Toluenesulfonyl)pyrrole","","- C11 H10 Br N O2 S -","- C11 H10 Br N O2 S -","- C44 H40 Br4 N4 O8 S4 -","4","1","OM6140","Knight, Lea W.; Padgett, Clifford W.; Huffman, John W.; Pennington, William T.","2-Bromo-<i>N</i>-(<i>p</i>-toluenesulfonyl)pyrrole","Acta Crystallographica Section E","2003","59","6","o762","o764","10.1107/S1600536803009097","","","0.71073","MoKα","","","0.0464","","","0.0851","0.0893","","","","","","1.003","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202157","6.923","0.001","11.616","0.002","19.413","0.004","90","","90","","90","","1561.1","0.5","293","2","293","2","","","","","","","","4","C m c a","-C 2ac 2","64","2-amino-6-bromo-pyridinium bromide","2-amino-6-bromo-pyridinium bromide","","- C5 H6 Br2 N2 -","- C5 H6 Br2 N2 -","- C40 H48 Br16 N16 -","8","","OM6141","Holmes, Brian T.; Padgett, Clifford W.; Pennington, William T.","2-Amino-6-bromopyridinium bromide","Acta Crystallographica Section E","2003","59","6","o862","o864","10.1107/S1600536803008870","","","0.71073","MoKα","","0.0601","0.0397","","","0.1062","0.1162","","","","","","1.026","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202158","18.1","0.01","9.239","0.005","11.216","0.006","90","","114.764","0.008","90","","1703.1","1.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,2'-[1,2-phenylenebis(methylenethio)]bis[5-methyl-1,3,4-thiadiazole]","","- C14 H14 N4 S4 -","- C14 H14 N4 S4 -","- C56 H56 N16 S16 -","4","0.5","SU6006","Yan Zheng; Hai-Bo Liu","2,2'-[1,2-Phenylenebis(methylenethio)]bis(5-methyl-1,3,4-thiadiazole)","Acta Crystallographica Section E","2003","59","1","o34","o35","10.1107/S1600536802021761","","","0.71073","MoKα","","0.0395","0.0291","","","","0.078","","","","","","1.081","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202159","9.462","0.001","8.093","0.001","9.823","0.001","90","","105.38","0.01","90","","725.27","0.14","180","2","180","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Aquadichloro(2,9-dimethyl-1,10-phenanthroline-κ^2^N,N')copper(II)","","- C14 H14 Cl2 Cu N2 O -","- C14 H14 Cl2 Cu N2 O -","- C28 H28 Cl4 Cu2 N4 O2 -","2","1","SU6007","Lemoine, Pascale; Viossat, Bernard; Daran, Jean-Claude","Aquadichloro(2,9-dimethyl-1,10-phenanthroline-κ^2^<i>N,N</i>')copper(II)","Acta Crystallographica Section E","2003","59","1","m17","m19","10.1107/S1600536802022249","","","0.71073","MoKα","","0.0181","0.017","","","0.0455","0.0459","","","","","","1.049","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202160","5.545","0.002","8.187","0.003","13.867","0.005","96.463","0.006","96.731","0.006","91.288","0.006","620.8","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1,5-Bis(ethylsulfonyl)-pentane","","- C9 H20 O4 S2 -","- C9 H20 O4 S2 -","- C18 H40 O8 S4 -","2","1","SU6008","Jian-Rong Li; Yan Zheng; Ya-Bo Xie; Ru-Qiang Zou; Ruo-Hua Zhang; Xian-He Bu","1,5-Bis(ethylsulfonyl)pentane","Acta Crystallographica Section E","2003","59","1","o70","o71","10.1107/S1600536802022985","","","0.71073","MoKα","","0.053","0.0397","","","0.1045","0.1118","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202161","8.7583","0.0004","7.9237","0.0004","13.8393","0.0006","90","","103.785","0.002","90","","932.76","0.08","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H24 Au Cl2 K O6 -","- C12 H24 Au Cl2 K O6 -","- C24 H48 Au2 Cl4 K2 O12 -","2","0.5","SU6009","Hossain, Md. Alamgir; Powell, Douglas R.; Bowman-James, Kristin","A potassium crown ether complex with dichloroaurate(I)","Acta Crystallographica Section E","2003","59","2","m57","m58","10.1107/S1600536803000813","","","0.71073","MoKα","","0.0199","0.0171","","","0.0454","0.0468","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202162","8.848","0.005","12.843","0.002","21.551","0.004","90","","90","","90","","2448.9","1.5","293","","293","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C28 H24 O9 -","- C28 H24 O9 -","- C112 H96 O36 -","4","1","SU6010","Olivier Renaudet; Pascal Dumy; Christian Philouze; Marie-Thérèse Averbuch","Methyl 2,3,6-tri-<i>O</i>-benzoyl-α-<small>D</small>-<i>xylo</i>-hexopyranosid-4-ulose","Acta Crystallographica Section E","2003","59","3","o283","o284","10.1107/S1600536803002265","","","0.7107","MoKα","","0.0646","0.0646","","0.0346","","0.0346","","","1.93","","","1.93","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202163","8.3649","0.0011","8.948","0.0013","9.8344","0.0014","74.713","0.002","77.828","0.003","69.389","0.003","658.9","0.16","298","2","","","","","","","","","","5","P -1","-P 1","2","","catena-Poly[silver(I)-2,5-bis(4-pyridyl)-1,3,4-oxadiazole nitrate]","","- C12 H8 Ag N5 O4 -","- C12 H8 Ag N5 O4 -","- C24 H16 Ag2 N10 O8 -","2","1","SU6011","Ya-Mei Guo; He Liu; Xue-Bing Leng","<i>catena</i>-Poly[[silver(I)-μ-2,5-bis(4-pyridyl)-1,3,4-oxadiazole] nitrate], a one-dimensional coordination polymer exhibiting a double-chain supramolecular structure through hydrogen bonds","Acta Crystallographica Section E","2003","59","2","m59","m60","10.1107/S1600536803000825","","","0.71073","MoKα","","0.0445","0.0397","","","0.113","0.1167","","","","","","1.058","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202164","7.154","0.001","9.554","0.002","9.866","0.002","85.27","0.03","82.88","0.03","89.57","0.03","666.9","0.2","90","0.1","90","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C16 H15 N O3 -","- C16 H15 N O3 -","- C32 H30 N2 O6 -","2","1","SU6012","Zarychta, Bartosz; Zaleski, Jacek; Prezhdo, Victor; Uspenskiy, Boris","<i>N</i>-(3-Methoxypropyl)-1,8-naphthalimide","Acta Crystallographica Section E","2003","59","3","o332","o333","10.1107/S1600536803003428","","","0.71073","MoKα","","0.0547","0.0381","","","0.0857","0.0999","","","","","","0.813","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202165","12.164","0.002","22.079","0.004","7.373","0.002","90","","100.86","0.02","90","","1944.7","0.7","298.2","","298.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","7-nitro-1,2,3a,4-tetrahydrobenzo[b][1,3] oxazolo [3,2-d] oxazine.","","- C10 H10 N2 O4 -","- C10 H10 N2 O4 -","- C80 H80 N16 O32 -","8","2","SU6013","S. Vishnu Vardhan Reddy; A. Sivalakshmi Devi; K. Vyas; V. Venugopal Rao; Y. Koteswar Rao; A. Venkateswarlu; P. K. Dubey","7-Nitro-1,2,3a,4-tetrahydrobenzo[<i>b</i>][1,3]oxazolo[3,2-<i>d</i>]oxazine: a new heterocycle","Acta Crystallographica Section E","2003","59","3","o360","o362","10.1107/S160053680300401X","","","1.5418","CuKα","","0.09","0.0759","","0.0979","","0.0947","","","1.883","","","1.978","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202166","22.5989","0.0013","22.5989","0.0013","39.015","0.003","90","","90","","90","","19925","2","200","2","200","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","4-(Tri-tert-butoxysilylthiomercurio)benzoic acid","","- C19 H32 Hg O5 S Si -","- C19 H32 Hg O5 S Si -","- C608 H1024 Hg32 O160 S32 Si32 -","32","2","SU6014","Jaroslaw Chojnacki; Agnieszka Walaszewska; Elke Baum; Wieslaw Wojnowski","4-(Tri-<i>tert</i>-butoxysilylthiomercurio)benzoic acid","Acta Crystallographica Section E","2003","59","3","m125","m127","10.1107/S1600536803004045","","","0.71073","MoKα","","0.068","0.0311","","","0.0516","0.0574","","","","","","0.827","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202167","7.129","0.002","7.529","0.002","16.371","0.005","94.35","0.005","101.426","0.005","100.753","0.005","840.3","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H14 N4 O6 S -","- C14 H14 N4 O6 S -","- C28 H28 N8 O12 S2 -","2","1","SU6015","Ning Ma; Baolei Wang; Jianguo Wang; Haibin Song; Suhua Wang; Zhengming Li","Methyl 2-(4-methoxypyrimidin-2-ylcarbamoylsulfamoyl)benzoate","Acta Crystallographica Section E","2003","59","4","o438","o440","10.1107/S160053680300446X","","","0.71073","MoKα","","0.1211","0.0564","","","0.0947","0.1189","","","","","","1.007","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202168","7.6761","0.0007","17.752","0.0017","10.3654","0.001","90","","105.479","0.002","90","","1361.2","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","N-para-bromophenyl-N'-2-chlorobenzoylurea","","- C14 H10 Br Cl N2 O2 -","- C14 H10 Br Cl N2 O2 -","- C56 H40 Br4 Cl4 N8 O8 -","4","1","SU6016","Bohari M. Yamin; A. Sahali Mardi","<i>N</i>-<i>p</i>-Bromophenyl-<i>N</i>'-(2-chlorobenzoyl)urea","Acta Crystallographica Section E","2003","59","4","o399","o400","10.1107/S1600536803004422","","","0.71073","MoKα","","0.054","0.036","","","0.09","0.098","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202169","7.829","0.001","13.874","0.001","14.079","0.001","90","","90","","90","","1529.3","0.2","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-(12-benzoyl-10-oxa-12-azatetracyclo[6.3.1.0^2,7^.0^9,11^] dodeca-2,4,6-trien-1-yl)ethan-1-one","","- C19 H15 N O3 -","- C19 H15 N O3 -","- C76 H60 N4 O12 -","4","1","SU6017","Sema Öztürk; Mehmet Akkurt; Ebubekír Tepe; Frank W. Heinemann; Alíye (Alaylı) Altundaş; Yunus Kara","1-(12-Benzoyl-10-oxa-12-azatetracyclo[6.3.1.0^2,7^.0^9,11^]dodeca-2,4,6-trien-1-yl)ethan-1-one","Acta Crystallographica Section E","2003","59","5","o635","o637","10.1107/S1600536803007827","","","0.71073","MoKα","","0.0574","0.0385","","","0.0877","0.097","","","","","","0.977","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202170","7.3107","0.0013","11.5702","0.0019","25.117","0.004","90","","90","","90","","2124.6","0.6","294","2","294","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(1R,2S)-1-(6-Methoxy-2-naphthyl)-3-methyl-2-(p-methylphenylsulfonylamino)- 1-(6-methoxy-2-naphthyl)butan-1-ol","","- C23 H27 N O4 S -","- C23 H27 N O4 S -","- C92 H108 N4 O16 S4 -","4","1","SU6018","Li, Xingshu; Jia, Xian; Zhou, Zhongyuan","(1<i>R</i>,2<i>S</i>)-1-(6-Methoxy-2-naphthyl)-3-methyl-2-(<i>p</i>-methylphenylsulfonylamino)-butan-1-ol","Acta Crystallographica Section E","2003","59","5","o706","o707","10.1107/S1600536803008092","","","0.71073","MoKα","","0.1306","0.0449","","","0.077","0.0907","","","","","","0.799","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202171","9.895","0.001","11.343","0.002","18.791","0.002","90","","90","","90","","2109.1","0.5","150","2","150","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C12 H14 O2 -","- C12 H14 O2 -","- C96 H112 O16 -","8","1","SU6020","Craig M. Williams; Lewis N. Mander; Paul V. Bernhardt","1-Ethynyl-2-isopropoxy-3-methoxybenzene","Acta Crystallographica Section E","2003","59","4","o561","o563","10.1107/S1600536803006585","","","0.71073","MoKα","","0.0635","0.0388","","","0.1005","0.1123","","","","","","1.052","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202172","12.6","0.006","20.177","0.009","14.202","0.006","90","","104.768","0.008","90","","3491","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-[(2-Chloro-phenyl)-hydroxyimino-methyl] -1,5-dimethyl-2-phenyl-pyrazolidin-3-one","","- C18 H12 Cl3 N O3 -","- C18 H12 Cl3 N O3 -","- C144 H96 Cl24 N8 O24 -","8","1","SU6021","Li, Xiao-Fang; Feng, Ya-Qing; Xu, Mian","4-(4-Chlorophenyl)-3-(2,6-dichlorophenyl)-1,7-dioxa-2-azaspiro[4.4]non-2-en-6-one","Acta Crystallographica Section E","2003","59","5","o675","o676","10.1107/S1600536803008134","","","0.71073","MoKα","","0.1083","0.0485","","","","0.1077","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202173","10.4041","0.0016","34.308","0.004","9.5158","0.0012","90","","93.338","0.011","90","","3390.8","0.8","248","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C81 H87 N O10 -","- C81 H87 N O10 -","- C162 H174 N2 O20 -","2","1","SU6022","Ohba, Shigeru; Miyamoto, Hisakazu","(<i>R,R</i>)-({-})-<i>trans</i>-1,4-Dioxaspiro[4,5]decane-2,3-diylbis(diphenylmethanol) <i>N</i>-allyl-<i>N</i>-propyl-3-oxo-1-cyclohexenecarboxamide (2/1 inclusion compound)","Acta Crystallographica Section E","2003","59","5","o646","o648","10.1107/S1600536803008080","","","1.5418","CuKα","","","0.0615","","","","0.1723","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202174","17.7211","0.0009","3.9082","0.0002","16.4115","0.0009","90","","103.856","0.003","90","","1103.55","0.1","291","1","291","1","10000","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-(9-Anthrylmetylidene)hydrazine","","- C15 H12 N2 -","- C15 H12 N2 -","- C60 H48 N8 -","4","1","SU6023","Urban, Jiří; Ludvík, Jiří; Fábry, Jan; Císařová, Ivana","Anthracene-9-carbaldehyde hydrazone","Acta Crystallographica Section E","2003","59","5","o654","o656","10.1107/S1600536803007694","","","0.71073","MoKα","","0.0699","0.0516","","","0.1248","0.1402","","","","","","1.104","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202175","13.373","0.005","11.527","0.004","13.485","0.005","90","","111.538","0.006","90","","1933.6","1.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-[3,3-Dimethylspiro[2,3-dihydro-1H-indole-2,3'-(3'H-naphtho[2,1-b] [1,4]oxazine)]-1-yl]propionic acid","","- C24 H22 N2 O3 -","- C24 H22 N2 O3 -","- C96 H88 N8 O12 -","4","1","TK6087","Gao, Yu; Zou, Wuxin; Zhang, Wanxuan; Li, Jinshui; Meng, Jiben","3-{3,3-Dimethylspiro[2,3-dihydro-1<i>H</i>-indole-2,3'-(3'<i>H</i>-naphtho[2,1-<i>b</i>][1,4]oxazin)]-1-yl}propionic acid","Acta Crystallographica Section E","2003","59","2","o135","o137","10.1107/S1600536802023632","","","0.71073","MoKα","","0.1","0.046","","","0.104","0.123","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202176","20.6825","0.001","21.0325","0.0009","13.2577","0.0006","90","","90","","90","","5767.2","0.5","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","Au2 P6 F12 C51 H46 Cl2","Bis[bis(diphenylphosphino)methane)digold(I) bishexafluorophosphatedichloromethane disolvate","","- C52 H48 Au2 Cl4 F12 P6 -","- C52 H48 Au2 Cl4 F12 P6 -","- C208 H192 Au8 Cl16 F48 P24 -","4","0.5","TK6088","Wu, Meimei; Zhang, Liyi; Chen, Zhongning","Bis[μ-bis(diphenylphosphino)methane]digold(I) bis(hexafluorophosphate) dichloromethane disolvate","Acta Crystallographica Section E","2003","59","2","m72","m73","10.1107/S1600536803001120","","","0.71073","MoKα","","0.126","0.066","","","0.133","0.16","","","","","","1.13","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202177","19.96","0.003","6.625","0.002","15.53","0.002","90","","106.68","0.01","90","","1967.2","0.7","296","2","296","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C42 H54 N4 O10 -","- C42 H54 N4 O10 -","- C84 H108 N8 O20 -","2","0.5","TK6089","Zhang, Hui; Lin, Zhong-Yu; Zhou, Zhao-Hui; Ng, Seik Weng","Bis(cinchonidinium) <small>L</small>-tartrate dihydrate","Acta Crystallographica Section E","2003","59","2","o183","o185","10.1107/S1600536803000850","","","0.71073","MoKα","","0.059","0.045","","","0.119","0.13","","","","","","1.11","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202178","6.171","0.002","11.334","0.003","11.653","0.003","81.25","0.01","87.31","0.01","74.27","0.01","775.4","0.4","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C11 H20 N2 O4 S -","- C11 H20 N2 O4 S -","- C22 H40 N4 O8 S2 -","2","1","TK6091","Li, Cong; Chan, Kannie Wai Yan; Szeto, Lap","<i>N,N</i>'-Bis(<i>tert</i>-butoxycarbonyl)thiourea","Acta Crystallographica Section E","2003","59","3","o366","o368","10.1107/S1600536803003647","","","0.7107","MoKα","","","0.045","","","","0.057","","","","","","1.566","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202179","14.1659","0.0002","7.9501","0.0001","12.3307","0.0002","90","","100.85","0.001","90","","1363.86","0.03","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis-N,N'-(3-hydroxyphenyl)-1,4,5,8-naphthalenetetracarboxylic diimide","","- C30 H26 N2 O8 S2 -","- C30 H26 N2 O8 S2 -","- C60 H52 N4 O16 S4 -","2","0.5","TK6092","Fallon, Gary D.; Lee, Marcia A-P.; Langford, Steven J.","<i>N,N</i>'-Bis(3-hydroxyphenyl)-1,8:4,5-naphthalenetetracarboximide dimethyl sulfoxide disolvate","Acta Crystallographica Section E","2003","59","3","o328","o329","10.1107/S1600536803003088","","","0.71073","MoKα","","0.063","0.039","","","0.097","0.105","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202180","5.9646","0.0001","18.0749","0.0003","25.8911","0.0006","90","","90","","90","","2791.31","0.09","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","D-Mannitol 1,6-dibenzoate-2:4, 3:5-O2:O4, O3:O5 bis(phenylboronate)","","- C32 H28 B2 O8 -","- C32 H28 B2 O8 -","- C128 H112 B8 O32 -","4","1","TK6093","Duggan, Peter D.; Humphrey, David G.; Price, David J.; Tyndall, Edward M.","1,6-Dibenzoyloxy-2:4,3:5-<i>O</i>^2^:<i>O</i>^4^,<i>O</i>^3^:<i>O</i>^5^-bis(phenylboronoyloxy)-<small>D</small>-mannitol","Acta Crystallographica Section E","2003","59","3","o372","o373","10.1107/S1600536803004069","","","0.71073","MoKα","","0.128","0.06","","","0.08","0.097","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202181","9.8368","0.0008","9.8368","0.0008","42.455","0.005","90","","90","","120","","3557.7","0.6","293","2","293","2","","","","","","","","3","P 65","P 65","170","trilobolide-6-O-isobutyrate","","","- C23 H32 O9 -","- C23 H32 O9 -","- C138 H192 O54 -","6","1","TK6094","Xue-Song Huang; Ren-Wang Jiang; Vincent Eng-Choon Ooi","Trilobolide-6-<i>O</i>-isobutyrate, a eudesmanolide from <i>Wedelia trilobata</i>","Acta Crystallographica Section E","2003","59","6","o771","o772","10.1107/S1600536803009590","","","0.71073","MoKα","","0.066","0.051","","","0.141","0.153","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202182","14.6419","0.0003","7.6642","0.0002","12.066","0.0002","90","","90","","90","","1354.03","0.05","203","2","203","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Tetrachloro(N,N,N',N'-tetramethylethylenediamine)zirconium(IV)","","- C6 H16 Cl4 N2 Zr -","- C6 H16 Cl4 N2 Zr -","- C24 H64 Cl16 N8 Zr4 -","4","1","TK6095","Rickard, Clifton E. F.; Glenny, Mark W.; Nielson, Alastair J.","Tetrachloro(<i>N,N,N</i>',<i>N</i>'-tetramethylethylenediamine)zirconium(IV)","Acta Crystallographica Section E","2003","59","4","m183","m184","10.1107/S1600536803004458","","","0.71073","MoKα","","0.0195","0.0179","","","0.0443","0.0449","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202183","6.587","0.003","13.723","0.005","11.758","0.005","90","","99.183","0.006","90","","1049.2","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-[(2-Hydroxyphenyl)methleneamino]-1,3,4-thiadiazole-2(3H)-thione","","- C9 H7 N3 O S2 -","- C9 H7 N3 O S2 -","- C36 H28 N12 O4 S8 -","4","1","TK6096","Zhang, Yu-Xia","5-[(2-Hydroxyphenyl)methyleneamino]-1,3,4-thiadiazole-2(3<i>H</i>)-thione","Acta Crystallographica Section E","2003","59","4","o581","o582","10.1107/S1600536803006627","","","0.71073","MoKα","","0.05","0.034","","","0.077","0.085","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202184","6.8327","0.0004","10.8017","0.0012","12.2436","0.0005","90","","100.854","0.005","90","","887.47","0.12","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","ammonium thionicotinate hydrate","ammonium 2-mercaptopyridine-3-carboxylate hydrate","","- C6 H10 N2 O3 S -","- C6 H10 N2 O3 S -","- C24 H40 N8 O12 S4 -","4","1","TK6097","Graham Smith; Dalius S. Sagatys","Ammonium 2-mercaptopyridine-3-carboxylate hydrate","Acta Crystallographica Section E","2003","59","4","o540","o541","10.1107/S1600536803006020","","","0.71069","MoKα","","0.155","0.04","","","0.113","0.174","","","","","","0.996","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202185","8.927","0.002","12.514","0.003","5.802","0.002","102.98","0.02","102.23","0.03","100.71","0.02","598.4","0.3","295","2","295","2","","","","","","","","4","P -1","-P 1","2","1,4-bis(diphenylphosphino)butane half oxide","1-(Diphenylphosphino)-4-(diphenylphosphinoyl)butane","","- C28 H28 O P2 -","- C28 H28 O P2 -","- C28 H28 O P2 -","1","0.5","TK6098","Michael L. Williams; Peter C. Healy; Nicholas K. Loh; Samuel P. C. Dunstan; Graham Smith","1-(Diphenylphosphino)-4-(diphenylphosphinoyl)butane","Acta Crystallographica Section E","2003","59","5","o596","o598","10.1107/S1600536803006561","","","0.71069","MoKα","","0.069","0.048","","","0.137","0.154","","","","","","0.86","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202186","14.183","0.004","14.699","0.005","25.814","0.009","91.904","0.011","92.328","0.011","102.784","0.011","5239","3","123","2","123","2","","","","","","","","7","P -1","-P 1","2","'μ~3~-Chloro-tri-μ-chloro-μ~3~- sulfidohexakis (triphenylphospine)triruthenium(II)","μ~3~-Chloro-tri-μ-chloro- 1κ^2^Cl,2κ^2^Cl,3κ^2^Cl-triangulo-μ~3~ -sulfidohexakis(triphenylphosphine)triruthenium(II)‒tetrahydrofuran‒water (1/1.25/0.75)","","- C113 H100 Cl4 O2 P6 Ru3 S -","- C113 H100 Cl4 O2 P6 Ru3 S -","- C226 H200 Cl8 O4 P12 Ru6 S2 -","2","1","TK6099","Vicki-Anne Tolhurst; David Cookson; Peter Turner","A synchrotron study of μ~3~-chloro-tri-μ-chloro-μ~3~-sulfido-hexakis(triphenylphospine)triruthenium(II)‒tetrahydrofuran‒water (1/1.25/0.75)","Acta Crystallographica Section E","2003","59","4","m218","m219","10.1107/S1600536803006573","","","0.5594","synchrotron","","0.116","0.089","","","0.223","0.243","","","","","","1.42","","","","has coordinates,has Fobs","194596","2020-10-21","18:00:00",""
"2202187","6.933","0.002","14.21","0.004","15.913","0.005","99.657","0.006","101.373","0.006","91.12","0.006","1512.9","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Ethyl N-(2-butyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)carbamate","","- C15 H18 N2 O4 -","- C15 H18 N2 O4 -","- C60 H72 N8 O16 -","4","2","TK6100","Shi, Da-Xin; Feng, Ya-Qing; Li, Xiao-Fang","Ethyl <i>N</i>-(2-butyl-1,3-dioxo-2,3-dihydro-1<i>H</i>-isoindol-5-yl)carbamate","Acta Crystallographica Section E","2003","59","5","o739","o741","10.1107/S1600536803009346","","","0.71073","MoKα","","0.151","0.062","","","","0.168","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202188","5.816","0.002","9.557","0.003","19.948","0.005","90","","91.461","0.007","90","","1108.4","0.6","123","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H24 Fe N2 O6 -","- C24 H24 Fe N2 O6 -","- C48 H48 Fe2 N4 O12 -","2","0.5","TK6101","Osawa, Kunitoyo; Furutachi, Hideki; Fujinami, Shuhei; Suzuki, Masatastu","<i>trans,trans,trans</i>-Diethanoldiquinaldinatoiron(II)","Acta Crystallographica Section E","2003","59","6","m315","m316","10.1107/S1600536803009607","","","0.7107","MoKα","","","0.039","","","","0.069","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202189","6.03","0.001","10.467","0.001","13.568","0.001","90","","90","","90","","856.36","0.18","298","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Δ-Aqua-S-citrato(2-)manganese(II)","","- C6 H8 Mn O8 -","- C6 H8 Mn O8 -","- C24 H32 Mn4 O32 -","4","1","TK6102","Deng, Yuan-Fu; Zhou, Zhao-Hui; Wan, Hui-Lin; Ng, Seik Weng","Δ-Aqua-<i>S</i>-citrato(2‒)manganese(II)","Acta Crystallographica Section E","2003","59","6","m310","m312","10.1107/S1600536803009383","","","0.71073","MoKα","","","0.048","","","0.094","0.094","","","","","","1.21","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202190","9.061","0.003","11.931","0.003","5.4924","0.0015","90","","90","","90","","593.8","0.3","295","","295","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","N-methyl taurine","2-(methylamino)ethanesulfonic acid","","- C3 H9 N O3 S -","- C3 H9 N O3 S -","- C12 H36 N4 O12 S4 -","4","1","TK6103","John A. Kalaitzis; Priscila de Almeida Leone; Ronald J. Quinn; Peter C. Healy","Zwitterionic 2-(methylamino)ethanesulfonic acid","Acta Crystallographica Section E","2003","59","5","o726","o727","10.1107/S160053680300895X","","","0.7107","MoKα","","0.032","0.031","","","0.08","0.085","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202191","8.829","0.003","9.644","0.004","14.283","0.005","104.833","0.014","92.357","0.007","109.866","0.011","1094.6","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","2-Aminoethylammonium tris(1,2-ethylenediamine)nickel tetraselenoantimonate","","- C8 H33 N8 Ni Sb Se4 -","- C8 H33 N8 Ni Sb Se4 -","- C16 H66 N16 Ni2 Sb2 Se8 -","2","1","TK6104","Ming-Lai Fu; Wen-Tong Chen; Li-Zhen Cai; Guo-Wei Zhou; Guo-Cong Guo; Jiang-Gao Mao; Jin-Shun Huang","2-Aminoethylammonium tris(1,2-ethylenediamine)nickel(II) tetraselenoantimonate(V)","Acta Crystallographica Section E","2003","59","6","m367","m369","10.1107/S1600536803009243","","","0.71073","MoKα","","0.092","0.054","","","0.078","0.088","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202192","10.481","0.002","10.597","0.002","13.568","0.003","97.12","0.03","93.55","0.03","105.38","0.03","1434.7","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H30 N4 O10 Zn -","- C28 H30 N4 O10 Zn -","- C56 H60 N8 O20 Zn2 -","2","1","TK6105","Jin Yang; Jian-Fang Ma; Jing-Fu Liu","An aquazinc(II) complex of 1,10-phenanthroline with fumarate counter-ions","Acta Crystallographica Section E","2003","59","6","m324","m326","10.1107/S1600536803009619","","","0.71073","MoKα","","0.036","0.026","","","0.071","0.082","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202193","5.736","0.003","11.468","0.005","12.095","0.004","81.1","0.6","98.83","0.03","98.03","0.03","771.2","1.3","295","","295","","","","","","","","","4","P -1","-P 1","2","","Spiro[1,3-dioxolane-2,4'-[8]phenylsulfonylbicyclo[4.2.0]octan[1]ol]","","- C16 H20 O5 S -","- C16 H20 O5 S -","- C32 H40 O10 S2 -","2","1","TK6107","Wendy A. Loughlin; Michelle A. McCleary; Peter C. Healy","Spiro[1,3-dioxolane-2,4'-[8]phenylsulfonylbicyclo[4.2.0]octan-1-ol]","Acta Crystallographica Section E","2003","59","6","o789","o791","10.1107/S1600536803009735","","","0.71069","MoKα","","0.069","0.045","","","0.117","0.13","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202194","11.057","0.002","12.19","0.0018","18.79","0.003","88.4","0.8","100.633","0.015","104.349","0.013","2411","1","295","","295","","","","","","","","","5","P -1","-P 1","2","","tris(triphenylphosphine)copper(I) hexafluorophosphate","","- C54 H45 Cu F6 P4 -","- C54 H45 Cu F6 P4 -","- C108 H90 Cu2 F12 P8 -","2","1","TK6109","Peter C. Healy; John V. Hanna","Tris(triphenylphosphine)copper(I) hexafluorophosphate","Acta Crystallographica Section E","2003","59","6","m384","m386","10.1107/S1600536803010973","","","0.71069","MoKa","","0.088","0.053","","","0.143","0.163","","","","","","1.02","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202195","7.6739","0.0018","17.515","0.004","11.261","0.002","90","","91.243","0.014","90","","1513.2","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(aqua)bis(dimethylglyoxime)cobalt(III) azide hydrate","","- C8 H18 Co N7 O6 -","- C8 H18 Co N7 O6 -","- C32 H72 Co4 N28 O24 -","4","1","WN6128","Dong, Zhi-Yong; Liu, Xuan-Wen; Wang, Xiao-Qing; Wang, Ru-Ji; Shen, Guang-Qiu","Aqua(azido)(dimethylglyoximato)(dimethylglyoxime)cobalt(III) monohydrate","Acta Crystallographica Section E","2003","59","5","m260","m262","10.1107/S1600536803003520","","","0.71073","MoKα","","0.0654","0.0417","","","0.0867","0.1002","","","","","","1.018","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202196","10.336","0.001","13.428","0.001","13.051","0.001","90","","99.56","0.02","90","","1786.2","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[1-(benzimidazol-2-ylmethyl)-1,4,7-triazacyclononane]chlorocopper(II) perchlorate","","- C14 H21 Cl2 Cu N5 O4 -","- C14 H21 Cl2 Cu N5 O4 -","- C56 H84 Cl8 Cu4 N20 O16 -","4","1","WN6129","Li, Qing-Xiang; Li, Yi-Zhi; Luo, Qin-Hui","[1-(Benzimidazol-2-ylmethyl)-1,4,7-triazacyclononane]chlorocopper(II) perchlorate","Acta Crystallographica Section E","2003","59","1","m23","m25","10.1107/S1600536802022183","","","0.71073","MoKα","","0.0472","0.0355","","","0.0662","0.0686","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202197","7.8096","0.0002","5.6168","0.0002","37.212","0.001","90","","90","","90","","1632.3","0.08","203","2","203","2","","","","","","","","4","P n a 21","P 2c -2n","33","","1-(4-Methacryloyloxyphenyl)-3-(3-bromophenyl)prop-2-en-1-one","","- C19 H15 Br O3 -","- C19 H15 Br O3 -","- C76 H60 Br4 O12 -","4","1","WN6130","T. Ravishankar; K. Chinnakali; S. Nanjundan; S. Radhakrishnan; Anwar Usman; Hoong-Kun Fun","1-(4-Methacryloyloxyphenyl)-3-(3-bromophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2003","59","2","o138","o140","10.1107/S1600536803000126","","","0.71073","MoKα","","0.136","0.069","","","0.142","0.169","","","","","","0.93","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202198","9.0026","0.0002","12.9509","0.0004","26.5409","0.0002","90","","97.612","0.001","90","","3067.18","0.12","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis (mu-phenylthiodiiron-hexacarbonyl) (mu~4~-sulfido)","","- C24 H10 Fe4 O12 S3 -","- C24 H10 Fe4 O12 S3 -","- C96 H40 Fe16 O48 S12 -","4","1","WN6131","Hu, Mingqiang; Ma, Chengbing; Zhang, Xiaofeng; Fang, Cheng; Chen, Feng; Chen, Changneng; Liu, Qiutian","μ~4~-Sulfido-bis(μ~2~-phenylthiolato)tetrakis(tricarbonyliron)","Acta Crystallographica Section E","2003","59","2","m55","m56","10.1107/S1600536803000138","","","0.71073","MoKα","","","0.0694","","","0.1264","0.1468","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202199","16.6529","0.0018","14.4143","0.0016","7.231","0.0008","90","","90.719","0.002","90","","1735.6","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Trimesic acid bis(N,N-dimethylformamide) solvate","","- C15 H20 N2 O8 -","- C15 H20 N2 O8 -","- C60 H80 N8 O32 -","4","1","WN6132","Dale, Sophie H.; Elsegood, Mark R. J.","Trimesic acid bis(<i>N,N</i>-dimethylformamide) solvate at 150K","Acta Crystallographica Section E","2003","59","2","o127","o128","10.1107/S160053680300076X","","","0.71073","MoKα","","0.1204","0.0514","","","0.1048","0.1338","","","","","","1.025","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202200","6.8049","0.0014","21.1","0.004","6.8968","0.0014","90","","95.75","0.03","90","","985.3","0.3","105","2","105","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","β-alaninium trichloroacetate","β-alaninium trichloroacetate","","- C5 H8 Cl3 N O4 -","- C5 H8 Cl3 N O4 -","- C20 H32 Cl12 N4 O16 -","4","1","WN6133","K. Rajagopal; R. V. Krishnakumar; M. Subha Nandhini; A. Mostad; S. Natarajan","β-Alaninium trichloroacetate at 105K","Acta Crystallographica Section E","2003","59","2","o206","o208","10.1107/S1600536803001107","","","0.71073","MoKα","","0.0468","0.0455","","","0.1027","0.1035","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202201","6.7702","0.0003","21.4106","0.0011","12.3411","0.0006","90","","98.108","0.01","90","","1771.01","0.15","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H23 N12 O7 P -","- C6 H23 N12 O7 P -","- C24 H92 N48 O28 P4 -","4","1","WN6134","Gordon, Laura E.; Harrison, William T. A.","Bis(melaminium) hydrogen phosphite tetrahydrate","Acta Crystallographica Section E","2003","59","2","o195","o197","10.1107/S1600536803001247","","","0.71073","MoKα","","0.0584","0.0368","","","0.0933","0.1024","","","","","","0.959","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2202202","5.4193","0.0002","18.0847","0.0005","9.4713","0.0003","90","","95.7044","0.0011","90","","923.65","0.05","100","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","(S)-phenylsuccinic acid","","- C10 H10 O4 -","- C10 H10 O4 -","- C40 H40 O16 -","4","2","WN6135","Andreas Fischer; Veronica M. Profir","(<i>S</i>)-Phenylsuccinic acid","Acta Crystallographica Section E","2003","59","3","o319","o320","10.1107/S1600536803002836","","","0.71073","MoKα","","0.0363","0.0317","","","0.0714","0.074","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202203","14.2379","0.0003","6.2978","0.0001","12.311","0.0003","90","","90","","90","","1103.9","0.04","120","2","120","2","","","","","","","","5","P n m a","-P 2ac 2n","62","1,10-Phenanthroline-5,6-dione hydrogen bromide","5,6-Dioxo-1,10-phenanthrolin-1-ium bromide","","- C12 H7 Br N2 O2 -","- C12 H7 Br N2 O2 -","- C48 H28 Br4 N8 O8 -","4","0.5","WN6136","Bomfim, João A. S.; Filgueiras, Carlos A. L.; Howie, R. Alan; Wardell, James L.","5,6-Dioxo-1,10-phenanthrolin-1-ium bromide at 120K","Acta Crystallographica Section E","2003","59","2","o244","o246","10.1107/S1600536803002009","","","0.71073","MoKα","","0.0317","0.0285","","","0.075","0.0771","","","","","","1.108","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202204","9.5687","0.0002","10.5926","0.0002","16.696","0.0002","90","","95.423","0.001","90","","1684.69","0.05","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","7,14-Dioxatetracyclo(14.2^4,5^.2^19,20^.2^21,22^.2^23,24^)tetracosa- 1,3,5,9,11,15,17,19,21,23-decaene","","- C22 H18 O2 -","- C22 H18 O2 -","- C88 H72 O8 -","4","1","WN6137","T. Ravishankar; K. Chinnakali; P. Rajakumar; V. Murali; Anwar Usman; Hoong-Kun Fun","7,14-Dioxatetracyclo[14.2^4,5^.2^19,20^.2^21,22^.2^23,24^]tetracosa-1,3,5,9,11,15,17,19,21,23-decaene","Acta Crystallographica Section E","2003","59","3","o290","o292","10.1107/S1600536803002733","","","0.71073","MoKα","","0.1297","0.0643","","","0.1274","0.1432","","","","","","0.824","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202205","13.3086","0.0007","5.8168","0.0003","20.8145","0.0011","90","","95.463","0.001","90","","1604","0.15","183","2","183","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","7,16-dioxatetracyclo(16.2^4,5^.2^21,22^.2^23,24^.0^9,14^)-tetracosa- 1,3,5,9,11,13,17,19,21,23-decaene","","- C22 H18 O2 -","- C22 H18 O2 -","- C88 H72 O8 -","4","1","WN6138","T. Ravishankar; K. Chinnakali; P. Rajakumar; V. Murali; Anwar Usman; Hoong-Kun Fun","7,16-Dioxatetracyclo[16.2^4,5^.2^21,22^.2^23,24^.0^9,14^]tetracosa-1,3,5,9,11,13,17,19,21,23-decaene","Acta Crystallographica Section E","2003","59","3","o293","o295","10.1107/S1600536803002745","","","0.71073","MoKα","","0.1329","0.0772","","","0.1772","0.1964","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202206","4.809","0.006","40.353","0.005","7.882","0.009","90","","105.65","0.02","90","","1473","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","n-undecylammonium bromide monohydrate","","- C11 H28 Br N O -","- C11 H28 Br N O -","- C44 H112 Br4 N4 O4 -","4","1","WN6139","Kruger, Gert J.; Rademeyer, Melanie; Billing, David G.","<i>n</i>-Undecylammonium bromide monohydrate","Acta Crystallographica Section E","2003","59","4","o480","o482","10.1107/S1600536803004859","","","0.71073","MoKα","","0.1103","0.0442","","","0.0946","0.1234","","","","","","0.943","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202207","5.7609","0.0009","7.5689","0.0011","14.227","0.002","99.374","0.002","91.216","0.002","96.778","0.002","607.27","0.16","293","2","293","2","","","","","","","","5","P -1","-P 1","2","p-bromoanilino acetophenone","2-[(4-bromophenyl)amino]-1-phenylethanone","","- C14 H12 Br N O -","- C14 H12 Br N O -","- C28 H24 Br2 N2 O2 -","2","1","WN6141","Saraogi, Ishu; Mruthyunjayaswamy, B. H. M.; Ijare, Omkar B.; Jadegoud, Y; Guru Row, T. N.","2-[(4-Bromophenyl)amino]-1-phenylethanone","Acta Crystallographica Section E","2003","59","4","o443","o444","10.1107/S1600536803004847","","","0.71073","MoKα","","0.0729","0.0545","","","0.0953","0.1004","","","","","","1.154","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202208","12.2484","0.0001","12.6553","0.0001","11.5031","0.0009","90","","102.407","0.005","90","","1741.42","0.14","123.1","","","","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C48 H26 S2 -","- C48 H26 S2 -","- C96 H52 S4 -","2","0.5","WN6142","Löhr, Sandra; Yonemura, Makiko; Orita, Akihiro; Imai, Nobuyuki; Akashi, Haruo; Junzo Otera","(<i>R</i>)-2,2'-Bis{[5-(2-phenylethynyl)thienyl]ethynyl}-1,1'-binaphthyl","Acta Crystallographica Section E","2003","59","5","o594","o595","10.1107/S1600536803007116","","","0.7107","MoKα","","","0.03","","","","0.094","","","","","","1.179","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202209","11.59","0.004","10.603","0.003","16.935","0.005","90","","90","","90","","2081.1","1.1","193","2","193","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","1-Methyl-2-trichloroacetyl-4-nitropyrrole","1-Methyl-4-nitro-2-(trichloroacetyl)pyrrole","","- C7 H5 Cl3 N2 O3 -","- C7 H5 Cl3 N2 O3 -","- C56 H40 Cl24 N16 O24 -","8","1","WN6144","Lu, Liping; Zhou Chengyong; Zhang, Guocai; Zhu, Miaoli; Yang, Pin","1-Methyl-4-nitro-2-(trichloroacetyl)pyrrole","Acta Crystallographica Section E","2003","59","4","o478","o479","10.1107/S1600536803005555","","","0.71073","MoKα","","0.055","0.0465","","","0.1079","0.1124","","","","","","1.087","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202210","11.5674","0.0015","10.1948","0.0019","21.433","0.003","90","","90","","90","","2527.5","0.7","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-phenyl-4a,5-dihydro-1,2,4-triazolo[3,4-b][1,3]benzothiazine","","- C15 H11 N3 S -","- C15 H11 N3 S -","- C120 H88 N24 S8 -","8","1","WN6145","P. G. Aravindan; V. Rajakannan; M. Yogavel; D. Velmurugan; A. Senthilvelan; Il-Hawn Suh","3-Phenyl-4a,5-dihydro-1,2,4-triazolo[3,4-<i>b</i>][1,3]benzothiazine","Acta Crystallographica Section E","2003","59","5","o622","o624","10.1107/S1600536803007190","","","0.71073","MoKα","","0.0772","0.0438","","","0.1217","0.1462","","","","","","0.877","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202211","21.8","0.004","11.587","0.002","16.886","0.003","90","","112.17","0.03","90","","3950","1.5","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Bis[dicarbonyl(η^5^-cyclopentadienyl)ferrio](N,N- diisobutyldithiocarbamato)tin(II)","","- C32 H46 Fe2 N2 O4 S4 Sn -","- C32 H46 Fe2 N2 O4 S4 Sn -","- C128 H184 Fe8 N8 O16 S16 Sn4 -","4","0.5","WN6146","Chen, Bao-Hua; Li, Yi-Zhi; Ma, Yong-Xiang; Wu, Xiao-Li; Li, Ping-Ren","Bis[dicarbonyl(η^5^-cyclopentadienyl)ferrio](<i>N,N</i>-diisobutyldithiocarbamato)tin(II)","Acta Crystallographica Section E","2003","59","5","m223","m224","10.1107/S160053680300713X","","","0.71073","MoKα","","0.0986","0.0537","","","0.1428","0.1533","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202212","35.978","0.005","4.0535","0.0006","12.3204","0.0019","90","","103.439","0.003","90","","1747.6","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis[aqua(4-chlorobenzoato)silver(I)]","","- C14 H12 Ag2 Cl2 O6 -","- C14 H12 Ag2 Cl2 O6 -","- C56 H48 Ag8 Cl8 O24 -","4","0.5","WN6147","Hai-Liang Zhu; Anwar Usman; Hoong-Kun Fun; Xian-Jiang Wang","Bis[aqua(4-chlorobenzoato)silver(I)](<i>Ag</i>—<i>Ag</i>)","Acta Crystallographica Section E","2003","59","5","m263","m265","10.1107/S1600536803008250","","","0.71073","MoKα","","0.0938","0.0548","","","0.1152","0.1304","","","","","","1.092","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202213","12.5386","0.0007","16.1113","0.0009","12.6488","0.0007","90","","96.773","0.001","90","","2537.4","0.2","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H54 Hg2 I4 N4 P2 -","- C48 H54 Hg2 I4 N4 P2 -","- C96 H108 Hg4 I8 N8 P4 -","2","0.5","WN6148","Cui Da-Jun; Zeng Xianshun; Leng Xuebing; Xu Fengbo; Zhang Zhengzhi","An unexpected product: di-μ-iodo-bis{[2-(<i>N</i>-diphenylphosphinomethyl-<i>N</i>-cyclohexylamino)pyridine]iodomercury(II)}","Acta Crystallographica Section E","2003","59","6","o868","o869","10.1107/S1600536803008754","","","0.71073","MoKα","","0.0383","0.0296","","","0.0713","0.0764","","","","","","0.983","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202214","11.2683","0.0011","13.2572","0.0011","16.8041","0.0018","90","","94.783","0.006","90","","2501.6","0.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H24 Cr N3 O4 -","- C29 H24 Cr N3 O4 -","- C116 H96 Cr4 N12 O16 -","4","1","WN6150","Dai-Xi Li; Duan-Jun Xu; Yuan-Zhi Xu","Tris(8-quinolinolato-κ^2^<i>N,O</i>)chromium(III) ethanol solvate","Acta Crystallographica Section E","2003","59","5","m271","m272","10.1107/S1600536803008742","","","0.71073","MoKα","","0.081","0.058","","","0.144","0.162","","","","","","1.096","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202215","6.991","0.0002","9.676","0.0005","21.735","0.002","90","","90","","90","","1470.26","0.16","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","L-argininium bis(dihydrogen phosphate)","L-argininium bis(dihydrogen phosphate)","","- C6 H20 N4 O10 P2 -","- C6 H20 N4 O10 P2 -","- C24 H80 N16 O40 P8 -","4","1","WN6151","Reena Ittyachan; P. Sagayaraj; Babu Kothandapani","<small>L</small>-Argininium bis(dihydrogen phosphate)","Acta Crystallographica Section E","2003","59","6","o886","o888","10.1107/S1600536803009280","","","1.5418","CuKα","","0.0441","0.0439","","","0.1311","0.1317","","","","","","1.272","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202216","6.7699","0.001","9.1736","0.0013","14.5311","0.0019","77.91","0.011","85.013","0.011","86.886","0.012","878.5","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-Methoxymethyl-1,3-dithiolane 1,1,3,3-tetraoxide","","- C5 H10 O5 S2 -","- C5 H10 O5 S2 -","- C20 H40 O20 S8 -","4","2","WN6152","Özcan, Özlem; Gültekin, Zeynep; Frey, Wolfgang; Hökelek, Tuncer","2-Methoxymethyl-1,3-dithiolane 1,1,3,3-tetraoxide","Acta Crystallographica Section E","2003","59","6","o747","o749","10.1107/S1600536803009371","","","0.71073","MoKα","","0.042","0.0371","","","0.0999","0.1034","","","","","","1.119","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202217","7.213","0.0014","29.196","0.004","7.887","0.0016","90","","116.14","0.005","90","","1491","0.5","180","2","180","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","N-[3,5-bis(trifluoromethyl)phenyl]-3-methoxysalicylaldimine","","- C16 H11 F6 N O2 -","- C16 H11 F6 N O2 -","- C64 H44 F24 N4 O8 -","4","1","WN6153","Karadayı, Nevzat; Gözüyes̨il, Sanem; Güzel, Bilgehan; Kazak ,Canan; Büyükgüngör, Orhan","<i>N</i>-[3,5-Bis(trifluoromethyl)phenyl]-3-methoxysalicylaldimine","Acta Crystallographica Section E","2003","59","6","o851","o853","10.1107/S1600536803010730","","","0.71073","MoKα","","0.0956","0.0695","","","0.1732","0.1949","","","","","","1.125","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202218","11.3438","0.0017","11.3438","0.0017","19.665","0.004","90","","90","","120","","2191.5","0.6","150","2","150","2","","","","","","","","3","P 65","P 65","170","Trimesic acid triethyl ester","Triethyl benzene-1,3,5-tricarboxylate","","- C15 H18 O6 -","- C15 H18 O6 -","- C90 H108 O36 -","6","1","WN6156","Dale, Sophie H.; Elsegood, Mark R. J.","Triethyl benzene-1,3,5-tricarboxylate","Acta Crystallographica Section E","2003","59","6","o836","o837","10.1107/S1600536803010250","","","0.71073","MoKα","","0.0799","0.0425","","","0.0975","0.1224","","","","","","1.029","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2202219","9.105","0.002","22.729","0.003","8.157","0.003","90","","98.47","0.02","90","","1669.7","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-(E)-But-1-enyl-2,6-dimethoxyphenyl nicotinate","4-(E)-But-1-enyl-2,6-dimethoxyphenyl pyridine-3-carboxylate","","- C18 H19 N O4 -","- C18 H19 N O4 -","- C72 H76 N4 O16 -","4","1","WN6157","Palusiak, Marcin","4-(<i>E</i>)-But-1-enyl-2,6-dimethoxyphenyl nicotinate","Acta Crystallographica Section E","2003","59","6","o854","o856","10.1107/S1600536803010766","","","1.54178","CuKα","","0.1029","0.039","","","0.0918","0.1009","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202220","7.0514","0.001","7.3862","0.0012","23.6459","0.0016","90","","92.372","0.013","90","","1230.5","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H12 N4 O4 -","- C10 H12 N4 O4 -","- C40 H48 N16 O16 -","4","1","WN6159","Shang Shan; Duan-Jun Xu; Wei-Xiao Hu","Isobutyraldehyde 2,4-dinitrophenylhydrazone","Acta Crystallographica Section E","2003","59","6","o838","o840","10.1107/S1600536803010547","","","0.71069","MoKα","","0.103","0.067","","","0.143","0.159","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202221","5.674","0.003","9.803","0.009","9.906","0.008","87.37","0.07","99.64","0.05","100.35","0.06","534.3","0.7","293","2","293","2","","","","","","","","4","P 1","P 1","1","L-Leucinium oxalate","L-Leucinium oxalate","","- C8 H15 N O6 -","- C8 H15 N O6 -","- C16 H30 N2 O12 -","2","2","WN6161","K. Rajagopal; R. V. Krishnakumar; M. Subha Nandhini; R. Malathi; S. S. Rajan; S. Natarajan","<small>L</small>-Leucinium oxalate","Acta Crystallographica Section E","2003","59","6","o878","o880","10.1107/S1600536803011267","","","1.54178","CuKα","","0.0483","0.0448","","","0.1132","0.1166","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202222","10.0106","0.0009","10.228","0.0006","12.1627","0.0007","90","","95.763","0.006","90","","1239.03","0.15","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","N-Hydroxy-2-oxo-2,N'-diphenylacetamidine","","- C14 H12 N2 O2 -","- C14 H12 N2 O2 -","- C56 H48 N8 O8 -","4","1","WN6162","Büyükgüngör, Orhan; Hökelek, Tuncer; Taş, Murat; Batı, Hümeyra","<i>N</i>-Hydroxy-2-oxo-2,<i>N</i>'-diphenylacetamidine","Acta Crystallographica Section E","2003","59","6","o883","o885","10.1107/S1600536803010882","","","0.71073","MoKα","","0.0566","0.0337","","","0.0835","0.0881","","","","","","0.807","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202223","6.9347","0.0007","9.9827","0.001","10.4868","0.0011","61.633","0.002","78.828","0.002","83.139","0.002","626.38","0.11","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","5-Ethyl-6-oxo-4-thioxo-1,3,2- oxazaphospholidino[3,2-a][1,3,2]benzodiazaphosphorine","","- C11 H13 N2 O2 P S -","- C11 H13 N2 O2 P S -","- C22 H26 N4 O4 P2 S2 -","2","1","WW6058","Sheng-Lou Deng; Ru-Yu Chen; Xue-Bing Leng; Lin-Hong Weng","5-Ethyl-6-oxo-4-thioxo-1,3,2-oxazaphospholidino[3,2-<i>a</i>][1,3,2]benzodiazaphosphorine","Acta Crystallographica Section E","2003","59","3","o285","o287","10.1107/S1600536803002290","","","0.71073","MoKα","","0.0472","0.0414","","","0.1127","0.1184","","","","","","1.043","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202224","10.409","0.002","6.133","0.002","19.665","0.004","90","","95.386","0.003","90","","1249.8","0.5","153","2","153","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C12 H23 N3 -","- C12 H23 N3 -","- C48 H92 N12 -","4","1","WW6060","Mei-su Zhou; Dian-sheng Liu; Shu-ping Huang; Hong-bo Tong","2-<i>tert</i>-Butyl-4-piperidino-β-diketimine","Acta Crystallographica Section E","2003","59","3","o310","o311","10.1107/S1600536803002605","","","0.71073","MoKα","","0.0862","0.0653","","","0.1354","0.1444","","","","","","1.056","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202225","11.71","0.004","13.177","0.004","14.236","0.005","90","","90","","90","","2196.7","1.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(6R,9S,13R,14S)-7,8-didehydro-3,7-dimethoxy- 17-methyl-6-phenylmorphinan-4,6-diol","","- C25 H29 N O4 -","- C25 H29 N O4 -","- C100 H116 N4 O16 -","4","1","WW6063","Li, Chun-Bao; Zhang,Wen-Qin; Wang, Chao","(6<i>R</i>,9<i>S</i>,13<i>R</i>,14<i>S</i>)-7,8-Didehydro-3,7-dimethoxy-17-methyl-6-phenylmorphinan-4,6-diol","Acta Crystallographica Section E","2003","59","4","o498","o500","10.1107/S1600536803005646","","","0.71073","MoKα","","0.1099","0.0436","","","","0.1062","","","","","","0.963","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202226","9.2025","0.0012","18.759","0.002","23.761","0.003","90","","92.009","0.003","90","","4099.3","0.9","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","3-Bromo-4-(dicyclohexylphosphinoyl)-2,6-dimethoxypyridine","","- C19 H29 Br N O3 P -","- C19 H29 Br N O3 P -","- C152 H232 Br8 N8 O24 P8 -","8","2","WW6064","Wu, Jing; Guo, Rongwei; Zhou, Zhongyuan; Chen, Hua; Yeung, Chihung","3-Bromo-4-(dicyclohexylphosphinoyl)-2,6-dimethoxypyridine","Acta Crystallographica Section E","2003","59","4","o493","o494","10.1107/S1600536803005531","","","0.71073","MoKα","","0.1337","0.0516","","","0.1051","0.1165","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202227","9.896","0.003","14.724","0.004","15.55","0.005","111.815","0.005","101.814","0.005","103.51","0.005","1935.7","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4,11-Bis(4-chlorophenyl)-3,10-bis(2,6-dichlorophenyl)-1,8-dioxa-2,9- diazadispiro[4.1.4.2]trideca-2,9-dien-6-one chloroform methanol solvate","","- C34.75 H24 Cl9 N2 O3.75 -","- C34.75 H21 Cl9 N2 O3.75 -","- C69.5 H42 Cl18 N4 O7.5 -","2","1","WW6065","Li, Xiao-Fang; Feng, Ya-Qing; Hu Xiao-Fen","4,11-Bis(4-chlorophenyl)-3,10-bis(2,6-dichlorophenyl)-1,8-dioxa-2,9-diazadispiro[4.1.4.2]trideca-2,9-dien-6-one‒chloroform‒methanol (1/1/0.75)","Acta Crystallographica Section E","2003","59","5","o670","o671","10.1107/S1600536803005543","","","0.71073","MoKα","","0.0869","0.056","","","","0.1954","","","","","","1.095","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202228","9.5168","0.0011","10.3952","0.0011","25.398","0.003","90","","90","","90","","2512.6","0.5","294","2","294","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","O,O'-(R)-(1,1'-Dinaphthyl-2,2'-diyl)-N,N'-benzyl-2- pyridinephosphoramidite","","- C32 H23 N2 O2 P -","- C32 H23 N2 O2 P -","- C128 H92 N8 O8 P4 -","4","1","WW6066","Liang, Liang; Guo, Rongwei; Zhou, Zhongyuan","<i>O,O</i>'-(<i>R</i>)-(1,1'-Dinaphthyl-2,2'-diyl) <i>N</i>-benzyl-<i>N</i>-(2-pyridyl)phosphoramidite","Acta Crystallographica Section E","2003","59","5","o599","o600","10.1107/S1600536803006640","","","0.71073","MoKα","","0.1421","0.0425","","","0.0466","0.0581","","","","","","0.895","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202229","7.114","0.0018","11.035","0.003","11.851","0.003","69.564","0.004","89.016","0.004","74.151","0.004","835.5","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Bis[N-(2-fluoro-4-bromobenzyl)pyridinium] bis(maleonitriledithiolato)palladium(II)","","- C32 H20 Br2 F2 N6 Pd S4 -","- C32 H20 Br2 F2 N6 Pd S4 -","- C32 H20 Br2 F2 N6 Pd S4 -","1","0.5","WW6067","Youcun Chen; Jingli Xie; Xiaoming Ren; Guangxiang Liu","The 1:2 bis(maleonitriledithiolato)palladium(II) complex of the <i>N</i>-(2-fluoro-4-bromobenzyl)pyridinium cation","Acta Crystallographica Section E","2003","59","4","m157","m159","10.1107/S1600536803005270","","","0.71073","MoKα","","0.0374","0.0302","","","0.0642","0.0652","","","","","","1.124","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202230","8.821","0.001","11.603","0.003","8.013","0.001","93.93","0.03","105.95","0.01","83.77","0.01","783.3","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C3 H32 Co Mo6 N9 O28 -","- C3 H18 Co Mo6 N9 O28 -","- C3 H18 Co Mo6 N9 O28 -","1","0.5","WW6068","Lee, Uk; Jang, Soon-Jung; Joo, Hea-Chung; Park, Ki-Min","Triguanidinium hexahydrogenhexamolybdocobaltate(III) tetrahydrate","Acta Crystallographica Section E","2003","59","6","m345","m347","10.1107/S1600536803009991","","","0.7107","MoKα","","0.0345","0.0308","","","0.081","0.084","","","","","","1.154","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2202231","7.8297","0.0013","9.8086","0.0016","11.031","0.0018","65.369","0.003","75.843","0.003","77.15","0.003","739.7","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N-(1-thiophene-2-yl-ethylidene)-hydrazinecarbodithioic acid benzyl ester","","- C14 H14 N2 S3 -","- C14 H14 N2 S3 -","- C28 H28 N4 S6 -","2","1","WW6069","Chan, Mun Hoe Eddy; Crouse, Karen A.; Tarafder, M. T. H.; Yamin, Bohari. M.","Benzyl <i>N</i>-[1-(thiophen-2-yl)ethylidene)]hydrazinecarbodithioate","Acta Crystallographica Section E","2003","59","5","o628","o629","10.1107/S1600536803007517","","","0.71073","MoKα","","0.043","0.039","","","0.109","0.113","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202232","7.204","0.003","7.534","0.003","8.821","0.004","78.109","0.005","73.979","0.006","85.353","0.006","450.1","0.3","184","2","184","2","","","","","","","","4","P -1","-P 1","2","N,N-dimethylbiguanidium nitrate","N,N-dimethylbiguanidium nitrate","","- C4 H12 N6 O3 -","- C4 H12 N6 O3 -","- C8 H24 N12 O6 -","2","1","WW6070","Zhu, Miaoli; Lu, Liping; Yang, Pin","<i>N,N</i>-Dimethylbiguanidium nitrate","Acta Crystallographica Section E","2003","59","4","o586","o588","10.1107/S1600536803006639","","","0.71073","MoKα","","0.0739","0.0543","","","0.1186","0.1288","","","","","","1.011","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202233","17.9522","0.0013","7.5712","0.0005","7.4092","0.0006","90","","90","","90","","1007.06","0.13","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","aqua(μ~4~-maleato-κ^4^O)pyridylnickel(II)","","- C9 H9 N Ni O5 -","- C9 H9 N Ni O5 -","- C36 H36 N4 Ni4 O20 -","4","0.5","WW6072","Yun Chen; Ping Liu; Jian Wang; Wen-Dan Cheng","Polymeric aqua(μ~4~-maleato-κ^4^<i>O</i>)pyridylnickel(II)","Acta Crystallographica Section E","2003","59","6","m393","m395","10.1107/S1600536803011231","","","0.71073","MoKα","","0.0909","0.0559","","","0.1195","0.1378","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202234","14.5727","0.0008","6.9988","0.0001","8.5447","0.0005","90","","118.012","0.003","90","","769.39","0.07","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Tetraaqua-trans-bis(nicotinato-κN)cadmium(II)","","- C12 H16 Cd N2 O8 -","- C12 H16 Cd N2 O8 -","- C24 H32 Cd2 N4 O16 -","2","0.25","WW6074","Youfu Zhou; Wenhua Bi; Xing Li; Jiutong Chen; Rong Cao; Maochun Hong","Tetraaqua-<i>trans</i>-bis(nicotinato-κ<i>N</i>)cadmium(II)","Acta Crystallographica Section E","2003","59","6","m356","m358","10.1107/S1600536803010675","","","0.71073","MoKα","","","0.0378","","","0.0928","0.0946","","","","","","1.148","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202235","10.3492","0.0013","9.979","0.0013","14.6493","0.0018","90","","96.382","0.002","90","","1503.5","0.3","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","Singuaiol","1(5),6(7)-diepoxy-4-guaiol hemihydrate","","- C15 H25 O3.5 -","- C15 H25 O3.5 -","- C60 H100 O14 -","4","2","WW6076","Xiang-Quan Ma; Cheng-Zhu Liao; Jing-Yu Su; Long-Mei Zeng","1(5),6(7)-Diepoxy-4-guaiol hemihydrate","Acta Crystallographica Section E","2003","59","6","o889","o890","10.1107/S1600536803010961","","","0.71073","MoKα","","0.0458","0.0414","","","0.1279","0.1342","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202236","20.786","0.002","32.459","0.003","9.727","0.0011","90","","90","","90","","6562.7","1.1","90","2","90","2","","","","","","","","6","F d d 2","F 2 -2d","43","Cl~2~Mg(OPPh~3~)~2~","","","- C36 H30 Cl2 Mg O2 P2 -","- C36 H30 Cl2 Mg O2 P2 -","- C288 H240 Cl16 Mg8 O16 P16 -","8","0.5","WW6077","Benjamin E. Kucera; Marilyn M. Olmstead; Robin S. Tanke; Susan M. Kauzlarich","Dichlorobis(triphenylphosphine oxide)magnesium","Acta Crystallographica Section E","2003","59","6","m359","m360","10.1107/S1600536803009723","","","0.71073","MoKα","","0.0235","0.0229","","","0.061","0.0613","","","","","","1.074","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202237","7.7956","0.0007","8.4511","0.0008","11.4697","0.0011","83.054","0.002","75.008","0.002","67.219","0.002","672.8","0.11","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","3,4:9,10-dibenzo-1,12-diformyl-5,8-dioxododecane","","- C16 H14 O4 -","- C16 H14 O4 -","- C32 H28 O8 -","2","1","WW6078","P. G. Aravindan; M. Yogavel; M. Thirumavalavan; P. Akilan; D. Velmurugan; M. Kandaswamy; S. Shanmuga Sundara Raj; H.-K. Fun","3,4:9,10-Dibenzo-1,12-diformyl-5,8-dioxododecane","Acta Crystallographica Section E","2003","59","6","o806","o807","10.1107/S1600536803009942","","","0.71073","MoKα","","0.166","0.0858","","","0.2077","0.2403","","","","","","0.834","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202238","10.8329","0.0009","11.3792","0.0009","19.7327","0.0016","90","","97.662","0.002","90","","2410.7","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H20 Co N4 O6 -","- C26 H20 Co N4 O6 -","- C104 H80 Co4 N16 O24 -","4","0.5","WW6079","He, Hong-Yin; Ma, Ai-Qing; Zhu, Long-Guan","Diaqua(4,4'-bipyridine)bis(4-cyanobenzoato)cobalt(II)","Acta Crystallographica Section E","2003","59","6","m333","m335","10.1107/S1600536803010249","","","0.71073","MoKα","","0.0432","0.0349","","","0.0841","0.0869","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202239","9.526","0.002","19.053","0.004","10.787","0.002","90","","92.19","0.03","90","","1956.4","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquatris(4-pyridylcarboxylato)neodymium(III)","","- C18 H16 N3 Nd O8 -","- C18 H16 N3 Nd O8 -","- C72 H64 N12 Nd4 O32 -","4","1","WW6080","Shao, Ting; Zhang, Hong-Tao","Diaquatris(4-pyridylcarboxylato)neodymium(III)","Acta Crystallographica Section E","2003","59","6","m353","m355","10.1107/S1600536803009917","","","0.71073","MoKα","","0.044","0.0293","","","0.0688","0.0737","","","","","","1.068","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202240","7.0244","0.0007","8.5982","0.0011","8.7399","0.0005","100.248","0.006","111.981","0.007","104.734","0.009","450.91","0.09","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[diaquabis(1H-benzimidazole-κN^3^)nickel(II)]-μ-succinato- k^2^O:O']","","- C18 H20 N4 Ni O6 -","- C18 H20 N4 Ni O6 -","- C18 H20 N4 Ni O6 -","1","0.5","WW6083","Yu Liu; Jian-Min Gu; Duan-Jun Xu","<i>catena</i>-Poly[[diaquabis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)nickel(II)]-μ-succinato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2003","59","6","m330","m332","10.1107/S1600536803009887","","","0.71073","MoKα","","0.031","0.028","","","0.073","0.074","","","","","","1.108","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202241","5.2834","0.0017","7.936","0.003","14.37","0.005","90","","98.164","0.006","90","","596.4","0.4","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 N4 O4 S2 -","- C10 H10 N4 O4 S2 -","- C20 H20 N8 O8 S4 -","2","0.5","WW6084","Jia-Geng Liu; Duan-Jun Xu; Wei-Lin Sun","2,2'-Diamino-4,4'-bi-1,3-thiazolium fumarate","Acta Crystallographica Section E","2003","59","6","o812","o813","10.1107/S1600536803010006","","","0.7107","MoKα","","0.09","0.05","","","0.112","0.137","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202242","8.1825","0.0002","9.9758","0.0001","12.3121","0.0001","69.281","0.001","72.067","0.001","70.878","0.001","866.92","0.03","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-(1-Phenylsulfonyl-2-methylindol-3-ylcarbonyl)propanoic acid","","- C19 H17 N O5 S -","- C19 H17 N O5 S -","- C38 H34 N2 O10 S2 -","2","1","WW6085","R. Krishna; P. G. Aravindan; M. Yogavel; D. Velmurugan; S. Shanmuga Sundara Raj; H.-K. Fun; P. C. Srinivasan","3-(1-Phenylsulfonyl-2-methylindol-3-ylcarbonyl)propanoic acid","Acta Crystallographica Section E","2003","59","6","o875","o877","10.1107/S1600536803010596","","","0.71073","MoKα","","0.0698","0.0515","","","0.1359","0.1493","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202243","11.783","0.003","12.219","0.004","14.468","0.006","91.42","0.03","103.51","0.03","113.653","0.018","1838.8","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H38 N12 O7 Zn -","- C36 H38 N12 O7 Zn -","- C72 H76 N24 O14 Zn2 -","2","1","WW6086","Ying-Chun Liu; Jian-Fang Ma; Ning-Hai Hu; Heng-Qing Jia","[<i>N,N,N</i>',<i>N</i>'-Tetrakis(2-benzimidazolylmethyl)-1,2-ethanediamine]zinc(II) dinitrate ethanol solvate","Acta Crystallographica Section E","2003","59","6","m361","m363","10.1107/S1600536803010602","","","0.71073","MoKα","","0.0802","0.0418","","","0.0817","0.0894","","","","","","0.848","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202244","4.5868","0.0009","10.582","0.002","13.08","0.003","94.685","0.003","91.341","0.003","96.759","0.003","628","0.2","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H12 N2 O3 S -","- C11 H12 N2 O3 S -","- C22 H24 N4 O6 S2 -","2","1","WW6087","M. Sukeri M. Yusof; Bohari M. Yamin","3-(3-Benzoylthioureido)propionic acid","Acta Crystallographica Section E","2003","59","6","o828","o829","10.1107/S1600536803010389","","","0.71073","MoKα","","0.0533","0.0452","","","0.1164","0.1227","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202245","8.6272","0.0017","10.979","0.003","18.788","0.007","90","","94.71","0.03","90","","1773.6","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Amino-7-methoxy-3-(1-methyl-1H-benzimidazol-2-yl)chromenium perchlorate","","- C18 H16 Cl N3 O6 -","- C18 H16 Cl N3 O6 -","- C72 H64 Cl4 N12 O24 -","4","1","YA6118","Baumer, Vyacheslav N.; Karasev, Alexander A.; Sizova, Zoya A.","2-Amino-7-methoxy-3-(1-methyl-1<i>H</i>-benzimidazol-2-yl)chromenium perchlorate","Acta Crystallographica Section E","2003","59","1","o54","o56","10.1107/S1600536802022699","","","0.71073","MoKα","","0.07","0.047","","","0.095","0.099","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202246","13.5958","0.0008","13.6077","0.0008","14.4444","0.0009","90","","101.014","0.001","90","","2623.1","0.3","168","2","168","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","μ-Succinato-bis(aquatriphenyltin) bis(o-phenanthroline)","","- C64 H54 N4 O6 Sn2 -","- C64 H54 N4 O6 Sn2 -","- C128 H108 N8 O12 Sn4 -","2","0.5","YA6143","Chee, Chin Fei; Lo, Kong Mun; Ng, Seik Weng","μ-Succinato-bis(aquatriphenyltin)bis(<i>o</i>-phenanthroline)","Acta Crystallographica Section E","2003","59","1","m36","m37","10.1107/S1600536802022213","","","0.71073","MoKα","","0.022","0.017","","","0.047","0.048","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202247","11.1725","0.0006","11.1725","0.0006","11.1725","0.0006","90","","90","","90","","1394.6","0.13","150","","150","","","","","","","","","3","P a -3","-P 2ac 2ab 3","205","","Tetramethyl lead","","- C4 H12 Pb -","- C4 H12 Pb -","- C32 H96 Pb8 -","8","0.333333","YA6144","Holger Fleischer; Simon Parsons; Colin R. Pulham","Tetramethyllead(IV) at 150K","Acta Crystallographica Section E","2003","59","1","m11","m13","10.1107/S1600536802022201","","","0.71073","MoKα","","0.048","0.033","","0.121","0.094","0.105","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202248","7.283","0.002","12.032","0.003","13.912","0.003","85.97","0.02","84.19","0.02","75.82","0.02","1174.6","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-poly[[bis[cis-1-(2,4,6-trimethylphenyl)tetrazole-κN^4^]copper(II)]- di-μ-chloro]","","- C20 H24 Cl2 Cu N8 -","- C20 H24 Cl2 Cu N8 -","- C40 H48 Cl4 Cu2 N16 -","2","1","YA6145","Ivashkevich, Dmitry O.; Lyakhov, Alexander S.; Degtyarik, Mikhail M.; Gaponik, Pavel N.","Chain structure of <i>catena</i>-poly[[bis[<i>cis</i>-1-(2,4,6-trimethylphenyl)tetrazole-κ<i>N</i>^4^]copper(II)]-di-μ-chloro]","Acta Crystallographica Section E","2003","59","1","m14","m16","10.1107/S1600536802022195","","","0.71069","MoKα","","0.048","0.038","","","0.108","0.121","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202249","6.1054","0.0015","9.598","0.003","9.813","0.003","108.92","0.02","106.899","0.019","97.39","0.02","504.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-poly[[(2-tert-butyltetrazole-κN^4^)copper(II)]-di-μ-chloro]","","- C5 H10 Cl2 Cu N4 -","- C5 H10 Cl2 Cu N4 -","- C10 H20 Cl4 Cu2 N8 -","2","1","YA6146","Lyakhov, Alexander S.; Gaponik, Pavel N.; Degtyarik, Michail M.; Ivashkevich, Ludmila S.","The chain structure of <i>catena</i>-poly[[(2-<i>tert</i>-butyltetrazole-κ<i>N</i>^4^)copper(II)]-di-μ-chloro]","Acta Crystallographica Section E","2003","59","1","m38","m40","10.1107/S1600536802023085","","","0.71069","MoKα","","0.039","0.035","","","0.095","0.098","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202250","22.652","0.006","16.228","0.005","15.25","0.005","90","","130.636","0.014","90","","4254","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C50 H42 Cu N6 O5 -","- C50 H42 Cu N6 O5 -","- C200 H168 Cu4 N24 O20 -","4","0.5","YA6148","Jin-Ling Wang; Feng Ding; Fang-Ming Miao","Bis{4-[α-(4-acetylphenylimino)benzyl]-3-methyl-1-phenylpyrazol-5-onato}aquacopper(II)","Acta Crystallographica Section E","2003","59","3","m128","m130","10.1107/S1600536803002496","","","0.71073","MoKα","","0.129","0.055","","","0.08","0.096","","","","","","0.97","","","","has coordinates","199607","2020-10-21","18:00:00",""
"2202251","12.7902","0.0014","7.5505","0.0008","13.9952","0.0015","90","","90.375","0.002","90","","1351.5","0.3","299","2","299","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-[N-(Furan-2-carbonyl)-hydrazinocarbothioyl]-benzamide","","- C13 H11 N3 O3 S -","- C13 H11 N3 O3 S -","- C52 H44 N12 O12 S4 -","4","1","YA6149","Bohari M. Yamin; M. Sukeri M. Yusof","<i>N</i>-[<i>N</i>-(Furan-2-carbonyl)hydrazinothiocarbonyl]benzamide","Acta Crystallographica Section E","2003","59","2","o124","o126","10.1107/S1600536802023620","","","0.71073","MoKα","","0.057","0.047","","","0.133","0.141","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202252","20.665","0.008","11.335","0.003","17.347","0.006","90","","126.21","0.05","90","","3279","3","293","","293","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H20 Cl14 Mo6 N2 O2 -","- C12 H20 Cl14 Mo6 N2 O2 -","- C48 H80 Cl56 Mo24 N8 O8 -","4","0.5","YA6150","Andreas Flemström","Dianilinium tetradecachlorohexamolybdate dihydrate, (PhNH~3~)~2~[(Mo~6~Cl~8~)Cl~6~]·2H~2~O","Acta Crystallographica Section E","2003","59","4","m162","m164","10.1107/S1600536803004884","","","0.71073","MoKα","","0.038","0.029","","","0.06","0.062","","","","","","1.37","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202253","7.6712","0.0015","5.6251","0.0011","32.773","0.007","90","","90","","90","","1414.2","0.5","105","2","105","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","1-phenyl-5-(3-indolyl)-pent-4-ene-1,3-dione","","- C19 H15 N O2 -","- C19 H15 N O2 -","- C76 H60 N4 O8 -","4","1","YA6151","Arrieta, Antonio F.; Mostad, Arvid","5-(1<i>H</i>-Indol-3-yl)-1-phenylpent-4-ene-1,3-dione","Acta Crystallographica Section E","2003","59","4","o524","o526","10.1107/S1600536803003192","","","0.71073","MoKα","","0.052","0.037","","","0.081","0.097","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202254","11.534","0.004","10.719","0.004","14.006","0.005","90","","114.029","0.005","90","","1581.5","1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,2-bis(benzothiazol-2-ylsulfanyl)ethane","","- C16 H12 N2 S4 -","- C16 H12 N2 S4 -","- C64 H48 N8 S16 -","4","1","YA6152","Ruqiang Zou; Jian-Rong Li; Yan Zheng; Ruo-Hua Zhang; Xian-He Bu","1,2-Bis(benzothiazol-2-ylsulfanyl)ethane","Acta Crystallographica Section E","2003","59","4","o393","o394","10.1107/S1600536803004264","","","0.71073","MoKα","","0.075","0.039","","","0.081","0.094","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202255","7.0867","0.0004","9.4514","0.0004","13.8277","0.0008","90","","96.993","0.002","90","","919.28","0.08","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C4.28 H4.56 Cu Na2 O8 -","- C4.284 H4.568 Cu Na2 O8 -","- C17.136 H18.272 Cu4 Na8 O32 -","4","1","YA6153","Amalija Golobič; Karmen Klančar; Primož Šegedin","<i>catena</i>-Poly[disodium [[tris(formato-κ<i>O</i>)copper(II)]-μ~2~-formato-κ^2^<i>O</i>:<i>O</i>']], with partial substitution of formate by acetate, Na~2<i>n~</i>[Cu(O~2~CH)~4{-~<i>x</i>}(O~2~CCH~3~)~<i>x~</i>]~<i>n~</i> (<i>x</i> = 0.28)","Acta Crystallographica Section E","2003","59","4","m165","m167","10.1107/S1600536803005567","","","0.71073","MoKα","","0.029","0.026","","0.019","","0.018","","","1.26","","","1.27","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2202256","29.005","0.002","8.543","0.0006","9.3081","0.0007","90","","96.163","0.001","90","","2293.1","0.3","168","2","168","2","","","","","","","","4","C 1 2 1","C 2y","5","Mersinine A","(5R,5aR,7aR,11aR,13aR)-5,5a,6,7,12,13-Hexahydro-5-hydroxy-4H,10H-1,3,- benzodioxolo[4,5-κ]pyrrolo[3,2,1-mn][1,8]phenanthroline-4,5,7a(10aH)- tricarboxylic acid trimethyl ester","","- C25 H28 N2 O9 -","- C25 H28 N2 O9 -","- C100 H112 N8 O36 -","4","1","YA6154","Subramaniam, G.; Kam, Toh Seok; Ng, Seik Weng","Mersinine A from <i>Kopsia fruticosa</i>","Acta Crystallographica Section E","2003","59","4","o555","o557","10.1107/S1600536803006470","","","0.71073","MoKα","","0.041","0.033","","","0.081","0.084","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202257","13.2","0.0009","19.965","0.0014","8.9503","0.0006","90","","90","","90","","2358.7","0.3","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Bis(N-cyclohexyl-N-methyldithiocarbamato)dimethyltin(IV)","","- C18 H34 N2 S4 Sn -","- C18 H34 N2 S4 Sn -","- C72 H136 N8 S16 Sn4 -","4","0.5","YA6155","Normah Awang; Ibrahim Baba; M. Sukeri. M.Yusof; Bohari. M.Yamin","Bis(<i>N</i>-cyclohexyl-<i>N</i>-methyldithiocarbamato)dimethyltin(IV)","Acta Crystallographica Section E","2003","59","6","m348","m349","10.1107/S1600536803010420","","","0.71073","MoKα","","0.038","0.032","","","0.077","0.081","","","","","","1.06","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202258","12.8796","0.0006","10.6984","0.0006","13.3098","0.0007","90","","114.118","0.002","90","","1673.88","0.15","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Piperazinium hexaaquacobalt disulfate","","- C4 H24 Co N2 O14 S2 -","- C4 H24 Co N2 O14 S2 -","- C16 H96 Co4 N8 O56 S8 -","4","1","YA6156","Jian-Xin Pan; Guo-Yu Yang; Yan-Qiong Sun","Piperazinium hexaaquacobalt(II) disulfate","Acta Crystallographica Section E","2003","59","5","m286","m288","10.1107/S1600536803008407","","","0.71073","MoKα","","0.071","0.043","","","0.094","0.112","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202259","6.4927","0.0009","12.194","0.0011","24.9681","0.0018","90","","90","","90","","1976.8","0.4","293","2","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C22 H20 O8 -","- C22 H20 O8 -","- C88 H80 O32 -","4","1","YA6159","Jian-Feng Shi; Yan-Guang Wang","(5a<i>R</i>,8a<i>R</i>,9<i>R</i>)-9-(3,4,5-Trimethoxyphenyl)-5a,6,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-<i>d</i>][1,3]dioxole-5,8-dione","Acta Crystallographica Section E","2003","59","6","o756","o758","10.1107/S1600536803008948","","","0.71073","MoKα","","","0.033","","","","0.112","","","","","","0.98","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202260","15.188","0.004","8.685","0.003","14.645","0.003","90","","111.12","0.01","90","","1802","0.9","298","2","298","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Bis(pentachlorophenyl) disulfide","","- C12 Cl10 S2 -","- C12 Cl10 S2 -","- C48 Cl40 S8 -","4","0.5","YA6161","Deng, Shun-Liu; Long, La-Sheng; Xie, Su-Yuan; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","Bis(pentachlorophenyl) disulfide","Acta Crystallographica Section E","2003","59","6","o843","o844","10.1107/S1600536803010390","","","0.71073","MoKα","","0.045","0.036","","","0.095","0.099","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202261","13.592","0.004","14.545","0.004","16.427","0.004","90.018","0.004","109.683","0.004","117.455","0.004","2665.9","1.3","123.2","","123.2","","","","","","","","","6","P -1","-P 1","2","","","","- C28 H32 Cl2 Ir N2 P -","- C28 H32 Cl2 Ir N2 P -","- C112 H128 Cl8 Ir4 N8 P4 -","4","2","AC6041","Joseph D. Fassler; Janell R. Neulinger; John F. Tannaci","{[4-(4-[2,2']Bipyridyl)phenyl]dimethylphosphine}dichloro(η^5^-pentamethylcyclopentadienyl)iridium(III)","Acta Crystallographica Section E","2003","59","7","m434","m435","10.1107/S1600536803012170","","","0.7107","MoKα","","0.0634","0.0398","","0.0537","0.0461","0.0461","","","","","","1.227","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2202262","8.4479","0.0004","12.4759","0.0006","7.9293","0.0004","90","","100.634","0.003","90","","821.36","0.07","120","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Hydrindantin","2,2'-Dihydroxy-[2,2'-bi-1H-indene]-1,1',3,3'-(2H,2'H)-tetrone dihydrate","","- C18 H14 O8 -","- C18 H14 O8 -","- C36 H28 O16 -","2","0.5","AC6042","Daniel E. Lynch","2,2'-Dihydroxy-[2,2'-bi-1<i>H</i>-indene]-1,1',3,3'-(2<i>H</i>,2'<i>H</i>)-tetrone dihydrate","Acta Crystallographica Section E","2003","59","8","o1133","o1134","10.1107/S1600536803012145","","","0.71073","MoKα","","0.1017","0.0522","","","0.1018","0.1162","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202263","8.0217","0.0007","13.5313","0.0012","14.2383","0.0012","90","","90","","90","","1545.5","0.2","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","8-Oxotetrahydrothalifendine","10-Hydroxy-9-methoxy-5,6,13,13a-tetrahydro-[1,3]dioxolo[4,5-g] isoquino[3,2-a]isoquinolin-8-one","","- C19 H17 N O5 -","- C19 H17 N O5 -","- C76 H68 N4 O20 -","4","1","AC6043","Aree, Thammarat; Singhana, Burapol; Pakawatchai, Chaveng; Chavasiri, Warinthorn; Kokpol, Udom","10-Hydroxy-9-methoxy-5,6,13,13a-tetrahydro[1,3]dioxolo[4,5-<i>g</i>]isoquino[3,2-<i>a</i>]isoquinolin-8-one","Acta Crystallographica Section E","2003","59","7","o919","o921","10.1107/S1600536803012327","","","0.71073","MoKα","","0.0649","0.0525","","","0.1079","0.1131","","","","","","1.116","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202264","22.451","0.003","8.3709","0.0013","14.921","0.002","90","","118.531","0.003","90","","2463.6","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N-phenyl-o-methoxybenzohydroxamic acid","","- C14 H13 N O3 -","- C14 H13 N O3 -","- C112 H104 N8 O24 -","8","1","AC6044","Elhadi Elbay Saad; Yang Farina; Bohari M. Yamin","<i>o</i>-Methoxy-<i>N</i>-phenylbenzohydroxamic acid","Acta Crystallographica Section E","2003","59","7","o1004","o1005","10.1107/S1600536803013564","","","0.71073","MoKα","","0.059","0.047","","","0.121","0.13","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202265","13.1579","0.0004","14.2791","0.0005","15.721","0.0005","90","","90","","90","","2953.71","0.17","91","2","91","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","Bis-chloro-{(N-2,6-diisopropylphenyl)-[(bis-2-pyridlymethyl)amino]- ethanamido}-iron(II) acetonitrile solvate","","","- C29 H37 Cl2 Fe N5 O -","- C29 H37 Cl2 Fe N5 O -","- C116 H148 Cl8 Fe4 N20 O4 -","4","1","AC6045","Marilyn M. Olmstead; Christina Troeltzsch; Timothy E. Patten","Dichloro{<i>N</i>-(2,6-diisopropylphenyl)-2-[(di-2-pyridylmethyl)amino]ethanamido}iron(II) acetonitrile solvate","Acta Crystallographica Section E","2003","59","7","m502","m503","10.1107/S160053680301345X","","","0.71073","MoKα","","0.033","0.0289","","","0.0733","0.0752","","","","","","1.068","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202266","12.167","0.005","15.961","0.005","19.293","0.005","81.75","0.005","76.04","0.005","76.84","0.005","3525","2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H50.25 Cl2 N7 O0.625 -","- C36 H50.25 Cl2 N7 O0.625 -","- C144 H201 Cl8 N28 O2.5 -","4","2","AC6046","Roblou, Emmanuel; Aït-Haddou, Hassan; Sasaki, Isabelle; Daran, Jean-Claude","2,6-Bis(5,6-dicyclohexyl-1,2,4-triazin-3-yl)pyridine‒dichloromethane‒water (1/1/0.625)","Acta Crystallographica Section E","2003","59","8","o1175","o1177","10.1107/S1600536803015745","","","0.71069","MoKα","","0.1126","0.0576","","","0.1331","0.1552","","","","","","0.887","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202267","9.853","0.003","9.882","0.003","37.944","0.011","83.845","0.006","88.531","0.006","89.856","0.005","3672","1.9","168","2","168","2","","","","","","","","3","P -1","-P 1","2","","","","- C12 H11 N -","- C12 H11 N -","- C192 H176 N16 -","16","8","AC6047","Mark A. Rodriguez; Scott D. Bunge","Diphenylamine","Acta Crystallographica Section E","2003","59","8","o1123","o1125","10.1107/S1600536803014788","","","0.71073","MoKα","","0.1077","0.0494","","","0.0944","0.1146","","","","","","0.97","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202268","8.617","0.001","7.8765","0.0009","23.103","0.003","90","","98","0.01","90","","1552.8","0.3","293","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H34 Cu N4 O12 -","- C26 H34 Cu N4 O12 -","- C52 H68 Cu2 N8 O24 -","2","0.5","AC6048","Reinoso, Santiago; Vitoria, Pablo; San Felices, Leire; Lezama, Luis; Gutiérrez-Zorrilla, Juan M.","Bis(di-2-pyridylmethanediol-κ^3^<i>N,O,N</i>')copper(II) diacetate tetrahydrate","Acta Crystallographica Section E","2003","59","7","m548","m550","10.1107/S1600536803014399","","","0.71073","MoKα","","0.0885","0.049","","","0.1035","0.115","","","","","","0.955","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202269","11.5388","0.0009","5.833","0.0004","12.4477","0.0009","90","","91.4537","0.0014","90","","837.53","0.11","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H10 Co O8 -","- C4 H10 Co O8 -","- C16 H40 Co4 O32 -","4","1","AC6049","Carballo, Rosa; Castiñeiras, Alfonso; Covelo, Berta; García-Martínez, Emilia; Vázquez-López, Ezequiel M.","(<i>OC</i>-6-32)-Diaquabis(glycolato)cobalt(II)","Acta Crystallographica Section E","2003","59","8","m588","m590","10.1107/S1600536803015083","","","0.71073","MoKα","","0.0335","0.0235","","","0.0505","0.0525","","","","","","0.944","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2202270","12.2603","0.0012","16.4739","0.0013","11.6085","0.0006","90","","90","","90","","2344.6","0.3","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","1,3,5-tris(4-fluorobensenesulfonyl)-1,3,5-triazacyclohexane","","- C21 H18 F3 N3 O6 S3 -","- C21 H18 F3 N3 O6 S3 -","- C84 H72 F12 N12 O24 S12 -","4","0.5","AC6050","Gilardi, Richard; Evans, Robin N.; Duddu, Raja","1,3,5-Tris(4-fluorobenzenesulfonyl)-1,3,5-triazacyclohexane","Acta Crystallographica Section E","2003","59","8","o1187","o1188","10.1107/S1600536803015228","","","0.71073","MoKα","","0.0489","0.0367","","","0.0896","0.096","","","","","","1.062","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202271","23.3022","0.0003","10.2248","0.0002","15.0785","0.0003","90","","122.273","0.001","90","","3037.6","0.1","120","2","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C16 H20 O5 -","- C16 H20 O5 -","- C128 H160 O40 -","8","1","AC6051","Silva, M.; Napolitano, H. B.; Ellena, J.; Rocha, W. C.; Vieira, P. C.; Oliva, G.; Thiemann, O. H.","3-(5,7-Dimethoxy-2,2-dimethyl-2<i>H</i>-benzo[<i>b</i>]pyran-6-yl)propionic acid: a potential inhibitor against Leishmania","Acta Crystallographica Section E","2003","59","10","o1575","o1577","10.1107/S160053680302107X","","","0.71073","MoKα","","","0.0327","","","","0.0903","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202272","7.3145","0.0005","10.2252","0.0006","21.7212","0.0014","80.233","0.002","89.126","0.002","82.418","0.002","1586.99","0.18","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","(N,N'-bis(2-pyridylmethyl)oxamide)palladium(II) hydrate chloroform hemisolvate","","- C14.5 H14.5 Cl1.5 N4 O3 Pd -","- C14.5 H14.5 Cl1.5 N4 O3 Pd -","- C58 H58 Cl6 N16 O12 Pd4 -","4","2","AC6053","Reger, Daniel L.; Smith, Delia M. Ciurtin; Shimizu, Ken D.; Smith, Mark D.","[<i>N,N</i>'-Bis(2-pyridylmethyl)oxamidato]palladium(II) monohydrate chloroform hemisolvate","Acta Crystallographica Section E","2003","59","8","m652","m654","10.1107/S160053680301609X","","","0.71073","MoKα","","0.0258","0.0242","","","0.0612","0.0623","","","","","","1.063","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2202273","7.2429","0.0001","10.4418","0.0002","15.4618","0.0003","90","","94.353","0.001","90","","1165.99","0.04","120","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H13 N O4 -","- C14 H13 N O4 -","- C56 H52 N4 O16 -","4","1","AC6054","Napolitano, H. B.; Silva, M.; Ellena, J.; Rocha, W. C.; Vieira, P. C.; Thiemann, O. H.; Oliva, G.","Redetermination of skimmianine: a new inhibitor against the Leishmania APRT enzyme","Acta Crystallographica Section E","2003","59","10","o1503","o1505","10.1107/S1600536803019913","","","0.71073","MoKα","","","0.0376","","","","0.1043","","","","","","1.043","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202274","16.9357","0.0005","4.3669","0.0001","16.2558","0.0004","90","","117.218","0.001","90","","1069.1","0.05","120","2","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C13 H10 O5 -","- C13 H10 O5 -","- C52 H40 O20 -","4","1","AC6055","Napolitano, H. B.; Silva, M.; Ellena, J.; Rocha, W. C.; Vieira, P. C.; Thiemann, O. H.; Oliva, G.","Redetermination and comparative structural study of isopimpinellin: a new inhibitor against the Leishmania APRT enzyme","Acta Crystallographica Section E","2003","59","10","o1506","o1508","10.1107/S1600536803019925","","","0.71073","MoKα","","","0.0441","","","","0.1236","","","","","","1.044","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202275","5.8977","0.0007","10.1767","0.0016","16.941","0.002","90","","94.394","0.01","90","","1013.8","0.2","173.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","(S)-2-Hydroxy-3-methylbutanoyl-L-alanyl-L-proline benzyl ester","","- C20 H28 N2 O5 -","- C20 H28 N2 O5 -","- C40 H56 N4 O10 -","2","1","AC6056","Oku, Hiroyuki; Shichiri, Kazuaki; Yamada, Keiichi; Katakai, Ryoichi","A peptide sequence containing a hydroxy acid residue: (<i>S</i>)-2-hydroxy-3-methylbutanoyl-<small>L</small>-alanyl-<small>L</small>-proline benzyl ester (H‒<small>L</small>-Hmb‒<small>L</small>-Ala‒<small>L</small>-Pro‒OBzl)","Acta Crystallographica Section E","2003","59","9","o1413","o1415","10.1107/S1600536803018701","","","1.5418","CuKα","","","0.079","","","","0.067","","","","","","1.008","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202276","8.521","0.001","5.1143","0.0006","12.401","0.002","90","","99.098","0.002","90","","533.62","0.12","120","0.2","120","0.2","","","","","","","","4","P 1 21 1","P 2yb","4","bthr","L-β-threonine lactone analogue","","- C12 H13 N O3 -","- C12 H13 N O3 -","- C24 H26 N2 O6 -","2","1","AC6057","Mitsunobu Doi; Akiko Asano","4(<i>R</i>)-(<i>N</i>-Benzoylamino)-5(<i>R</i>)-methyltetrahydrofuran-2-one: an <small>L</small>-β-threonine analogue","Acta Crystallographica Section E","2003","59","10","o1486","o1487","10.1107/S1600536803019883","","","0.71073","MoKα","","0.0451","0.0434","","","0.1156","0.1175","","","","","","1.121","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202277","20.915","0.002","10.3733","0.0009","11.4042","0.0013","90","","113.236","0.005","90","","2273.5","0.4","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[VCl2(thf)2(tBuNCH2CH2NtBu)]","Dichlorobis(tetrahydrofuran)N,N'-di-tert-buthylethane-1,2-diaminevanadium(II)","","- C18 H38 Cl2 N2 O2 V -","- C18 H38 Cl2 N2 O2 V -","- C72 H152 Cl8 N8 O8 V4 -","4","0.5","AC6058","Niedwieski, Antonio Carlos; Leigh, G. Jeffery; Hasegawa, Tai; Nunes, Fábio Souza","Dichlorobis(tetrahydrofuran)(<i>N,N</i>'-di-<i>tert</i>-butylethane-1,2-diamine)vanadium(II)","Acta Crystallographica Section E","2003","59","10","m939","m941","10.1107/S1600536803019743","","","0.71073","MoKα","","0.0728","0.0532","","","0.1266","0.1366","","","","","","1.066","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202278","7.0717","0.0009","8.6326","0.0011","8.8223","0.0012","100.699","0.007","112.489","0.009","104.78","0.006","456.33","0.11","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H20 Co N4 O6 -","- C18 H20 Co N4 O6 -","- C18 H20 Co N4 O6 -","1","0.5","AC6059","Yu-Hong Xue; Yu Liu; Duan-Jun Xu","<i>catena</i>-Poly[[diaquabis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)cobalt(II)]-μ-succinato-κ<i>O</i>]","Acta Crystallographica Section E","2003","59","10","m944","m946","10.1107/S1600536803019901","","","0.71069","MoKα","","0.03","0.027","","","0.065","0.067","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202279","10.6841","0.0007","31.649","0.002","10.5758","0.0007","90","","105.222","0.001","90","","3450.6","0.4","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","μ-OH [Re(dmbpy)(CO)~3~]~2~ ReO~4~ acetone solvate","μ-Hydroxo bis-[Tricarbonyl(4,4'-dimethyl-2,2'-bipyridine) rhenium(I)] perrhenate acetone solvate","","- C31.5 H28 N4 O11.5 Re3 -","- C31.5 H25 N4 O11.5 Re3 -","- C126 H100 N16 O46 Re12 -","4","1","AC6060","Gibson, Dorothy H.; Mashuta, Mark S.; Yin, Xiaolong","μ-Hydroxo-bis[(4,4'-dimethyl-2,2'-bipyridine)tricarbonylrhenium(I)] perrhenate acetone hemisolvate","Acta Crystallographica Section E","2003","59","10","m911","m913","10.1107/S1600536803020105","","","0.71073","MoKα","","0.032","0.027","","","0.074","0.076","","","","","","1.07","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2202280","16.103","0.003","10.8827","0.0019","27.396","0.005","90","","90","","90","","4801","1.5","150","2","150","2","","","","","","","","3","P n a 21","P 2c -2n","33","2,4,6-Trimethyl-1,3,5-tris(phenoxymethyl)benzene","2,4,6-Trimethyl-1,3,5-tris(phenoxymethyl)benzene","","- C30 H30 O3 -","- C30 H30 O3 -","- C240 H240 O24 -","8","2","AC6061","David J. Bray; Leonard F. Lindoy; John C. McMurtrie","2,4,6-Trimethyl-1,3,5-tris(phenoxymethyl)benzene","Acta Crystallographica Section E","2003","59","10","o1544","o1545","10.1107/S1600536803020610","","","0.71073","MoKα","","0.0398","0.0345","","","0.0899","0.0935","","","","","","1.032","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202281","9.508","0.003","18.747","0.006","10.116","0.003","90","","105.085","0.005","90","","1741","0.9","183","2","183","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2,6-Bis(3,5-dimethylpyrazol-1-ylmethyl)-4-methylphenol","2,6-Bis(3,5-dimethylpyrazol-1-ylmethyl)-4-methylphenol","","- C19 H24 N4 O -","- C19 H24 N4 O -","- C76 H96 N16 O4 -","4","1","AC6062","Yin, Caixia; Huo, Fangjun; Gao, Fei; Guo, Jianping; Yang, Pin","2,6-Bis(3,5-dimethylpyrazol-1-ylmethyl)-4-methylphenol","Acta Crystallographica Section E","2003","59","11","o1740","o1741","10.1107/S1600536803022979","","","0.71073","MoKα","","0.1496","0.0779","","","0.1192","0.1417","","","","","","0.978","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202282","8.764","0.003","12.872","0.004","14.284","0.005","94.49","0.006","96.563","0.006","108.739","0.005","1504.6","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3,10-Bis(2,6-dichlorophenyl)-4,11-diphenyl-1,8-dioxa-2,9- diazadispiro[4.1.4.3]tetradeca-2,9-dien-6-one","","- C34 H24 Cl4 N2 O3 -","- C34 H24 Cl4 N2 O3 -","- C68 H48 Cl8 N4 O6 -","2","1","AC6063","Li, Xiao-Fang; Feng, Ya-Qing; Gao, Bo; Li, Nan","3,10-Bis(2,6-dichlorophenyl)-4,11-diphenyl-1,8-dioxa-2,9-diazadispiro[4.1.4.3]tetradeca-2,9-dien-6-one","Acta Crystallographica Section E","2003","59","11","o1638","o1639","10.1107/S1600536803020890","","","0.71073","MoKα","","0.0666","0.0411","","","","0.1079","","","","","","1.029","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202283","14.464","0.003","13.377","0.003","17.08","0.004","90","","114.954","0.004","90","","2996.2","1.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3,10-Bis(2,6-dichlorophenyl)-4,11-diphenyl-1,8-dioxa-2,9- diazadispiro[4.1.4.2]trideca-2,9-dien-6-one","","- C33 H22 Cl4 N2 O3 -","- C33 H22 Cl4 N2 O3 -","- C132 H88 Cl16 N8 O12 -","4","1","AC6064","Li, Xiao-Fang; Feng, Ya-Qing; Gao, Bo; Li, Nan","3,10-Bis(2,6-dichlorophenyl)-4,11-diphenyl-1,8-dioxa-2,9-diazadispiro[4.1.4.2]trideca-2,9-dien-6-one","Acta Crystallographica Section E","2003","59","11","o1640","o1641","10.1107/S1600536803020907","","","0.71073","MoKα","","0.0863","0.0479","","","","0.1077","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202284","10.6882","0.0007","11.3911","0.0007","12.9037","0.0008","90.908","0.002","114.075","0.002","112.741","0.002","1294.46","0.15","193","2","193","2","","","","","","","","6","P -1","-P 1","2","Bis[μ-1,3-bis(diphenylphosphino)propane]disilver bis(tetrafluoroborate)","Bis[μ-1,3-bis(diphenylphosphino)propane]disilver bis(tetrafluoroborate)","","- C54 H52 Ag2 B2 F8 P4 -","- C54 H52 Ag2 B2 F8 P4 -","- C54 H52 Ag2 B2 F8 P4 -","1","0.5","AC6065","Smith, Michele L.; Almond, Philip M.; Albrecht-Schmitt, Thomas E.; Hill, William E.","Bis[μ-1,3-bis(diphenylphosphino)propane]disilver(I) bis(tetrafluoroborate)","Acta Crystallographica Section E","2003","59","11","m1013","m1014","10.1107/S1600536803022554","","","0.71073","MoKα","","0.0437","0.0403","","","0.1154","0.1187","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202285","12.4768","0.0004","14.1024","0.0004","22.1653","0.0007","90","","90","","90","","3900","0.2","180","2","180","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Sodium-Monensin","Sodium monensin dihydrate","","- C36 H65 Na O13 -","- C36 H65 Na O13 -","- C144 H260 Na4 O52 -","4","1","AC6066","Almeida Paz, Filipe A.; Gates, Paul J.; Fowler, Stan; Gallimore, Andrew; Harvey, Barbara; Lopes, Norberto P.; Stark, Christian B. W.; Staunton, James; Klinowski, Jacek; Spencer, Jonathan B.","Sodium monensin dihydrate","Acta Crystallographica Section E","2003","59","11","m1050","m1052","10.1107/S1600536803022980","","","0.71073","MoKα","","0.0766","0.0624","","","0.1588","0.1678","","","","","","1.12","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202286","10.912","0.005","13.116","0.005","9.856","0.004","102.81","0.03","107.19","0.03","96.88","0.04","1287.8","1","295","","295","","","","","","","","","5","P -1","-P 1","2","","μ-bis(diphenylphosphino)methane-κ^2^P:P'-bis[chlorogold(I)]","","- C25 H22 Au2 Cl2 P2 -","- C25 H22 Au2 Cl2 P2 -","- C50 H44 Au4 Cl4 P4 -","2","1","AC6069","Peter C. Healy","A new polymorph of μ-bis(diphenylphosphino)methane-κ^2^<i>P</i>:<i>P</i>'-bis[chlorogold(I)]","Acta Crystallographica Section E","2003","59","12","m1112","m1114","10.1107/S1600536803025364","","","0.7107","MoKα","","0.0492","0.0342","","","0.0899","0.096","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202287","6.6451","0.0001","7.5873","0.0002","14.1809","0.0003","90","","90","","90","","714.98","0.03","293","2","293","2","","","","","","","","4","P n 21 a","P -2ac -2n","33","","Tridadolinium niobium trisulfide tetraoxide","","- Gd3 Nb O4 S3 -","- Gd3 Nb O4 S3 -","- Gd12 Nb4 O16 S12 -","4","1","BR6101","Kabbour, Houria; Cario, Laurent; Deudon, Catherine; Meerschaut, Alain","A gadolinium and niobium oxide sulfide, Gd~3~NbS~3~O~4~","Acta Crystallographica Section E","2003","59","7","i101","i102","10.1107/S1600536803013035","","","0.71069","MoKα","","0.0368","0.0297","","","0.0581","0.0606","","","","","","1.051","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202288","19.2856","0.0001","19.2856","","7.98049","0.00003","90","","90","","120","","2570.55","0.016","293","1","","","","","","","","","","3","R 3 c :H","R 3 -2""c","161","","","","- Ge3 Pr4 S12 -","- Ge3 Pr4 S12 -","- Ge18 Pr24 S72 -","6","0.333333","BR6102","Helmholdt, Robert B.; Goubitz, Kees; Sonneveld, Ed J.; Schenk, Henk","Pr~4~Ge~3~S~12~: structure determination from high-resolution powder diffraction data","Acta Crystallographica Section E","2003","59","8","i119","i121","10.1107/S1600536803015162","","","0.65296","synchrotron","","","","","","","","","","","","","3.5","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2202289","13.4802","0.0009","6.6846","0.0004","18.216","0.001","90","","101.977","0.007","90","","1605.71","0.17","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","yttrium(III) sulfate octahydrate","yttrium(III) sulfate octahydrate","","- H16 O20 S3 Y2 -","- H16 O20 S3 Y2 -","- H64 O80 S12 Y8 -","4","0.5","BR6103","Held, Peter; Wickleder, Mathias","Yttrium(III) sulfate octahydrate","Acta Crystallographica Section E","2003","59","7","i98","i100","10.1107/S1600536803012182","","","0.71073","MoKα","","0.0935","0.0396","","","0.077","0.0951","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202290","8.0183","0.0007","11.272","0.001","23.961","0.002","90","","90","","90","","2165.7","0.3","298","2","298","2","","","","","","","","2","F d d d :2","-F 2uv 2vw","70","","","","- Se3 Yb2 -","- Se3 Yb2 -","- Se48 Yb32 -","16","0.5","","Assoud, Abdeljalil; Kleinke, Holger","The sesquiselenide Yb~2~Se~3~","Acta Crystallographica, Section E","2003","59","","i103","i104","10.1107/S1600536803013242","","","","","","","","","","","","","","","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202291","3.449","0.0002","6.3603","0.0005","9.9502","0.0008","105.441","0.008","90.807","0.006","91.933","0.006","210.22","0.03","293","2","293","2","","","","","","","","3","P -1","-P 1","2","Cadmium pyroborate","Cadmium diborate","","- B2 Cd2 O5 -","- B2 Cd2 O5 -","- B4 Cd4 O10 -","2","1","BR6105","Weil, Matthias","Re-investigation of Cd~2~B~2~O~5~: evidence of a centre of symmetry","Acta Crystallographica Section E","2003","59","7","i95","i97","10.1107/S1600536803012157","","","0.71073","MoKα","","0.0229","0.0215","","","0.0552","0.0558","","","","","","1.125","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202292","10.1659","0.0007","10.1659","0.0007","13.1601","0.0009","90","","90","","120","","1177.83","0.14","180","2","180","2","","","","","","","","4","P 32 2 1","P 32 2""","154","","Hydronium pentaaquacopper(II) triperchlorate","","- Cl3 Cu H13 O18 -","- Cl3 Cu H10 O18 -","- Cl9 Cu3 H30 O54 -","3","0.5","BR6106","Bramsen, Fabienne; Bond, Andrew D.; McKenzie, Christine J.","Hydronium pentaaquacopper(II) triperchlorate","Acta Crystallographica Section E","2003","59","7","i105","i106","10.1107/S1600536803014272","","","0.7107","MoKα","","0.0589","0.0451","","","0.1038","0.1114","","","","","","1.039","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202293","3.3572","0.0005","3.3572","0.0005","12.912","0.003","90","","90","","120","","126.03","0.04","150","2","150","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Li0.7 Nb S2 -","- Li0.7 Nb S2 -","- Li1.4 Nb2 S4 -","2","0.0833333","BR6107","Salyer, Pamela A.; Barker, Marten G.; Gregory, Duncan H.; Jones, Martin O.; Wilson, Claire","Li~0.7~NbS~2~: structural effects of increased alkali metal content","Acta Crystallographica Section E","2003","59","8","i112","i115","10.1107/S1600536803014855","","","0.71073","MoKα","","0.017","0.0158","","","0.0466","0.0474","","","","","","1.584","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2202294","12.6563","0.0009","13.26","0.001","18.491","0.002","72.576","0.003","70.078","0.003","62.848","0.003","2557.3","0.4","296.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- Ge H41.5 Na8.5 O54 W9 -","- Ge Na8.5 O53.4 W9 -","- Ge2 Na17 O106.8 W18 -","2","1","BR6108","Xiaoou Cao; Haruo Naruke; Toshihiro Yamase","Na~8.5~H~1.5~[GeW~9~O~34~]·20H~2~O containing trivacant A-α- and A-β-Keggin anions","Acta Crystallographica Section E","2003","59","8","i116","i118","10.1107/S1600536803015344","","","0.7107","MoKα","","","0.0762","","","","0.1631","","","","","","1.559","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2202295","8.62","0.001","10.387","0.001","11.017","0.002","69.22","0.01","87.14","0.01","66.12","0.01","838.2","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- H20 K4 Na2 O38 V10 -","- H20 K4 Na2 O38 V10 -","- H20 K4 Na2 O38 V10 -","1","0.5","BR6109","Lee, Uk; Joo, Hea-Chung","Potassium‒sodium double salt of decavanadate, K~4~Na~2~[V~10~O~28~]·10H~2~O","Acta Crystallographica Section E","2003","59","8","i122","i124","10.1107/S1600536803016453","","","0.71069","MoKα","","0.0407","0.0336","","","0.0874","0.0937","","","","","","1.109","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202296","7.6887","0.0003","7.6887","0.0003","28.87","0.001","90","","90","","120","","1478","0.2","293","","293","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","","- F12 K2 O Zr3 -","- F12 K2 O Zr3 -","- F72 K12 O6 Zr18 -","6","0.166667","","Mohamed Ali Saada; Annie Hemon-Ribaud; Vincent Maisonneuve; Leila Samia Smiri; Marc Leblanc","K~2~Zr~3~OF~12~: microwave-assisted hydrothermal synthesis and powder diffraction study","Acta Crystallographica, Section E","2003","59","","i131","i133","10.1107/S1600536803018567","","","","","","","","","","","","","","","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202297","12.274","0.002","13.169","0.003","9.754","0.002","90","","108.64","0.03","90","","1493.9","0.6","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","ferrous iron hydroxide phosphate, mineral name: wolfeite","diiron(II) hydroxide phosphate","","- Fe1.84 H Mg0.16 O5 P -","- Fe1.83918 H Mg0.160825 O5 P -","- Fe29.4268 H16 Mg2.5732 O80 P16 -","16","4","BR6111","Kolitsch, Uwe","Mg-rich wolfeite, (Fe^II^,Mg)~2~(PO~4~)(OH): structure refinement and Raman spectroscopic data","Acta Crystallographica Section E","2003","59","9","i125","i128","10.1107/S1600536803017537","","","0.71073","MoKα","","0.0326","0.0215","","","0.0608","0.0653","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202298","7.311","0.002","13.321","0.002","12.862","0.002","90","","94.45","0.02","90","","1248.9","0.4","296","2","296","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","Dipotassium di-μ-hydroxo-bis[(nitrilotriacetato-κ^4^N,O,O',O'')chromium(III)] hexahydrate","","- C12 H26 Cr2 K2 N2 O20 -","- C12 H26 Cr2 K2 N2 O20 -","- C24 H52 Cr4 K4 N4 O40 -","2","0.25","BR6112","Choi, Jong-Ha; Suzuki, Takayoshi; Kaizaki, Sumio","Dipotassium di-μ-hydroxo-bis[(nitrilotriacetato-κ^4^<i>N,O,O</i>',<i>O</i>'')chromium(III)] hexahydrate","Acta Crystallographica Section E","2003","59","9","m812","m813","10.1107/S160053680301883X","","","0.71069","MoKα","","0.0973","0.0559","","","0.1557","0.1789","","","","","","1.043","","","","has coordinates,has Fobs","194538","2020-10-21","18:00:00",""
"2202299","6.6418","0.0004","9.9428","0.0006","14.0575","0.0008","90","","90","","90","","928.33","0.1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","dabconium phosphite","4-Aza-1-azoniabicyclo[2.2.2]octane dihydrogenphosphite","","- C6 H15 N2 O3 P -","- C6 H15 N2 O3 P -","- C24 H60 N8 O12 P4 -","4","1","BR6113","Harrison, William T. A.","4-Aza-1-azoniabicyclo[2.2.2]octane dihydrogenphosphite","Acta Crystallographica Section E","2003","59","9","o1351","o1353","10.1107/S1600536803018130","","","0.71073","MoKα","","0.0441","0.0366","","","0.0942","0.0979","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202300","6.7019","0.0001","11.9573","0.0002","18.0923","0.0004","90","","90","","90","","1449.86","0.05","120","2","120","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C6 H22 Cl4 N2 Ni O4 -","- C6 H22 Cl4 N2 Ni O4 -","- C24 H88 Cl16 N8 Ni4 O16 -","4","1","BR6114","Bremner, Colin A.; Harrison, William T. A.","1,4-Diazoniabicyclo[2.2.2]octane triaquatrichloronickelate(II) chloride monohydrate","Acta Crystallographica Section E","2003","59","9","m797","m799","10.1107/S1600536803018555","","","0.71073","MoKα","","0.0275","0.0267","","","0.074","0.0745","","","","","","1.149","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202301","7.1225","0.0012","7.2333","0.0008","8.7082","0.0013","91.557","0.011","102.518","0.017","112.627","0.011","401.21","0.11","295","2","295","2","","","","","","","","5","P -1","-P 1","2","[2,6-DAPyH]Br.H2O","2,6-Diaminopyridinium Bromide Hydrate","","- C5 H10 Br N3 O -","- C5 H10 Br N3 O -","- C10 H20 Br2 N6 O2 -","2","1","BR6115","Haddad, Salim F.; Al-Far, Rawhi H.","2,6-Diaminopyridinium bromide monohydrate","Acta Crystallographica Section E","2003","59","10","o1444","o1446","10.1107/S1600536803019111","","","0.71073","MoKα","","0.0415","0.0376","","","0.0963","0.0996","","","","","","1.089","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202302","14.782","0.003","5.6774","0.0011","8.7653","0.0018","90","","90","","90","","735.6","0.3","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","ammonium iron molybdate","","- Fe H4 Mo2 N O8 -","- Fe H4 Mo2 N O8 -","- Fe4 H16 Mo8 N4 O32 -","4","0.5","BR6116","Wu, Xiaoyuan; Zhang, Hanhui; Huang, Changcang; Huang, Xihe; Sun, Qiaozhen; Lin, Zhihua","Ammonium iron(III) molybdate","Acta Crystallographica Section E","2003","59","10","i134","i136","10.1107/S1600536803019597","","","0.71069","MoKα","","0.0236","0.0209","","","0.0537","0.0553","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202303","5.6038","0.0004","10.2066","0.0007","12.2719","0.0008","85.549","0.001","88.404","0.001","89.026","0.001","699.43","0.08","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","μ-1,3-benzenedicarboxylato-μ-ethylenediamine-zinc(II) trihydrate","","- C10 H18 N2 O7 Zn -","- C10 H18 N2 O7 Zn -","- C20 H36 N4 O14 Zn2 -","2","1","BR6117","Jiang, Ya-Qi; Xie, Zhao-Xiong; Ng, Seik Weng","A two-dimensional coordination polymer, μ-1,3-benzenedicarboxylato-μ-ethylenediaminezinc(II) trihydrate","Acta Crystallographica Section E","2003","59","10","m947","m949","10.1107/S1600536803020579","","","0.71073","MoKα","","0.034","0.03","","","0.067","0.068","","","","","","0.917","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202304","9.6444","0.0019","12.678","0.002","18.097","0.002","90","","95.57","0.016","90","","2202.3","0.6","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4,4'-bipyridinium(2+) di-μ-iodo-bis[(4,4'-bipyridyl)triiodoantimony(III)]","","- C30 H26 I8 N6 Sb2 -","- C30 H26 I8 N6 Sb2 -","- C60 H52 I16 N12 Sb4 -","2","0.5","BR6118","Jonathan P. H. Charmant; Nicholas C. Norman; A. Guy Orpen; Jonathan Starbuck","4,4'-Bipyridyl adduct of an iodoantimonate anion linked by a 4,4'-bipyridinium cation","Acta Crystallographica Section E","2003","59","11","m997","m999","10.1107/S1600536803022347","","","0.71073","MoKα","","0.0859","0.0408","","","0.0667","0.0787","","","","","","0.965","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202305","9.6366","0.0002","12.7506","0.0001","18.1728","0.0003","90","","95.013","0.001","90","","2224.39","0.06","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4,4'-bipyridinium(2+) di-μ-iodo-bis[(4,4'-bipyridyl)triiodobismuth(III)]","","- C30 H26 Bi2 I8 N6 -","- C30 H26 Bi2 I8 N6 -","- C60 H52 Bi4 I16 N12 -","2","0.5","BR6119","Jonathan P. H. Charmant; Nicholas C. Norman; A. Guy Orpen; Jonathan Starbuck","4,4'-Bipyridyl adduct of an iodobismuthate anion linked by a 4,4'-bipyridinium cation","Acta Crystallographica Section E","2003","59","11","m1000","m1001","10.1107/S1600536803022359","","","0.71073","MoKα","","0.0935","0.0718","","","0.2002","0.2122","","","","","","1.037","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202306","10.376","0.0006","10.376","0.0006","22.021","0.0012","90","","90","","120","","2053.2","0.2","150","","150","","","","","","","","","6","R -3 :H","-R 3","148","","hexakisdimethylsulfoxidealuminium(III) trichloride","","- C12 H36 Al Cl3 O6 S6 -","- C12 H36 Al Cl3 O6 S6 -","- C36 H108 Al3 Cl9 O18 S18 -","3","0.166667","BR6120","Dan Boström; Maria Clausén; Malin Sandström","Hexakis(dimethyl sulfoxide-κ<i>O</i>)aluminium(III) trichloride","Acta Crystallographica Section E","2003","59","10","m934","m935","10.1107/S1600536803020464","","","0.71073","MoKα","","0.027","0.0256","","","0.0668","0.0678","","","","","","1.109","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2202307","5.764","0.0003","8.7418","0.0009","6.3629","0.0003","90","","90","","90","","320.61","0.04","297","","297","","","","","","","","","4","C m c m","-C 2c 2","63","","","","- Li Mn O4 V -","- Li Mn O4 V -","- Li4 Mn4 O16 V4 -","4","0.25","","Masahiko Sugahara; Akira Yoshiasa; Takamitu Yamanaka; Humihiko Takei","LiMnVO~4~","Acta Crystallographica, Section E","2003","59","","i161","i163","10.1107/S1600536803023742","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2202308","11.161","0.0005","8.305","0.0011","15.818","0.0008","90","","90","","90","","1466.2","0.2","150","","150","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- H2 Na O13 Rb3 V4 -","- H2 Na O13 Rb3 V4 -","- H8 Na4 O52 Rb12 V16 -","4","0.5","BR6122","Dan Boström; Gustaf Bergquist; Lage Pettersson","Sodium trirubidium metavanadate monohydrate","Acta Crystallographica Section E","2003","59","11","i151","i153","10.1107/S1600536803024024","","","0.71073","MoKα","","0.0377","0.0344","","","0.0759","0.0773","","","","","","1.139","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202309","13.3019","0.001","18.6809","0.0015","16.5245","0.0015","90","","90","","90","","4106.2","0.6","180","2","180","2","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- C6 H8 Ag I2 N -","- C6 H8 Ag I2 N -","- C96 H128 Ag16 I32 N16 -","16","","BR6123","Alcock, Nathaniel W.; Archibald, Stephen J.; Busch, Daryle H","A silver‒iodine chain complex: <i>catena</i>-poly[anilinium [silver(I)-di-μ-iodo]], {[PhNH~3~][AgI~2~]}~<i>n~</i>","Acta Crystallographica Section E","2003","59","12","m1110","m1111","10.1107/S1600536803024966","","","0.71073","MoKα","","0.0375","0.0286","","","0.0661","0.0697","","","","","","0.98","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2202310","17.2502","0.0009","24.4253","0.0013","11.3154","0.0006","90","","90","","90","","4767.6","0.4","294","2","294","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C52 H40 O4 P2 Ru2 S2 -","- C52 H40 O4 P2 Ru2 S2 -","- C208 H160 O16 P8 Ru8 S8 -","4","0.5","BR6125","Shiu, Kom-Bei; Liao, Fen-Ling; Wang, Sue-Lein","<i>syn</i>-Tetracarbonyldi-μ-phenylthiolato-bis[(triphenylphosphine)ruthenium(I)]","Acta Crystallographica Section E","2003","59","12","m1187","m1188","10.1107/S1600536803026874","","","0.71073","MoKα","","0.134","0.0493","","","0.0573","0.0694","","","","","","0.875","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202311","12.402","0.0012","10.9759","0.0011","14.2847","0.0014","90","","107.323","0.002","90","","1856.3","0.3","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","trans-Diaquatetrakis(imidazole)nickel(II) dichloride","","- C12 H20 Cl2 N8 Ni O2 -","- C12 H20 Cl2 N8 Ni O2 -","- C48 H80 Cl8 N32 Ni4 O8 -","4","0.5","BR6126","Shiu, Kom-Bei; Yen, Chia-Hung; Liao, Fen-Ling; Wang, Sue-Lein","<i>trans</i>-Diaquatetrakis(imidazole)nickel(II) dichloride","Acta Crystallographica Section E","2003","59","12","m1189","m1191","10.1107/S1600536803026886","","","0.71073","MoKα","","0.0364","0.0267","","","0.0604","0.0626","","","","","","1.023","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2202312","11.887","0.002","9.671","0.002","19.493","0.004","90","","90","","90","","2240.9","0.8","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","cesium trichromate","","","- Cr3 Cs2 O10 -","- Cr3 Cs2 O10 -","- Cr24 Cs16 O80 -","8","1","","Kolitsch, Uwe","α-Cs~2~Cr~3~O~10~","Acta Crystallographica, Section E","2003","59","","i164","i166","10.1107/S1600536803026473","","","","","","","","","","","","","","","","","","","","","has coordinates","277836","2022-09-14","17:02:02",""
"2202313","5.8652","0.0015","6.813","0.0018","9.794","0.002","86.14","0.03","86.68","0.03","85.26","0.03","388.6","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- Cl6 H18 In2 N6 -","- Cl6 H18 In2 N6 -","- Cl6 H18 In2 N6 -","1","0.5","BT6243","Bremm, Stephan; Meyer, Gerd","Triamminetrichloroindium(III), [InCl~3~(NH~3~)~3~]","Acta Crystallographica Section E","2003","59","8","i110","i111","10.1107/S1600536803013539","","","0.71073","MoKα","","0.0332","0.0282","","","0.0707","0.0727","","","","","","0.958","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202314","12.557","0.002","12.557","0.002","16.6","0.003","90","","90","","90","","2617.5","0.8","293","2","293","2","","","","","","","","6","P -4 21 c","P -4 2n","114","","zinc diisobutyldithiocarbamoylsulphinate","","- C18 H36 N2 O4 S4 Zn -","- C18 H36 N2 O4 S4 Zn -","- C72 H144 N8 O16 S16 Zn4 -","4","0.5","BT6269","Reck, Günter; Becker, Roland","(<i>N,N</i>-Diisobutyldithiocarbamoylsulfinato)zinc(II)","Acta Crystallographica Section E","2003","59","7","m489","m490","10.1107/S160053680301314X","","","0.71069","MoKα","","0.0342","0.0322","","","0.0915","0.0933","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202315","7.0012","0.0008","13.843","0.0012","11.1307","0.0011","90","","106.572","0.008","90","","1033.95","0.19","293","2","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(p-Fluorobenzylideneamino)-3-methyl-4,5-dihydro-1H-1,2,4-triazol-5-one","","- C10 H9 F N4 O -","- C10 H9 F N4 O -","- C40 H36 F4 N16 O4 -","4","1","BT6280","Şamil Işık; Kahveci, Bahittin; Erbil Ag̃ar; Selami Şaşmaz","4-(<i>p</i>-Fluorobenzylideneamino)-3-methyl-4,5-dihydro-1<i>H</i>-1,2,4-triazol-5-one","Acta Crystallographica Section E","2003","59","8","o1165","o1166","10.1107/S1600536803013047","","","0.71073","MoKα","","0.0614","0.0372","","","0.1017","0.1073","","","","","","0.894","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202316","26.8424","0.0016","7.8024","0.0006","14.8652","0.001","90","","104.708","0.003","90","","3011.3","0.4","143","2","143","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","7-Isopropylidenenorborna-2,5-diene-2,3,5,6-tetracarboxylic acid tetrakis(phenylamide)","","- C38 H32 N4 O4 -","- C38 H32 N4 O4 -","- C152 H128 N16 O16 -","4","0.5","BT6283","Winkler, Torsten; Herges, Rainer; Jones, Peter G.; Dix, Ina","A tetrakis(secondary amide) derivative of norbornadiene: 7-isopropylidene-<i>N,N</i>',<i>N</i>'',<i>N</i>'''-tetraphenylnorborna-2,5-diene-2,3,5,6-tetracarboxamide","Acta Crystallographica Section E","2003","59","7","o994","o996","10.1107/S1600536803011346","","","0.71073","MoKα","","0.0494","0.0427","","","0.1131","0.1187","","","","","","1.056","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202317","13.3354","0.0018","12.1987","0.0016","16.981","0.002","90","","104.454","0.004","90","","2674.9","0.6","143","2","143","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N',N'',N'''-3-isopropylidenetetracyclo[3.2.0.0^2,7^.0^4,5^]heptane- 1,5,6,7-tetracarboxamide","","- C26 H40 N4 O4 -","- C26 H40 N4 O4 -","- C104 H160 N16 O16 -","4","1","BT6284","Winkler, Torsten; Herges, Rainer; Jones, Peter G.; Dix, Ina","A tetrakis(secondary amide) derivative of quadricyclane: <i>N,N</i>',<i>N</i>'',<i>N</i>'''-tetraisopropyl-3-isopropylidenetetracyclo[3.2.0.0^2,7^.0^4,6^]heptane-1,5,6,7-tetracarboxamide","Acta Crystallographica Section E","2003","59","7","o997","o999","10.1107/S1600536803011358","","","0.71073","MoKα","","0.0535","0.0375","","","0.0954","0.1041","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202318","14.48","0.003","12.278","0.003","19.366","0.004","90","","107.41","0.03","90","","3285.3","1.4","140","1","140","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","1","(2-Dimethylaminoethyl)dimethylammonium dichlorotrimethyltin","","- C9 H26 Cl2 N2 Sn -","- C9 H26 Cl2 N2 Sn -","- C72 H208 Cl16 N16 Sn8 -","8","2","BT6286","Mark Schormann","(2-Dimethylaminoethyl)dimethylammonium dichlorotrimethylstannate(IV)","Acta Crystallographica Section E","2003","59","7","m500","m501","10.1107/S1600536803013205","","","0.71073","MoKα","","0.0453","0.0329","","","0.0812","0.0849","","","","","","1.026","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202319","7.7498","0.0001","10.8752","0.0001","13.4942","0.0002","76.776","0.001","81.112","0.001","78.449","0.001","1077.65","0.02","115","2","115","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H10 Ni2 O2 -","- C12 H10 Ni2 O2 -","- C48 H40 Ni8 O8 -","4","2","BT6287","Evans, Cameron; Farrugia, Louis","Low temperature redetermination of the structure of [Ni(CO)(η^5^-C~5~H~5~)]~2~","Acta Crystallographica Section E","2003","59","7","m510","m511","10.1107/S1600536803012984","","","0.71073","MoKα","","0.027","0.0245","","","0.0636","0.0646","","","","","","1.095","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202320","5.4651","0.0006","6.4044","0.0007","9.1145","0.0011","71.941","0.003","88.612","0.003","72.933","0.003","289.16","0.06","160","2","160","2","","","","","","","","3","P -1","-P 1","2","","","","- C10 H10 O10 -","- C10 H10 O10 -","- C10 H10 O10 -","1","0.5","BT6288","Dale, Sophie H.; Elsegood, Mark R. J.","Benzene-1,2,4,5-tetracarboxylic acid dihydrate at 160K","Acta Crystallographica Section E","2003","59","8","o1087","o1088","10.1107/S1600536803014351","","","0.71073","MoKα","","0.0378","0.0345","","","0.0946","0.0957","","","","","","1.064","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202321","10.1995","0.0014","11.6467","0.0016","15.206","0.002","87.126","0.003","77.132","0.003","81.3","0.003","1740.4","0.4","143","2","143","2","","","","","","","","4","P -1","-P 1","2","","3-isopropylidenetetracyclo[3.2.0.0^2,7^.0^4,5^]heptane- 1,5,6,7-tetracarboxylic acid tetrakis(cyclohexylamide)","","- C38 H56 N4 O4 -","- C38 H56 N4 O4 -","- C76 H112 N8 O8 -","2","1","BT6289","Winkler, Torsten; Herges, Rainer; Jones, Peter G.; Dix, Ina","A tetrakis(secondary amide) derivative of quadricyclane: 3-isopropylidenetetracyclo[3.2.0.0^2,7^.0^4,6^]heptane-1,5,6,7-tetracarboxylic acid tetrakis(cyclohexylamide)","Acta Crystallographica Section E","2003","59","8","o1098","o1100","10.1107/S1600536803013692","","","0.71073","MoKα","","0.0613","0.0385","","","0.0952","0.1051","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202322","10.7945","0.0012","25.449","0.003","11.671","0.0012","90","","106.353","0.003","90","","3076.4","0.6","133","2","133","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","7-isopropylidenenorborna-2,5-diene-2,3,5,6-tetracarboxylic acid tetrakis(diethylamide)","","- C30 H48 N4 O4 -","- C30 H48 N4 O4 -","- C120 H192 N16 O16 -","4","1","BT6290","Winkler, Torsten; Herges, Rainer; Jones, Peter G.; Dix, Ina","A tetrakis(tertiary amide) derivative of norbornadiene: 7-isopropylidenenorborna-2,5-diene-2,3,5,6-tetracarboxylic acid tetrakis(diethylamide)","Acta Crystallographica Section E","2003","59","8","o1101","o1102","10.1107/S1600536803013709","","","0.71073","MoKα","","0.0736","0.0417","","","0.0999","0.1137","","","","","","0.938","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202323","9.166","0.001","22.484","0.002","9.579","0.001","90","","118.21","0.01","90","","1739.6","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","Diisopropyl(2-hydroxy-1-naphthyl)methylphosphonate","","","- C17 H23 O4 P -","- C17 H23 O4 P -","- C68 H92 O16 P4 -","4","2","BT6291","Zarychta, Bartosz; Zaleski, Jacek; Gawdzik, Barbara; Iwanek, Waldemar","Diisopropyl [(2-hydroxy-1-naphthyl)methyl]phosphonate","Acta Crystallographica Section E","2003","59","7","o1055","o1057","10.1107/S160053680301393X","","","0.71073","MoKα","","0.0605","0.0428","","","0.0783","0.0842","","","","","","0.995","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202324","10.8375","0.0008","11.6922","0.0008","13.7337","0.001","109.065","0.003","101.073","0.003","106.8","0.003","1493.6","0.2","133","2","133","2","","","","","","","","4","P -1","-P 1","2","","3-Isopropylidene-tetracyclo[3.2.0.0^2,7^.0^4,6^]heptan-1,5,6,7- tetracarboxylic acid tetrakis(diethylamide)","","- C30 H48 N4 O4 -","- C30 H48 N4 O4 -","- C60 H96 N8 O8 -","2","1","BT6292","Winkler, Torsten; Herges, Rainer; Jones, Peter G.; Dix, Ina","A tetrakis(tertiary amide) derivative of quadricyclane: 3-isopropylidene-tetracyclo[3.2.0.0^2,7^.0^4,6^]heptan-1,5,6,7-tetracarboxylic acid tetrakis(diethylamide)","Acta Crystallographica Section E","2003","59","8","o1103","o1105","10.1107/S1600536803013898","","","0.71073","MoKα","","0.0606","0.0418","","","0.1073","0.1164","","","","","","1.059","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202325","9.9831","0.0008","12.2324","0.001","13.9644","0.001","92.574","0.003","106.831","0.003","105.554","0.003","1558.5","0.2","143","2","143","2","","","","","","","","4","P -1","-P 1","2","","3-Isopropylidene-tetracyclo[3.2.0.0^2,7^.0^4,5^]heptane- 1,5,6,7-tetracarboxylic acid tetrakis(tert-butylamide)","","- C30 H48 N4 O4 -","- C30 H48 N4 O4 -","- C60 H96 N8 O8 -","2","1","BT6293","Winkler, Torsten; Herges, Rainer; Jones, Peter G.; Dix, Ina","A tetrakis(secondary amide) derivative of quadricyclane: 3-isopropylidene-tetracyclo[3.2.0.0^2,7^.0^4,6^]heptane-1,5,6,7-tetracarboxylic acid tetrakis(<i>tert</i>-butylamide)","Acta Crystallographica Section E","2003","59","8","o1106","o1107","10.1107/S1600536803013904","","","0.71073","MoKα","","0.0562","0.0374","","","0.094","0.1031","","","","","","1.034","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202326","10.357","0.002","10.397","0.002","11.671","0.002","77.76","0.03","71.14","0.03","83.95","0.03","1161.3","0.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H10 B F15 O4 S -","- C20 H10 B F15 O4 S -","- C40 H20 B2 F30 O8 S2 -","2","1","BT6294","Coles, Simon J.; Hursthouse, Michael B.; Beckett, Michael A.; Dutton, Michael","A supramolecular assembly: aquatris(pentafluorophenyl)borane as its mixed dimethyl sulfone and water solvate, (H~2~O)B(C~6~F~5~)~3~·Me~2~SO~2~·H~2~O","Acta Crystallographica Section E","2003","59","9","o1354","o1356","10.1107/S1600536803014065","","","0.71073","MoKα","","0.0434","0.0349","","","0.0905","0.0955","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202327","4.5292","0.0005","9.7807","0.001","21.622","0.002","90","","90","","90","","957.83","0.17","160","2","160","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C7 H13 N O6 -","- C7 H13 N O6 -","- C28 H52 N4 O24 -","4","1","BT6295","Clegg, William; Heath, Sarah L.; Jackson, Richard F. W.; Palmer, Nicholas J.","[3<i>R</i>-(3β,4β,5β)]-3-(Acetylamino)-3,4-dihydro-4-hydroxy-5-(hydroxymethyl)furan-2(5<i>H</i>)-one monohydrate","Acta Crystallographica Section E","2003","59","7","o1060","o1062","10.1107/S1600536803014120","","","0.71073","MoKα","","0.056","0.0382","","","0.0758","0.0824","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202328","10.0904","0.0012","8.9428","0.0011","13.1503","0.0016","90","","95.531","0.003","90","","1181.1","0.2","160","2","160","2","","","","","","","","6","P 1 21 1","P 2yb","4","","(1'S,2R,3R)-3-(1'-tert-Butyldimethylsilyloxy-1'-phenylmethyl)- 2-(4''-methylphenylthio)-2-nitrooxirane","","- C22 H29 N O4 S Si -","- C22 H29 N O4 S Si -","- C44 H58 N2 O8 S2 Si2 -","2","1","BT6296","Clegg, William; .; Elsegood, Mark R. J.","(1'<i>S</i>,2<i>R</i>,3<i>R</i>)-3-(1'-<i>tert</i>-Butyldimethylsilyloxy-1'-phenylmethyl)-2-(4''-methylphenylthio)-2-nitrooxirane","Acta Crystallographica Section E","2003","59","7","o1070","o1072","10.1107/S1600536803014326","","","0.71073","MoKα","","0.0446","0.0362","","","0.0818","0.0849","","","","","","0.976","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202329","8.364","0.0012","6.5476","0.0011","8.5472","0.0012","90","","106.815","0.005","90","","448.07","0.12","133","2","133","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","2,5-dibromoanilinium bromide","","- C6 H6 Br3 N -","- C6 H6 Br3 N -","- C12 H12 Br6 N2 -","2","0.5","BT6297","Jones, Peter G.; Lozano, Virginia","A second polymorph of 2,5-dibromoanilinium bromide","Acta Crystallographica Section E","2003","59","8","o1092","o1094","10.1107/S160053680301465X","","","0.71073","MoKα","","0.0352","0.0298","","","0.0725","0.0743","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202330","11.404","0.002","11.751","0.002","10.87","0.001","90","","116.62","0.02","90","","1302.3","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,5-Di-p-tolyl-1,3,4-oxadiazole","","- C16 H14 N2 O -","- C16 H14 N2 O -","- C64 H56 N8 O4 -","4","0.5","BT6298","Reck, Günter; Orgzall, Ingo; Schulz, Burkhard","2,5-Di-<i>p</i>-tolyl-1,3,4-oxadiazole","Acta Crystallographica Section E","2003","59","8","o1135","o1136","10.1107/S1600536803014867","","","0.71069","MoKα","","0.0717","0.0531","","","0.1528","0.1562","","","","","","0.905","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202331","7.6651","0.0009","12.3726","0.0018","8.4886","0.001","90","","93.766","0.012","90","","803.3","0.18","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Piperazinium chromate(VI)","Piperazinium chromate(VI)","","- C4 H12 Cr N2 O4 -","- C4 H12 Cr N2 O4 -","- C16 H48 Cr4 N8 O16 -","4","1","BT6299","Srinivasan, Bikshandarkoil R.; Näther, Christian; Bensch, Wolfgang","Piperazinium chromate(VI)","Acta Crystallographica Section E","2003","59","8","m639","m641","10.1107/S1600536803014879","","","0.71073","MoKα","","0.0335","0.0263","","","0.0787","0.0818","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202332","7.3679","0.0014","22.28","0.004","27.448","0.004","90","","90","","90","","4505.8","1.3","203","2","203","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","cis-bis(N,N-dimethyl-N'-2-chlorobenzoylthioureato)nickel(II)","","- C20 H20 Cl2 N4 Ni O2 S2 -","- C20 H20 Cl2 N4 Ni O2 S2 -","- C160 H160 Cl16 N32 Ni8 O16 S16 -","8","1","BT6300","Emen, Fatih Mehmet; Flörke, Ulrich; Külcü, Nevzat; Arslan, Hakan","<i>cis</i>-Bis(<i>N</i>,<i>N</i>-dimethyl-<i>N</i>'-2-chlorobenzoylthioureato)nickel(II)","Acta Crystallographica Section E","2003","59","8","m582","m583","10.1107/S1600536803014934","","","0.71073","MoKα","","0.1339","0.0555","","","0.1218","0.1716","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202333","5.6323","0.0013","7.24","0.002","47.39","0.0015","90","","91.17","0.011","90","","1932.1","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Tetradecyltrimethylammmonium bromide","","- C17 H38 Br N -","- C17 H38 Br N -","- C68 H152 Br4 N4 -","4","1","BT6302","Ramos Silva, Manuela; Matos Beja, Ana; Paixão, Jose Antonio","Pseudosymmetry in tetradecyltrimethylammonium bromide","Acta Crystallographica Section E","2003","59","8","o1151","o1152","10.1107/S1600536803015319","","","1.5418","CuKα","","0.0531","0.0331","","","0.0893","0.1007","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202334","13.3792","0.0011","12.6369","0.0007","14.9381","0.0009","90","","90","","90","","2525.6","0.3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","1,4-dimethylpiperazinium tetrathiotungstate(VI)","","- C6 H16 N2 S4 W -","- C6 H16 N2 S4 W -","- C48 H128 N16 S32 W8 -","8","1","BT6303","Srinivasan, Bikshandarkoil R.; Dhuri, Sunder N.; Näther, Christian; Bensch, Wolfgang","1,4-Dimethylpiperazinium tetrathiotungstate(VI)","Acta Crystallographica Section E","2003","59","8","m681","m683","10.1107/S1600536803016040","","","0.71073","MoKα","","0.0309","0.0246","","","0.0632","0.0668","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202335","11.558","0.003","10.476","0.002","11.75","0.002","90","","98.823","0.003","90","","1405.9","0.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-ethoxycarbonyl-4-hydroxy-6-methoxymethyleneoxy-1-methyl-2-quinolone","","- C15 H17 N O6 -","- C15 H17 N O6 -","- C60 H68 N4 O24 -","4","1","BT6304","Pozzi, C. Gustavo; Goeta, Andrés E.; Autino, Juan C.; Punte, Graciela","3-Ethoxycarbonyl-4-hydroxy-6-(methoxymethoxy)-1-methyl-2-quinolone","Acta Crystallographica Section E","2003","59","8","o1196","o1198","10.1107/S1600536803016192","","","0.71073","MoKα","","0.066","0.0408","","","0.1025","0.1159","","","","","","1.011","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202336","10.896","0.001","12.547","0.002","13.454","0.002","90","","120.71","0.02","90","","1581.4","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H14 I2 N2 -","- C15 H14 I2 N2 -","- C60 H56 I8 N8 -","4","1","BT6305","Marciniak, Bernard; Pavlyuk, Volodymyr; Rozycka-Sokolowska, Ewa","6-(3-Iodopropyl)benzo[<i>f</i>][1,7]naphthyridin-6-ium iodide","Acta Crystallographica Section E","2003","59","8","o1178","o1180","10.1107/S1600536803015800","","","0.71069","MoKα","","0.0465","0.0427","","","0.0945","0.0954","","","","","","1.192","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2202337","40.153","0.003","8.113","0.002","20.161","0.003","90","","109.989","0.008","90","","6172","1.9","294","1","294","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tetraethylammonium dicarbonyl(dicyanomethylene)[tris(3,5-dimethyl-1- pyrazolyl)hydroborato]molybdenum(0)","","- C28 H42 B Mo N9 O2 -","- C28 H42 B Mo N9 O2 -","- C224 H336 B8 Mo8 N72 O16 -","8","1","BT6306","Ferguson, George; Lalor, Fergus J.; O'Neill, S. A.","Tetraethylammonium dicarbonyl(dicyanomethylene)[tris(3,5-dimethyl-1-pyrazolyl)hydroborato]molybdenum(0)","Acta Crystallographica Section E","2003","59","8","m644","m646","10.1107/S1600536803015794","","","0.7107","MolybdenumKα","","0.0801","0.0385","","","0.0827","0.091","","","","","","0.957","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202339","11.775","0.002","7.1711","0.0009","17.488","0.002","90","","93.914","0.002","90","","1473.2","0.4","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Hexaaquacadmium(II) di-{(S)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptane-1- methanesulfonate}","","- C20 H42 Cd O14 S2 -","- C20 H42 Cd O14 S2 -","- C40 H84 Cd2 O28 S4 -","2","1","BT6309","Zhou, Jin-Sen; Cai, Ji-Wen; Ng, Seik Weng","Hexaaquacadmium(II) di-(<i>S</i>)-camphor-10-sulfonate","Acta Crystallographica Section E","2003","59","8","o1185","o1186","10.1107/S1600536803015940","","","0.71073","MoKα","","0.054","0.044","","","0.109","0.116","","","","","","1.24","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202340","7.8623","0.0007","14.2934","0.0013","11.3321","0.001","90","","90","","90","","1273.5","0.2","150","2","150","2","","","","","","","","6","P n a 21","P 2c -2n","33","","N'-(4-Chlorobenzoyl)-N-(pyrrolidin-1-yl)thiourea","","- C12 H13 Cl N2 O S -","- C12 H13 Cl N2 O S -","- C48 H52 Cl4 N8 O4 S4 -","4","1","BT6310","Kayhan, Esra; Flörke, Ulrich; Külcü, Nevzat; Arslan, Hakan","<i>N</i>'-(4-Chlorobenzoyl)-<i>N</i>-(pyrrolidin-1-yl)thiourea","Acta Crystallographica Section E","2003","59","8","o1237","o1238","10.1107/S1600536803016027","","","0.71073","MoKα","","0.0345","0.0331","","","0.0802","0.0809","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202341","25.311","0.005","9.801","0.002","9.472","0.0019","90","","90","","90","","2349.7","0.8","140","1","140","1","","","","","","","","6","P n a 21","P 2c -2n","33","","μ~2~-Oxo-bis[trichlorobis(dimethylsulfane)titanium(IV)]","","- C8 H24 Cl6 O S4 Ti2 -","- C8 H24 Cl6 O S4 Ti2 -","- C32 H96 Cl24 O4 S16 Ti8 -","4","1","BT6311","Mark Schormann","μ-Oxo-bis[trichlorobis(dimethylsulfane)titanium(IV)]","Acta Crystallographica Section E","2003","59","8","m674","m675","10.1107/S1600536803016258","","","0.71073","MoKα","","0.0301","0.0292","","","0.0762","0.0767","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202342","6.8304","0.0004","9.227","0.0005","20.197","0.001","78.294","0.001","82.734","0.001","74.892","0.001","1199.69","0.11","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Pentapotassium dicitrato(4-)manganate(III) pentahydrate","","- C12 H18 K5 Mn O19 -","- C12 H18 K5 Mn O19 -","- C24 H36 K10 Mn2 O38 -","2","1","BT6312","Zhao, Rui; Deng, Yuan-Fu; Zhou, Zhao-Hui; Ng, Seik Weng","Pentapotassium dicitrato(4{-})manganate(III) pentahydrate","Acta Crystallographica Section E","2003","59","8","m666","m668","10.1107/S1600536803016271","","","0.71073","MoKα","","0.0786","0.0624","","","0.1501","0.161","","","","","","1.149","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202343","7.3351","0.0004","9.051","0.0005","7.4211","0.0005","90","","101.723","0.003","90","","482.41","0.05","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","5-Carboxymellein","","","- C11 H10 O5 -","- C11 H10 O5 -","- C22 H20 O10 -","2","1","","Wang, Jian-Feng; Fang, Mei-Juan; Zhao, Yu-Fen; Huang, Yao-Jian; Su, Wen-Jin; Ng, Seik Weng","8-Hydroxy-(S)-3-methyl-1-oxoisochromane-5-carboxylic acid (5-carboxymellein)","Acta Crystallographica, Section E: Structure Reports Online","2003","59","8","m1208","m1209","10.1107/s1600536803016313","","","","","","","","","","","","","","","","","","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202344","6.7185","0.0003","16.5766","0.0008","20.2149","0.001","90","","90","","90","","2251.33","0.19","150","1","150","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H25 Co N6 O9 -","- C17 H25 Co N6 O9 -","- C68 H100 Co4 N24 O36 -","4","1","BT6314","Panosyan, Francis B.; Lough, Alan J.; Chin, Jik","{2,6-Bis[(4<i>R</i>)-(+)-4-isopropyl-4,5-dihydro-1,3-oxazol-2-yl]pyridine-κ^3^<i>N</i>}trinitrocobalt(III) monohydrate","Acta Crystallographica Section E","2003","59","8","m695","m697","10.1107/S160053680301643X","","","0.71073","MoKα","","0.1026","0.0669","","","0.134","0.1533","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202345","10.9633","0.0007","7.189","0.0005","14.425","0.001","90","","99.088","0.001","90","","1122.64","0.13","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","5-Methoxycarbonylmellein","Methyl 8-hydroxy-(S)-3-methyl-1-oxo-isochromane-5-carboxylate","","- C12 H12 O5 -","- C12 H12 O5 -","- C48 H48 O20 -","4","2","BT6315","Wang, Jian-Feng; Zhang, Yong-Jie; Huang, Yao-Jian; Su, Wen-Jin; Lu, Yang; Zhao, Yu-Fen; Ng, Seik Weng","Methyl 8-hydroxy-(<i>S</i>)-3-methyl-1-oxoisochromane-5-carboxylate (5-methoxycarbonylmellein)","Acta Crystallographica Section E","2003","59","8","o1233","o1234","10.1107/S1600536803016490","","","0.71073","MoKα","","0.067","0.051","","","0.115","0.123","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202346","7.5508","0.0007","12.616","0.001","10.1223","0.0009","90","","90","","90","","964.26","0.15","298","2","298","2","","","","","","","","3","P n a 21","P 2c -2n","33","","7-Methoxy-4,6-dimethyl-3H-isobenzofuran-1-one","","- C11 H12 O3 -","- C11 H12 O3 -","- C44 H48 O12 -","4","1","BT6316","Wang, Jian-Feng; Lin, Xin; Huang, Yao-Jian; Su, Wen-Jin; Zhao, Yu-Fen; Ng, Seik Weng","7-Methoxy-4,6-dimethyl-3<i>H</i>-isobenzofuran-1-one","Acta Crystallographica Section E","2003","59","8","o1235","o1236","10.1107/S1600536803016507","","","0.71073","MoKα","","0.065","0.06","","","0.151","0.156","","","","","","1.13","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202347","24.172","0.003","13.365","0.001","8.463","0.001","90","","90","","90","","2734","0.5","298","2","298","2","","","","","","","","5","P n a 21","P 2c -2n","33","","μ-Nitrato-nitratobis[tris(2-aminoethyl)amine]dicadmium(II) dinitrate","","- C12 H36 Cd2 N12 O12 -","- C12 H36 Cd2 N12 O12 -","- C48 H144 Cd8 N48 O48 -","4","1","BT6317","Cai, Jiwen; Ng, Seik Weng","μ-Nitrato-nitratobis[tris(2-aminoethyl)amine]dicadmium(II) dinitrate","Acta Crystallographica Section E","2003","59","8","m692","m694","10.1107/S1600536803016519","","","0.71073","MoKα","","0.072","0.036","","","0.073","0.085","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202348","10.4073","0.0005","17.8174","0.0008","7.5278","0.0004","90","","108.474","0.001","90","","1323.95","0.11","298","2","298","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","Disodium bis(1,2,4,5-benzenetetracarboxylato)dihydroxytetrazincate(II)^.^pyrazine","","- C24 H10 N2 Na2 O18 Zn4 -","- C24 H10 N2 Na2 O18 Zn4 -","- C48 H20 N4 Na4 O36 Zn8 -","2","0.25","BT6318","Yang, Shi-Yao; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","Disodium bis(1,2,4,5-benzenetetracarboxylato)dihydroxytetrazincate(II) pyrazine","Acta Crystallographica Section E","2003","59","9","m731","m733","10.1107/S1600536803016921","","","0.71073","MoKα","","0.033","0.028","","","0.0702","0.072","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202349","7.2005","0.0005","8.0322","0.0005","9.3735","0.0006","96.175","0.001","101.872","0.001","116.245","0.001","463.5","0.05","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","tetraaqua(1,2,4,5-benzenetetracarboxylato)(pyrazine)dinickel(II) dihydrate","","- C14 H18 N2 Ni2 O14 -","- C14 H18 N2 Ni2 O14 -","- C14 H18 N2 Ni2 O14 -","1","0.5","BT6319","Yang, Shi-Yao; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","Polymeric tetraaqua(1,2,4,5-benzenetetracarboxylato)(pyrazine)dinickel(II) dihydrate","Acta Crystallographica Section E","2003","59","9","m734","m735","10.1107/S1600536803017045","","","0.71073","MoKα","","0.07","0.065","","","0.139","0.142","","","","","","1.25","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202350","10.9115","0.0005","6.153","0.0003","13.3653","0.0006","90","","92.315","0.001","90","","896.59","0.07","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C3 H15 As N2 O5 -","- C3 H15 As N2 O5 -","- C12 H60 As4 N8 O20 -","4","1","BT6320","Lee, Clare; Harrison, William T. A.","Propane-1,2-diammonium hydrogenarsenate monohydrate","Acta Crystallographica Section E","2003","59","9","m739","m741","10.1107/S1600536803017239","","","0.71073","MoKα","","0.0353","0.0227","","","0.0489","0.0512","","","","","","0.923","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202351","5.524","0.004","14.988","0.011","23.557","0.018","90","","90","","90","","1950","3","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Methyl 2(S)-(N-fluoren-9-ylmethoxycarbonylamino)-3-(2-pyridyl)propionate","","- C24 H22 N2 O4 -","- C24 H22 N2 O4 -","- C96 H88 N8 O16 -","4","1","BT6321","Clegg, William; Horsburgh, Lynne","Methyl 2(<i>S</i>)-(<i>N</i>-fluoren-9-ylmethoxycarbonylamino)-3-(2-pyridyl)propionate","Acta Crystallographica Section E","2003","59","9","o1257","o1258","10.1107/S1600536803017240","","","0.71073","MoKα","","0.1133","0.0517","","","0.0766","0.0902","","","","","","0.797","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202352","15.0297","0.0009","16.9603","0.001","17.2897","0.0011","90","","90","","90","","4407.3","0.5","160","2","160","2","","","","","","","","7","C m c 21","C 2c -2","36","","trans-(6-amino-2-pyridinio)iodobis(triphenylphosphine)palladium(II) iodide ethyl acetate solvate","","- C45 H44 I2 N2 O2 P2 Pd -","- C45 H44 I2 N2 O2 P2 Pd -","- C180 H176 I8 N8 O8 P8 Pd4 -","4","0.5","BT6322","Clegg, William; Horsburgh, Lynne","<i>trans</i>-(6-Amino-2-pyridinio)iodobis(triphenylphosphine)palladium(II) iodide ethyl acetate solvate","Acta Crystallographica Section E","2003","59","9","m700","m702","10.1107/S1600536803017252","","","0.71073","MoKα","","0.0271","0.0255","","","0.0651","0.0658","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202353","6.7643","0.0004","7.9045","0.0005","8.2612","0.0005","63.021","0.001","81.414","0.001","72.2","0.001","374.77","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","guanylurea selenite","","","- C2 H8 N4 O4 Se -","- C2 H8 N4 O4 Se -","- C4 H16 N8 O8 Se2 -","2","1","BT6323","Ritchie, Lyndsey K.; Harrison, William T. A.","1-Carbamoylguanidinium hydrogenselenite","Acta Crystallographica Section E","2003","59","9","o1296","o1298","10.1107/S1600536803017380","","","0.71073","MoKα","","0.0368","0.0309","","","0.076","0.0778","","","","","","1.008","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202354","9.7641","0.0008","10.4448","0.0008","27.245","0.002","80.396","0.004","83.548","0.003","63.566","0.003","2450.9","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","bis[μ-2-(N'-methyl-4,4'-bipyridinium-1-yl)acetamidato]bis[cis- diammineplatinum(II)] hexaperchlorate dihydrate","","- C26 H44 Cl6 N10 O28 Pt2 -","- C26 H40 Cl6 N10 O28 Pt2 -","- C52 H80 Cl12 N20 O56 Pt4 -","2","1","BT6324","Sakai, Ken; Ikuta, Yoshie; Tsubomura, Taro; Kato, Kaoru; Yokoyama, Yoshimi; Kajiwara, Takashi; Ito, Tasuku","A head-to-tail isomer of bis[μ-2-(<i>N</i>'-methyl-4,4'-bipyridinium-1-yl)acetamidato]bis[<i>cis</i>-diammineplatinum(II)] hexaperchlorate dihydrate","Acta Crystallographica Section E","2003","59","9","m780","m783","10.1107/S1600536803017756","","","0.71073","MoKα","","0.1999","0.0621","","","0.0791","0.1083","","","","","","0.702","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202355","7.3671","0.0002","8.6295","0.0004","15.0272","0.0007","73.543","0.002","83.409","0.003","70.465","0.002","863.26","0.06","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Hexa-aqua-cobalt(II) (μ~2~-triethylenetetra-aminehexa-acetato)- diaqua-dicobalt(II) tetrahydrate","","- C18 H48 Co3 N4 O24 -","- C18 H48 Co3 N4 O24 -","- C18 H48 Co3 N4 O24 -","1","0.5","BT6325","Li-Jun Song; Jie Zhang; Zi-Rong Tang; Wen-Guo Wang; Zhan-Feng Ju","Hexaaquacobalt(II) (μ~2~-triethylenetetraminehexaacetato)diaquadicobalt(II) tetrahydrate","Acta Crystallographica Section E","2003","59","10","m867","m869","10.1107/S1600536803019445","","","0.71073","MoKα","","0.0671","0.0536","","","0.1193","0.1272","","","","","","1.062","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2202356","17.6993","0.001","10.0639","0.0008","13.7659","0.001","90","","97.124","0.0016","90","","2433.1","0.3","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(ethylenediammonium) di-μ~5~-hydrogenphosphato-penta-μ~2~-oxo-decaoxopentamolybdenum","","- C4 H22 Mo5 N4 O23 P2 -","- C4 H22 Mo5 N4 O23 P2 -","- C16 H88 Mo20 N16 O92 P8 -","4","0.5","BT6326","Sun, Qiaozhen; Zhang, Hanhui; Huang, Changcang; Sun, Qiaohong; Sun, Ruiqing; Wang, Yongjing","Bis(ethylenediammonium) di-μ~5~-hydrogenphosphato-penta-μ~2~-oxo-decaoxopentamolybdenum","Acta Crystallographica Section E","2003","59","9","m729","m730","10.1107/S1600536803017859","","","0.71069","MoKα","","0.0339","0.0216","","","0.0436","0.0447","","","","","","0.996","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202357","3.755","0.0008","7.758","0.002","20.694","0.004","90","","91.31","0.03","90","","602.7","0.2","100","0.2","100","0.2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C5 H5 B O4 -","- C5 H5 B O4 -","- C20 H20 B4 O16 -","4","1","BT6327","Ejsmont, Krzysztof; Zaleski, Jacek; Sporzyński, Andrzej; Lewandowski, Michał","5-Formyl-2-furanboronic acid at 100K","Acta Crystallographica Section E","2003","59","9","o1324","o1326","10.1107/S1600536803017999","","","0.71073","MoKα","","0.0673","0.0474","","","0.1197","0.1324","","","","","","0.945","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202358","10.023","0.017","15.92","0.03","12.123","0.015","90","","115.67","0.11","90","","1744","5","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Dimethyl 5-oxo-4,5-dihydro-1,2,3,4-tetrazole-1,4-dicarboxylate","","- C5 H6 N4 O5 -","- C5 H6 N4 O5 -","- C40 H48 N32 O40 -","8","4","BT6328","Crockett, Rowena; Forrester, Alexander R.; Howie, R. Alan","Dimethyl 5-oxo-4,5-dihydro-1<i>H</i>-tetrazole-1,4-dicarboxylate","Acta Crystallographica Section E","2003","59","9","o1347","o1348","10.1107/S1600536803018282","","","0.71073","MoKα","","0.1468","0.0846","","","0.2086","0.2474","","","","","","1.004","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202359","6.798","0.0007","15.2735","0.0016","10.0275","0.001","90","","109.168","0.001","90","","983.43","0.17","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-[4-(3,3-Diethylthioureidocarbonoyl)benzoyl]-1,1-diethylthiourea","","- C18 H26 N4 O2 S2 -","- C18 H26 N4 O2 S2 -","- C36 H52 N8 O4 S4 -","2","0.5","BT6329","Ugur, Derya; Flörke, Ulrich; Külcü, Nevzat; Arslan, Hakan","3-[4-(3,3-Diethylthioureidocarbonoyl)benzoyl]-1,1-diethylthiourea","Acta Crystallographica Section E","2003","59","9","o1345","o1346","10.1107/S1600536803018270","","","0.71073","MoKα","","0.0343","0.0317","","","0.0881","0.0902","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202360","14.721","0.002","7.364","0.001","9.82","0.001","90","","122.43","0.01","90","","898.5","0.2","293","2","293","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Tetracaesium digermanium octasulfide","","- Cs4 Ge2 S8 -","- Cs4 Ge2 S8 -","- Cs8 Ge4 S16 -","2","0.25","BT6330","Wu, Yuandong; Näther, Christian; Bensch, Wolfgang","Cs~4~Ge~2~S~8~","Acta Crystallographica Section E","2003","59","10","i137","i138","10.1107/S1600536803018695","","","0.71073","MoKα","","0.028","0.021","","","0.05","0.051","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202361","15.5767","0.0009","15.7746","0.0009","20.5721","0.0012","90","","102.541","0.001","90","","4934.3","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","30,31-Dimethyl-3,26-dioxa-11,18- diazapentacyclo[26.4.0.0^4,9^.0^12,17^.0^20,25^]dotriconta- 1(32),4,6,8,12,14,16,20,22,24,28,30-dodecaene-10,19-dione","","- C30 H26 N2 O4 -","- C30 H26 N2 O4 -","- C240 H208 N16 O32 -","8","2","BT6331","Sundari Bhaskaran; S. Selvanayagam; V. Rajakannan; D. Velmurugan; K. Ravikumar; A. Mohammed Abdul Rasheed; P. Rajakumar","30,31-Dimethyl-3,26-dioxa-11,18-diazapentacyclo[26.4.0.0^4,9^.0^12,17^.0^20,25^]dotriconta-1(32),4,6,8,12,14,16,20,22,24,28,30-dodecaene-10,19-dione","Acta Crystallographica Section E","2003","59","9","o1429","o1431","10.1107/S1600536803018634","","","0.71073","MoKα","","0.1103","0.0555","","","0.139","0.1662","","","","","","0.986","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202362","6.3317","0.0005","11.547","0.0008","14.1402","0.001","72.24","0.001","77.366","0.001","77.773","0.001","948.93","0.12","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H24 N2 O3 -","- C23 H24 N2 O3 -","- C46 H48 N4 O6 -","2","1","","Govind, M. M.; Selvanayagam, S.; Velmurugan, D.; Ravikumar, K.; Sridhar, Gowri; Raghunathan, R.","4'-(p-Methoxyphenyl)-1'-methyl-1H-indole-3-spiro-2'-pyrrolidine- 3'-spiro-1''-cyclopentane-2(3H),2''-dione","Acta Crystallographica, Section E: Structure Reports Online","2003","59","10","o1438","o1440","10.1107/s1600536803018890","","","","","","","","","","","","","","","","","","","","","has coordinates","200778","2020-10-21","18:00:00",""
"2202363","4.6788","0.0002","13.3277","0.0006","13.538","0.0007","90","","97.212","0.002","90","","837.52","0.07","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H10 N2 O5 -","- C6 H10 N2 O5 -","- C24 H40 N8 O20 -","4","1","BT6333","Kennedy, Alan R.; Khalaf, Abedawn I.; Suckling, Colin J.; Waigh, Roger D.","Ethyl 5-oxo-2,5-dihydro-4-isoxazolecarboxylate hydroxylamine salt","Acta Crystallographica Section E","2003","59","9","o1410","o1412","10.1107/S1600536803018828","","","0.71073","MoKα","","0.0525","0.0378","","","0.0805","0.0878","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202364","9.7632","0.0006","10.3841","0.0007","11.6874","0.0008","99.735","0.001","96.48","0.001","98.892","0.001","1141.98","0.13","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Spiro- [2 -3'] oxindole - spiro -[3- 3""] oxindole - 4[p-methyl benzydy] pyrolidizine.","","- C29 H25 N3 O3 -","- C29 H25 N3 O3 -","- C58 H50 N6 O6 -","2","1","BT6334","P.R.Seshadri; S.Selvanayagam; D.Velmurugan; K.Ravikumar; A.R.Sureshbabu; R.Raghunathan","Spiro-[2-3']oxindole-spiro-[3-3'']oxindole-4[<i>p</i>-methylbenzyl]pyrrolidizine","Acta Crystallographica Section E","2003","59","10","o1458","o1460","10.1107/S1600536803019226","","","0.71073","MoKα","","0.0596","0.0501","","","0.1449","0.1549","","","","","","0.949","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202365","9.968","0.0002","11.5077","0.0002","15.4906","0.0004","90","","103.712","0.001","90","","1726.26","0.06","150","1","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","[(S,S)-N-(1-{6-[1-(Dimethylamino)ethyl]pyridin-2-yl}ethyl)-N,N- dimethylamine-κ^3^N]dibromozinc(II)","","- C13 H23 Br2 N3 Zn -","- C13 H23 Br2 N3 Zn -","- C52 H92 Br8 N12 Zn4 -","4","2","BT6335","Panosyan, Francis B.; Lough, Alan J.; Chin, Jik","[(<i>S,S</i>)-<i>N</i>-(1-{6-[1-(Dimethylamino)ethyl]pyridin-2-yl}ethyl)-<i>N,N</i>-dimethylamine-κ^3^<i>N</i>]dibromozinc(II)","Acta Crystallographica Section E","2003","59","9","m827","m829","10.1107/S1600536803018920","","","0.71073","MoKα","","0.0543","0.0511","","","0.127","0.131","","","","","","1.062","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202366","16.86","0.001","10.521","0.0007","7.2325","0.0005","90","","110.298","0.001","90","","1203.26","0.14","223","","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Cadmium dichloride.1,10-phenanthroline","catena-Dichloro(1,10-phenanthroline)cadmium(II)","","- C12 H8 Cd Cl2 N2 -","- C12 H8 Cd Cl2 N2 -","- C48 H32 Cd4 Cl8 N8 -","4","0.5","BT6336","Chen, Hong-Bin; Zhou, Zhao-Hui; Wan, Hui-Lin; Ng, Seik Weng","<i>catena</i>-Poly[di-μ~2~-chloro(1,10-phenanthroline)cadmium(II)]","Acta Crystallographica Section E","2003","59","10","m845","m846","10.1107/S1600536803019214","","","0.71073","MoKα","","0.069","0.067","","","0.157","0.159","","","","","","1.24","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202367","7.4392","0.0001","8.4408","0.0001","8.7411","0.0002","113.027","0.001","97.04","0.001","101.818","0.001","481.76","0.015","150","1","150","1","","","","","","","","6","P 1","P 1","1","","","","- C17 H23 Cl2 N3 O2 Zn -","- C17 H23 Cl2 N3 O2 Zn -","- C17 H23 Cl2 N3 O2 Zn -","1","1","BT6337","Panosyan, Francis B.; Lough, Alan J.; Chin, Jik","{2,6-Bis[(4<i>R</i>)-(+)-4-isopropyl-4,5-dihydro-1,3-oxazol-2-yl]pyridine-κ^3^<i>N</i>}dichlorozinc(II)","Acta Crystallographica Section E","2003","59","10","m864","m866","10.1107/S160053680301924X","","","0.71073","MoKα","","0.0319","0.0313","","","0.0791","0.0796","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202368","16.4714","0.0008","14.0769","0.0007","11.0443","0.0005","90","","98.128","0.001","90","","2535.1","0.2","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(diisopropylammonium) dimethyldioxalatostannate","","- C18 H38 N2 O8 Sn -","- C18 H38 N2 O8 Sn -","- C72 H152 N8 O32 Sn4 -","4","0.5","BT6338","Xu, Tao; Yang, Shi-Yao; Xie, Zhao-Xiong; Ng, Seik Weng","Bis(diisopropylammonium) dimethyldioxalatostannate","Acta Crystallographica Section E","2003","59","10","m870","m872","10.1107/S1600536803019251","","","0.71073","MoKα","","0.046","0.041","","","0.095","0.098","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202369","9.4647","0.0005","20.901","0.001","15.994","0.0008","90","","93.364","0.001","90","","3158.5","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(diisopropylammonium) diphenyldioxalatostannate","","- C28 H42 N2 O8 Sn -","- C28 H42 N2 O8 Sn -","- C112 H168 N8 O32 Sn4 -","4","1","BT6339","Xu, Tao; Yang, Shi-Yao; Xie, Zhao-Xiong; Ng, Seik Weng","Bis(diisopropylammonium) diphenyldioxalatostannate(IV)","Acta Crystallographica Section E","2003","59","10","m873","m875","10.1107/S1600536803019457","","","0.71073","MoKα","","0.081","0.08","","","0.165","0.166","","","","","","1.3","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202370","7.0005","0.0003","10.8221","0.0004","16.7241","0.0006","90","","90","","90","","1267.02","0.08","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Dimethyl-4-fluorophenyltin trifluoroacetate","catena-Poly[μ-trifluoroacetato-O:O'-dimethyl-4-fluorophenyltin(IV)]","","- C10 H10 F4 O2 Sn -","- C10 H10 F4 O2 Sn -","- C40 H40 F16 O8 Sn4 -","4","1","BT6340","Amini, Mostafa M.; Abadi, Shabnam Hossein; Mirzaee, Mahdi; Yang, Shi-Yao; Ng, Seik Weng","<i>catena</i>-Poly[μ-trifluoroacetato-<i>O</i>:<i>O</i>'-dimethyl-4-fluorophenyltin(IV)]","Acta Crystallographica Section E","2003","59","10","m847","m848","10.1107/S1600536803019299","","","0.71073","MoKα","","0.033","0.03","","","0.06","0.061","","","","","","0.92","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202371","8.9026","0.0005","9.6131","0.0006","11.2145","0.0007","91.674","0.001","113.129","0.001","96.651","0.001","873.74","0.09","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis[1,1,3,3-tetramethyl-1,3-bis(dichloroacetato)distannoxane]","","- C16 H28 Cl8 O10 Sn4 -","- C16 H28 Cl8 O10 Sn4 -","- C16 H28 Cl8 O10 Sn4 -","1","0.5","BT6341","Amini, Mostafa M.; Abadi, Shabnam Hossein; Mirzaee, Mahdi; Yang, Shi-Yao; Ng, Seik Weng","Bis[1,1,3,3-tetramethyl-1,3-bis(dichloroacetato)distannoxane]","Acta Crystallographica Section E","2003","59","10","m876","m877","10.1107/S1600536803019421","","","0.71073","MoKα","","0.079","0.059","","","0.116","0.129","","","","","","1.081","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202372","7.2342","0.0004","8.0693","0.0005","9.3975","0.0006","96.114","0.001","102.35","0.001","116.053","0.001","468.71","0.05","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Tetraaqua-1,2,4,5-benzenetetracarboxylato(pyrazine)dicobalt(II) dihydrate","","- C14 H18 Co2 N2 O14 -","- C14 H18 Co2 N2 O14 -","- C14 H18 Co2 N2 O14 -","1","0.5","BT6342","Yang, Shi-Yao; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","Tetraaqua-1,2,4,5-benzenetetracarboxylato(pyrazine)dicobalt(II) dihydrate","Acta Crystallographica Section E","2003","59","10","m841","m842","10.1107/S1600536803019342","","","0.71073","MoKα","","0.039","0.035","","","0.08","0.082","","","","","","0.95","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202373","9.2974","0.0005","15.2169","0.0008","16.1024","0.0008","90","","90","","90","","2278.1","0.2","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Diaqua-8-hydroxyquinolinyl-5-sulfonatozinc(II)","","- C9 H9 N O6 S Zn -","- C9 H9 N O6 S Zn -","- C72 H72 N8 O48 S8 Zn8 -","8","1","BT6343","Rao, Huo-Yu; Tao, Jun; Ng, Seik Weng","Polymeric diaqua-8-hydroxyquinolinyl-5-sulfonatozinc(II)","Acta Crystallographica Section E","2003","59","10","m859","m860","10.1107/S1600536803019433","","","0.71073","MoKα","","0.038","0.032","","","0.083","0.085","","","","","","1","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202374","8.3527","0.0008","9.8192","0.001","12.0219","0.0012","98.377","0.003","101.455","0.003","108.361","0.003","893.88","0.16","133","2","133","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H30 N6 -","- C18 H30 N6 -","- C36 H60 N12 -","2","1","BT6344","Khan, Arif Ali; Wismach, Cathleen; Jones, Peter G.; Streubel, Rainer","2,4,6-Tripiperidino-1,3,5-triazine","Acta Crystallographica Section E","2003","59","11","o1757","o1758","10.1107/S1600536803020440","","","0.71073","MoKα","","0.0535","0.0399","","","0.1093","0.1168","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202375","21.258","0.01","9.723","0.004","17.253","0.007","90","","126.61","0.014","90","","2863","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dithiocyanatebis(4,4'-methylenebis(3,5-dimethylpyrazole))manganese(II)","","- C24 H32 Mn N10 S2 -","- C24 H32 Mn N10 S2 -","- C96 H128 Mn4 N40 S8 -","4","0.5","BT6345","Han, Wei; Li, Ling; Gu, Wen; Liu, Zhan-Quan; Yan, Shi-Ping; Cheng, Peng; Liao, Dai-Zheng; Jiang, Zong-Hui; Shen, Pan-Wen","<i>catena</i>-Poly[[dithiocyanatomanganese(II)]-di-μ-4,4'-methylenebis(3,5-dimethylpyrazole)]","Acta Crystallographica Section E","2003","59","11","m980","m981","10.1107/S160053680302021X","","","0.71073","MoKα","","0.0781","0.0434","","","0.0917","0.1028","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202376","14.4717","0.0005","6.4247","0.0002","18.4846","0.0006","90","","90","","90","","1718.63","0.1","293","2","295","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C10 H12 Cu N10 O10 -","- C10 H12 Cu N10 O10 -","- C40 H48 Cu4 N40 O40 -","4","0.5","","Abul-Haj, Mohammad; Quirós, Miguel; Salas, Juan M.","Diaquabis(nitrato-κO)bis(4,7-dihydro-1,2,4-triazolo [1,5-a]pyrimidine-7-one-κN^3^)copper(II)","Acta Crystallographica, Section E: Structure Reports Online","2003","59","10d","m903","m905","10.1107/s1600536803019974","","","","","","","","","","","","","","","","","","","","","has coordinates","200778","2020-10-21","18:00:00",""
"2202377","8.811","0.003","9.717","0.003","12.724","0.004","104.87","0.04","93.42","0.04","115.266","0.007","934.2","0.6","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","Bis[3-(4-methylcoumarinyl-7-oxy)-μ-methoxy-1,1,3,3-tetramethyldistannoxane]","","- C30 H44 O10 Sn4 -","- C30 H44 O10 Sn4 -","- C30 H44 O10 Sn4 -","1","0.5","BT6347","Zhang, Yiqun; Khoo, Lian Ee; Tou, Teck Yong; Ng, Seik Weng","Bis[3-(4-methylcoumarinyl-7-oxy)-μ-methoxy-1,1,3,3-tetramethyldistannoxane]","Acta Crystallographica Section E","2003","59","10","m894","m896","10.1107/S1600536803019858","","","0.71073","MoKα","","0.071","0.037","","","0.067","0.078","","","","","","0.99","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202378","4.474","0.001","9.529","0.002","14.271","0.002","92.65","0.01","93.72","0.01","95.16","0.02","603.8","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","2-(3-Pyridylmethyliminomethyl)-4-bromophenol","","- C13 H11 Br N2 O -","- C13 H11 Br N2 O -","- C26 H22 Br2 N4 O2 -","2","1","BT6348","Zhang, Yiqun; Khoo, Lian Ee; Ng, Seik Weng","4-Bromo-2-(2-pyridylmethyliminomethyl)phenol","Acta Crystallographica Section E","2003","59","10","o1496","o1497","10.1107/S1600536803019986","","","0.71073","MoKα","","0.08","0.045","","","0.094","0.108","","","","","","1.01","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202379","7.4087","0.0003","16.4236","0.0006","14.5347","0.0005","90","","94.993","0.001","90","","1761.84","0.11","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Bis(1,2,4,5-benzenetetracarboxylato)dihydroxytetraaquapentazinc(II) decahydrate","","- C20 H34 O32 Zn5 -","- C20 H34 O32 Zn5 -","- C40 H68 O64 Zn10 -","2","0.5","BT6349","Yang, Shi-Yao; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","On the number of uncoordinated water molecules in the open-framework coordination compound, bis(1,2,4,5-benzenetetracarboxylato)dihydroxytetraaquapentacobalt(II) <i>x</i>-hydrate, and the crystal structure of the isomorphous decahydrated zinc(II) analog","Acta Crystallographica Section E","2003","59","10","m921","m923","10.1107/S1600536803019895","","","0.71073","MoKα","","0.063","0.062","","","0.129","0.129","","","","","","1.27","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202380","13.1419","0.001","12.5844","0.0009","14.011","0.0011","90","","100.601","0.002","90","","2277.6","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2'-Benzoyl-1',2,2',3,4',5',6',6a'-octahydro-1H-indan-2-spiro-3'- (3'H-pyrrolizine)-1'-spiro-3''-1H-indoline-1,2'',3-trione","","- C29 H22 N2 O4 -","- C29 H22 N2 O4 -","- C116 H88 N8 O16 -","4","1","BT6350","P. R. Seshadri; S. Selvanayagam; D. Velmurugan; K. Ravikumar; A. R. Sureshbabu; R. Raghunathan","2'-Benzoyl-1',2,2',3,4',5',6',6a'-octahydro-1<i>H</i>-indan-2-spiro-3'-(3'<i>H</i>-pyrrolizine)-1'-spiro-3''-1<i>H</i>-indoline-1,2'',3-trione","Acta Crystallographica Section E","2003","59","10","o1559","o1561","10.1107/S1600536803020658","","","0.71073","MoKα","","0.0926","0.0599","","","0.1505","0.1709","","","","","","1.007","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202381","9.995","0.005","10.372","0.007","10.508","0.005","101.84","0.05","91.14","0.05","109.01","0.05","1003.6","1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","9, 17-Dioxa-1,3-dithiatetracyclo[18. 2. 2. 2^23, 24^. 1^25^] heptacosan-5, 7, 11,13, 15 (25), 18, 20, 23, 26 nonene","","- C23 H22 O2 S2 -","- C23 H22 O2 S2 -","- C46 H44 O4 S4 -","2","1","BT6351","P. G. Aravindan; D. Velmurugan; M. Dhanasekaran; P. Rajakumar","9,17-Dioxa-1,3-dithiatetracyclo[18.2.2.2^23,24^.1^25^]heptacosa-5,7,11,13,15-(25),18,20,23,26-nonene","Acta Crystallographica Section E","2003","59","11","o1677","o1679","10.1107/S1600536803020129","","","0.71073","MoKα","","0.1163","0.0415","","","0.1063","0.127","","","","","","1.015","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202382","9.4147","0.0008","9.6714","0.0008","11.1245","0.0009","85.336","0.001","70.235","0.001","84.351","0.002","947.37","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","C-halogen...π interaction: 4-Chloro-2-(9-ethylcarbazol-3-yl)quinoline-1(2H)- carbaldehyde.","","- C24 H19 Cl N2 O -","- C24 H19 Cl N2 O -","- C48 H38 Cl2 N4 O2 -","2","1","BT6352","P.G.Aravindan; S.Selvanayagam; D.Velmurugan; K.Ravikumar; N.Nagarajan; P.T.Perumal","C—Halogen···π interactions in 4-chloro-2-(9-ethylcarbazol-3-yl)-1,2-dihydroquinoline-1-carbaldehyde","Acta Crystallographica Section E","2003","59","10","o1564","o1566","10.1107/S1600536803020130","","","0.71073","MoKα","","0.0629","0.0487","","","0.1296","0.1407","","","","","","1.006","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202383","7.1791","0.0005","9.4033","0.0006","10.2886","0.0007","90","","90","","90","","694.55","0.08","298","2","298","2","","","","","","","","5","I m m m","-I 2 2","71","","catena-Poly[[[tetraaquacobalt(II)]-μ-pyrazine] phthalate]","","- C12 H16 Co N2 O8 -","- C12 H16 Co N2 O8 -","- C24 H32 Co2 N4 O16 -","2","0.125","BT6353","Yang, Shi-Yao; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","<i>catena</i>-Poly[[[tetraaquacobalt(II)]-μ-pyrazine] phthalate]","Acta Crystallographica Section E","2003","59","11","m961","m963","10.1107/S1600536803021573","","","0.71073","MoKα","","0.097","0.096","","","0.297","0.297","","","","","","1.23","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202384","14.3186","0.0011","9.6801","0.0007","17.9616","0.0013","90","","91.19","0.001","90","","2489","0.3","293","","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C31 H28 N2 O3 -","- C31 H28 N2 O3 -","- C124 H112 N8 O12 -","4","1","BT6354","M.M.Govind; S.Selvanayagam; D.Velmurugan; K.Ravikumar; Gowri Sridhar; R.Raghunathan","1<i>N</i>-Methyl-spiro[2-3']indan-1,3-dione-spiro[3-3'']-5''-benzylidene-<i>N</i>-methyl-piperidinone-4-phenylpyrrolidine","Acta Crystallographica Section E","2003","59","11","o1680","o1681","10.1107/S1600536803021135","","","0.71073","MoKα","","0.1272","0.066","","","0.1529","0.1856","","","","","","1.002","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202385","13.3866","0.0002","6.669","0.0001","22.7332","0.0004","90","","118.038","0.0007","90","","1791.32","0.05","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[N,N'-Ethylenebis(salicylideneiminato)]nickel(II) dimethylformamide solvate","","- C19 H21 N3 Ni O3 -","- C19 H21 N3 Ni O3 -","- C76 H84 N12 Ni4 O12 -","4","1","BT6355","Lutz, Martin","[<i>N</i>,<i>N</i>'-Ethylenebis(salicylideneiminato)]nickel(II) dimethylformamide solvate","Acta Crystallographica Section E","2003","59","10","m950","m952","10.1107/S1600536803020567","","","0.71073","MoKα","","0.04","0.027","","","0.073","0.08","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202386","9.8492","0.0002","12.774","0.0003","16.0631","0.0003","74.5472","0.0014","75.3838","0.0014","68.2566","0.0009","1782.47","0.07","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","Carbonyl[1-(2-pyridylmethyl)-1,4,7-triazacyclononane- κ^4^N](triphenylphosphine)ruthenium(II) dichloride dichloromethane sesquisolvate","","- C32.5 H38 Cl5 N4 O P Ru -","- C32.5 H38 Cl5 N4 O P Ru -","- C65 H76 Cl10 N8 O2 P2 Ru2 -","2","1","BT6356","Gott, Andrew L.; McGowan, Patrick C.; Thornton-Pett, Mark","Carbonyl[1-(2-pyridylmethyl)-1,4,7-triazacyclononane-κ^4^<i>N</i>](triphenylphosphine)ruthenium(II) dichloride dichloromethane sesquisolvate","Acta Crystallographica Section E","2003","59","11","m1015","m1017","10.1107/S160053680302258X","","","0.71073","MoKα","","0.0673","0.0445","","","0.093","0.1051","","","","","","1.081","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2202387","19.972","0.003","6.509","0.003","15.472","0.003","90","","106.874","0.013","90","","1924.7","1","122","2","122","2","","","","","","","","4","C 1 2 1","C 2y","5","Cinchonidinium (R,R)-tartrate","Cinchonidinium (R,R)-tartrate monohydrate","","- C42 H54 N4 O10 -","- C42 H54 N4 O10 -","- C84 H108 N8 O20 -","2","0.5","BT6357","Ryttersgaard, Carsten; Larsen, Sine","Cinchonidinium (<i>R,R</i>)-tartrate monohydrate","Acta Crystallographica Section E","2003","59","11","o1715","o1716","10.1107/S1600536803022438","","","1.5418","CuKα","","0.0298","0.0289","","0.0746","0.0736","","","","1.066","","","1.066","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2202388","7.211","0.002","10.157","0.003","11.35","0.003","105.39","0.02","90.76","0.02","109.85","0.02","749","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Tetraamminehexabromodiscandium(III)","","- Br6 H12 N4 Sc2 -","- Br6 H12 N4 Sc2 -","- Br12 H24 N8 Sc4 -","2","1","BT6359","Meyer, Gerd; Cesur, Nazife; Bremm, Stephan","Tetraamminehexabromodiscandium(III)","Acta Crystallographica Section E","2003","59","11","i142","i144","10.1107/S1600536803021524","","","0.71073","MoKα","","0.118","0.039","","","0.066","0.081","","","","","","0.7","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202389","7.392","0.002","9.578","0.002","9.551","0.002","73.07","0.02","80.04","0.02","77.82","0.02","627.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Diamminehexabromodiscandium(III)","","- Br6 H6 N2 Sc2 -","- Br6 H6 N2 Sc2 -","- Br12 H12 N4 Sc4 -","2","1","BT6360","Meyer, Gerd; Cesur, Nazife; Pantenburg, Ingo","Diamminehexabromodiscandium(III)","Acta Crystallographica Section E","2003","59","11","i145","i146","10.1107/S1600536803021536","","","0.71073","MoKα","","0.095","0.04","","","0.083","0.096","","","","","","0.789","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202390","11.642","0.001","12.2348","0.0011","13.5739","0.0013","104.761","0.005","90.427","0.004","93.727","0.005","1865.1","0.3","150","1","150","1","","","","","","","","4","P -1","-P 1","2","","Ethyl 4-cyclohexyl-7-(dicyanomethylene)tricyclo[4.2.1.0^2,5^]non-3-ene-3-carboxylate","","- C21 H24 N2 O2 -","- C21 H24 N2 O2 -","- C84 H96 N8 O8 -","4","2","BT6361","Lough, Alan J.; Jordan, Robert W.; Tam, William","Ethyl 4-cyclohexyl-7-(dicyanomethylene)tricyclo[4.2.1.0^2,5^]non-3-ene-3-carboxylate","Acta Crystallographica Section E","2003","59","11","o1675","o1676","10.1107/S1600536803021950","","","0.71073","MoKα","","0.1641","0.0643","","","0.1382","0.1795","","","","","","0.983","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202391","9.0239","0.0006","30.1204","0.0016","8.422","0.0005","90","","112.139","0.007","90","","2120.4","0.2","293","2","293","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Di-μ-iodo-bis[(acetonitrile-κN)(triphenylphosphite-κP)copper(I)]","","- C40 H36 Cu2 I2 N2 O6 P2 -","- C40 H36 Cu2 I2 N2 O6 P2 -","- C80 H72 Cu4 I4 N4 O12 P4 -","2","0.5","BT6362","Näther, Christian; Steinhoff, Tobias; Jeß, Inke","Di-μ-iodo-bis[(acetonitrile-κ<i>N</i>)(triphenylphosphite-κ<i>P</i>)copper(I)]","Acta Crystallographica Section E","2003","59","11","m1041","m1043","10.1107/S1600536803023304","","","0.71073","MoKα","","0.032","0.0259","","","0.0636","0.0656","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202392","16.2196","0.0004","18.2187","0.0004","10.0604","0.0002","90","","90","","90","","2972.85","0.11","150","1","150","1","","","","","","","","3","P c c n","-P 2ab 2ac","56","","Ethyl 7-oxo-4-phenyltricyclo[4.2.1.0^2,5^]non-3-ene-3-carboxylate","","- C18 H18 O3 -","- C18 H18 O3 -","- C144 H144 O24 -","8","1","BT6363","Tam, William; Lough, Alan J.; Jordan, Robert W.","Ethyl 7-oxo-4-phenyltricyclo[4.2.1.0^2,5^]non-3-ene-3-carboxylate","Acta Crystallographica Section E","2003","59","11","o1685","o1686","10.1107/S1600536803022244","","","0.71073","MoKα","","0.0628","0.0413","","","0.1008","0.1127","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202393","9.751","0.0014","5.592","0.0009","15.355","0.0018","90","","90.934","0.01","90","","837.2","0.2","150","1","150","1","","","","","","","","3","P 1 21 1","P 2yb","4","","Ethyl 7-exo-acetoxy-4-phenyltricyclo[4.2.1.0^2,5^]non-3-ene-3-carboxylate","","- C20 H22 O4 -","- C20 H22 O4 -","- C40 H44 O8 -","2","1","BT6364","Jordan, Robert W.; Tam, William; Lough, Alan J.","Ethyl 7-<i>exo</i>-acetoxy-4-phenyltricyclo[4.2.1.0^2,5^]non-3-ene-3-carboxylate","Acta Crystallographica Section E","2003","59","11","o1687","o1688","10.1107/S160053680302227X","","","0.71073","MoKα","","0.0804","0.0506","","","0.1245","0.1416","","","","","","1.053","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202394","11.4931","0.0008","13.6374","0.0009","15.5377","0.001","90","","96.351","0.001","90","","2420.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2'-(p-Methoxybenzoyl)-1',2,2',3,5',6',7',7a'-octahydro-1H-indan-2-spiro-3'- (3'H-pyrrolizine)-1'-spiro-3''-1H-indoline-1,2'',3-trione","","- C30 H24 N2 O5 -","- C30 H24 N2 O5 -","- C120 H96 N8 O20 -","4","1","BT6365","P. R. Seshadri; S. Selvanayagam; D. Velmurugan; K. Ravikumar; A. R. Sureshbabu; R. Raghunathan","2'-(<i>p</i>-Methoxybenzoyl)-1',2,2',3,5',6',7',7a'-octahydro-1<i>H</i>-indan-2-spiro-3'-(3'<i>H</i>-pyrrolizine)-1'-spiro-3''-1<i>H</i>-indoline-1,2'',3-trione","Acta Crystallographica Section E","2003","59","11","o1783","o1785","10.1107/S160053680302302X","","","0.71073","MoKα","","0.0786","0.0486","","","0.1224","0.1389","","","","","","0.995","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202395","7.1338","0.0013","13.981","0.003","9.467","0.0015","90","","90.614","0.005","90","","944.2","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl 6-bromo-2,3-dihydro-2-methylimidazo[2,1-b]oxazole-5-carboxylate","","- C8 H9 Br N2 O3 -","- C8 H9 Br N2 O3 -","- C32 H36 Br4 N8 O12 -","4","1","BT6366","Kraus, George A.; Choudhury, Prabir K.; Ellern, Arkady","Methyl 6-bromo-2,3-dihydro-2-methylimidazo[2,1-<i>b</i>]oxazole-5-carboxylate","Acta Crystallographica Section E","2003","59","11","o1735","o1737","10.1107/S1600536803023122","","","0.71073","MoKα","","0.0469","0.0402","","","0.1042","0.1071","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202396","8.5516","0.0015","10.2077","0.0017","9.392","0.003","90","","91.64","0.02","90","","819.5","0.3","298","","298","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C6 H8 N2 O5 -","- C6 H8 N2 O5 -","- C24 H32 N8 O20 -","4","1","BT6367","Takeo Fukunaga; Hiroyuki Ishida","Imidazolium hydrogen tartronate","Acta Crystallographica Section E","2003","59","12","o1869","o1871","10.1107/S1600536803024723","","","0.71073","MoKα","","0.066","0.065","","0.12","","0.12","","","1.01","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202397","13.0109","0.001","17.372","0.0014","7.8427","0.0006","90","","107.979","0.002","90","","1686.1","0.2","160","2","160","2","","","","","","","","5","C 1 m 1","C -2y","8","","catena-poly[[caesium(I)-μ-18-crown-6-caesium(I)-di-μ-2-amidopyridine] toluene]","","- C29 H42 Cs2 N4 O6 -","- C29 H42 Cs2 N4 O6 -","- C58 H84 Cs4 N8 O12 -","2","0.5","BT6368","Liddle, Stephen T.; Clegg, William","Polymeric (18-crown-6)bis(2-amidopyridinecaesium) toluene solvate","Acta Crystallographica Section E","2003","59","11","m1062","m1064","10.1107/S1600536803023821","","","0.71073","MoKα","","0.042","0.0284","","","0.06","0.065","","","","","","0.935","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202398","11.9109","0.0007","11.3292","0.0007","17.3573","0.001","90","","103.993","0.001","90","","2272.7","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2,3,4-Tetrahydro-4'-furfuryl-1'-methylnaphthene-2-spiro-3'-pyrrolidine-2'- spiro-1''-acenaphthene-1,2''-dione","","- C29 H23 N O3 -","- C29 H23 N O3 -","- C116 H92 N4 O12 -","4","1","BT6369","M. M. Govind; S. Selvanayagam; D. Velmurugan; K. Ravikumar; R. Rathna Durga; R. Raghunathan","1,2,3,4-Tetrahydro-4'-furfuryl-1'-methylnaphthalene-2-spiro-3'-pyrrolidine-2'-spiro-1''-acenaphthene-1,2''-dione","Acta Crystallographica Section E","2003","59","12","o1875","o1877","10.1107/S1600536803024711","","","0.71073","MoKα","","0.0807","0.0554","","","0.1642","0.1869","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202399","10.6889","0.0007","18.9025","0.0012","12.527","0.0008","90","","95.283","0.001","90","","2520.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5''-Benzylidene-1'-methyl-4'-phenylindole-3-spiro-2'-pyrrolidine-3'-spiro-3''- piperidine-2(3H),4''-dione","","- C30 H29 N3 O2 -","- C30 H29 N3 O2 -","- C120 H116 N12 O8 -","4","1","BT6370","M. M. Govind; S. Selvanayagam; D. Velmurugan; K. Ravikumar; Gowri Sridhar; R. Raghunathan","5''-Benzylidene-1'-methyl-4'-phenylindole-3-spiro-2'-pyrrolidine-3'-spiro-3''-piperidine-2(3<i>H</i>),4''-dione","Acta Crystallographica Section E","2003","59","12","o1878","o1880","10.1107/S1600536803024759","","","0.71073","MoKα","","0.0856","0.0526","","","0.13","0.148","","","","","","0.991","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202400","9.8106","0.0012","9.8106","0.0012","10.8547","0.0019","90","","90","","90","","1044.7","0.3","293","2","293","2","","","","","","","","5","P 4 n c","P 4 -2n","104","","Chlorotetrakis(2-methylimidazole)copper(II) chloride","","- C16 H24 Cl2 Cu N8 -","- C16 H24 Cl2 Cu N8 -","- C32 H48 Cl4 Cu2 N16 -","2","0.25","BT6371","Ana María Atria; .; Piedad Cortés; .; María Teresa Garland; .; Ricardo Baggio; .","[Cu(2-Me-imidH)~4~Cl]Cl: a conflict between high symmetry and packing efficiency","Acta Crystallographica Section E","2003","59","11","m1075","m1077","10.1107/S1600536803024553","","","0.71073","MoKα","","0.062","0.0408","","","0.0786","0.0853","","","","","","0.927","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202401","7.0177","0.0005","8.3138","0.0006","11.3906","0.0008","107.128","0.001","99.039","0.001","102.748","0.001","601.6","0.07","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C7 H15 N Ni O10 -","- C7 H15 N Ni O10 -","- C14 H30 N2 Ni2 O20 -","2","1","BT6372","Shiu, Kom-Bei; Chen, Zheng-Wei; Liao, Fen-Ling; Wang, Sue-Lein","<i>cis</i>-Tetraaqua(η^2^-pyridine-2,5-dicarboxylato-κ^2^<i>O,N</i>)nickel(II) dihydrate","Acta Crystallographica Section E","2003","59","11","m1072","m1074","10.1107/S1600536803024383","","","0.71073","MoKα","","0.0507","0.0281","","","0.0518","0.0538","","","","","","0.817","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202402","11.749","0.001","7.498","0.002","21.028","0.003","90","","90","","90","","1852.4","0.6","298","2","298","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","N,N'-bis(2-pyridylmethyl)pyromellitic diimide","","- C22 H14 N4 O4 -","- C22 H14 N4 O4 -","- C88 H56 N16 O16 -","4","1","BT6373","Lü, Xingqiang; Zhang, Li; Chen, Chunlong; Su, Chengyong; Kang, Beisheng; Ng, Seik Weng","<i>N,N</i>'-Bis(2-pyridylmethyl)pyromellitic diimide","Acta Crystallographica Section E","2003","59","12","o1891","o1893","10.1107/S1600536803024930","","","0.71073","MoKα","","0.05","0.033","","","0.08","0.091","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202403","9.8457","0.0009","5.7677","0.0013","14.5035","0.0012","90","","95.178","0.007","90","","820.2","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","L-argininium bis(trifluoroacetate)","","- C10 H16 F6 N4 O6 -","- C10 H16 F6 N4 O6 -","- C20 H32 F12 N8 O12 -","2","1","BT6374","Ramos Silva, Manuela; Paixão, Jose A.; Matos Beja, Ana","<small>L</small>-Argininium bis(trifluoroacetate)","Acta Crystallographica Section E","2003","59","12","o1912","o1914","10.1107/S1600536803025169","","","0.71073","MoKα","","0.0765","0.0444","","","0.115","0.1339","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202404","29.425","0.005","9.2613","0.0014","13.69","0.002","90","","90","","90","","3730.7","1","293","2","293","2","","","","","","","","6","F d d 2","F 2 -2d","43","","Hexaaquabis(dicyanoguanidine)terbium(III) trichloride","","- C4 H20 Cl3 N8 O6 Tb -","- C4 H20 Cl3 N8 O6 Tb -","- C32 H160 Cl24 N64 O48 Tb8 -","8","0.5","BT6375","Liao, Wuping; Hu, Chunhua; Dronskowski, Richard","Hexaaquabis(dicyanoguanidine)terbium(III) trichloride","Acta Crystallographica Section E","2003","59","12","m1124","m1126","10.1107/S1600536803025509","","","0.71073","MoKα","","0.0237","0.0222","","","0.0541","0.0548","","","","","","1.104","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202405","9.2875","0.0007","12.3181","0.0009","18.9028","0.0013","90","","90","","90","","2162.6","0.3","160","2","160","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","tert-Butyl (2R)-2-(9H-Fluoren-9-ylmethoxycarbonylamino)-3-iodopropionate","","- C22 H24 I N O4 -","- C22 H24 I N O4 -","- C88 H96 I4 N4 O16 -","4","1","BT6377","Clegg, William; Horsburgh, Lynne","<i>tert</i>-Butyl (2<i>R</i>)-2-(9<i>H</i>-Fluoren-9-ylmethoxycarbonylamino)-3-iodopropionate","Acta Crystallographica Section E","2003","59","12","o1925","o1926","10.1107/S1600536803025467","","","0.71073","MoKα","","0.0338","0.0259","","","0.0489","0.0508","","","","","","0.979","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202406","7.761","0.0006","11.6696","0.001","11.9952","0.0009","93.392","0.002","91.092","0.001","93.66","0.001","1081.98","0.15","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-Methyl-4'-(3-nitrophenyl)-1H-indole-3-spiro-2'-pyrrolidine-3'- spiro-2''-indan-2,1'',3''-trione","","- C26 H19 N3 O5 -","- C26 H19 N3 O5 -","- C52 H38 N6 O10 -","2","1","BT6378","P.R.Seshadri; S.Selvanayagam; D.Velmurugan; K.Ravikumar; A.R.Sureshbabu; R.Raghunathan","1-Methyl-4'-(3-nitrophenyl)-1<i>H</i>-indole-3-spiro-2'-pyrrolidine-3'-spiro-2''-indan-2,1'',3''-trione","Acta Crystallographica Section E","2003","59","12","o2025","o2027","10.1107/S1600536803026345","","","0.71073","MoKα","","0.0711","0.0519","","","0.1465","0.1627","","","","","","1.014","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202407","5.4266","0.0008","7.2419","0.0012","12.445","0.002","90","","90","","90","","489.07","0.13","133","2","133","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C4 H5 N O3 -","- C4 H5 N O3 -","- C16 H20 N4 O12 -","4","1","BT6380","Jones, Peter G.","<i>N</i>-Hydroxysuccinimide","Acta Crystallographica Section E","2003","59","12","o1951","o1952","10.1107/S1600536803025704","","","0.71073","MoKα","","0.0439","0.0409","","","0.1056","0.1085","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202408","7.5052","0.0005","13.2537","0.0009","27.9439","0.0018","90","","93.175","0.001","90","","2775.4","0.3","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C16 H40 Cl2 Cu2 Mo N2 S4 -","- C16 H40 Cl2 Cu2 Mo N2 S4 -","- C64 H160 Cl8 Cu8 Mo4 N8 S16 -","4","1","BT6381","Hosaini Sadr, Moayad; Razmi, Habib; Brooks, Neil R.; Clegg, William","Bis(tetraethylammonium) μ-tetrathiomolybdato(VI)-bis[chlorocopper(I)]","Acta Crystallographica Section E","2003","59","12","m1134","m1136","10.1107/S1600536803025807","","","0.71073","MoKα","","0.0584","0.0326","","","0.0628","0.0705","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202409","12.1419","0.0011","5.3779","0.0006","24.926","0.002","90","","98.435","0.01","90","","1610","0.3","160","2","160","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(2S)-2-(9H-Fluoren-9-ylmethoxycarbonylamino)-3-(3',4'-dimethoxyphenyl)propionic acid tert-butyl ester chloroform sesquisolvate","","- C31.5 H34.5 Cl4.5 N O6 -","- C30 H33 N O6 -","- C60 H66 N2 O12 -","2","1","BT6382","Clegg, William; Elsegood, Mark R. J.","<i>tert</i>-Butyl (2<i>S</i>)-2-(9<i>H</i>-fluoren-9-ylmethoxycarbonylamino)-3-(3',4'-dimethoxyphenyl)propionate chloroform sesquisolvate","Acta Crystallographica Section E","2003","59","12","o1946","o1948","10.1107/S1600536803025819","","","1.54184","CuKα","","0.0604","0.0531","","","0.1382","0.1531","","","","","","1.138","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202410","10.2463","0.0004","16.1386","0.0009","24.5021","0.0013","90","","90","","90","","4051.7","0.3","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Pentacarbonyl[diphenyl(perfluorovinyl)phosphine]molybdenum(0)","","- C19 H10 F3 Mo O5 P -","- C19 H10 F3 Mo O5 P -","- C152 H80 F24 Mo8 O40 P8 -","8","1","BT6384","Peters, R. Gregory; Palcic, Jason D.; Baughman, Russell G.","Pentacarbonyl[diphenyl(perfluorovinyl)phosphine]molybdenum(0)","Acta Crystallographica Section E","2003","59","12","m1198","m1200","10.1107/S1600536803026333","","","0.71073","MoKα","","0.0542","0.0342","","0.0854","","0.0767","","","1.032","","","1.091","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202411","9.1813","0.001","10.7862","0.0012","12.7242","0.0014","90","","90","","90","","1260.1","0.2","160","2","160","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-tert-Butyl 2-methyl 4-(R)-hydroxypyrrolidine-1,2-(2S)-dicarboxylate","","- C11 H19 N O5 -","- C11 H19 N O5 -","- C44 H76 N4 O20 -","4","1","BT6386","Clegg, William; Deboves, Hervé J. C.; Elsegood, Mark R. J.","1-<i>tert</i>-Butyl 2-methyl 4-(<i>R</i>)-hydroxypyrrolidine-1,2-(2<i>S</i>)-dicarboxylate","Acta Crystallographica Section E","2003","59","12","o1987","o1989","10.1107/S1600536803026412","","","0.71073","MoKα","","0.038","0.03","","","0.074","0.075","","","","","","1.013","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202412","6.5281","0.0011","7.2358","0.0018","14.627","0.004","92.73","0.02","96.274","0.018","102.803","0.016","667.9","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H30 Co O22 S2 -","- C14 H30 Co O22 S2 -","- C14 H30 Co O22 S2 -","1","0.5","CF6251","Jian-Fang Ma; Jin Yang; Jing-Fu Liu","Hexaaquacobalt(II) 3-carboxy-4-hydroxybenzenesulfonate tetrahydrate","Acta Crystallographica Section E","2003","59","7","m481","m482","10.1107/S1600536803013060","","","0.71073","MoKα","","0.0485","0.0413","","","0.115","0.1183","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202413","7.0298","0.0009","7.0749","0.0015","13.288","0.004","92.16","0.02","90.259","0.018","112.236","0.012","611.2","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H26 Cu O20 S2 -","- C14 H26 Cu O20 S2 -","- C14 H26 Cu O20 S2 -","1","0.5","CF6252","Jian-Fang Ma; Jin Yang; Jing-Fu Liu","Hexaaquacopper(II) 3-carboxy-4-hydroxybenzenesulfonate dihydrate","Acta Crystallographica Section E","2003","59","7","m485","m486","10.1107/S1600536803013084","","","0.71073","MoKα","","0.0362","0.0322","","","0.0911","0.0926","","","","","","1.101","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202414","7.0608","0.0019","7.1535","0.0019","13.836","0.003","90.49","0.02","90.49","0.02","119.118","0.017","610.4","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H26 Mn O20 S2 -","- C14 H26 Mn O20 S2 -","- C14 H26 Mn O20 S2 -","1","0.5","CF6253","Jian-Fang Ma; Jin Yang; Jing-Fu Liu","Hexaaquamanganese(II) 3-carboxy-4-hydroxybenzenesulfonate dihydrate","Acta Crystallographica Section E","2003","59","7","m478","m480","10.1107/S1600536803013059","","","0.71073","MoKα","","0.0394","0.031","","","0.0858","0.0894","","","","","","1.043","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202415","6.538","0.0009","7.2199","0.001","14.534","0.004","92.931","0.016","96.494","0.016","102.727","0.012","662.9","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H30 Ni O22 S2 -","- C14 H30 Ni O22 S2 -","- C14 H30 Ni O22 S2 -","1","0.5","CF6254","Jian-Fang Ma; Jin Yang; Jing-Fu Liu","Hexaaquanickel(II) 3-carboxy-4-hydroxybenzenesulfonate tetrahydrate","Acta Crystallographica Section E","2003","59","7","m483","m484","10.1107/S1600536803013072","","","0.71073","MoKα","","0.0463","0.0377","","","0.0977","0.101","","","","","","1.086","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202416","6.5367","0.0014","7.2555","0.0018","14.616","0.004","92.83","0.02","96.321","0.019","102.839","0.017","669.8","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H30 O22 S2 Zn -","- C14 H30 O22 S2 Zn -","- C14 H30 O22 S2 Zn -","1","0.5","CF6255","Jian-Fang Ma; Jin Yang; Jing-Fu Liu","Hexaaquazinc(II) 3-carboxy-4-hydroxybenzenesulfonate tetrahydrate","Acta Crystallographica Section E","2003","59","7","m487","m488","10.1107/S1600536803013096","","","0.71073","MoKα","","0.0426","0.0334","","","0.0851","0.0878","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202417","7.0388","0.0002","7.0388","0.0002","30.0684","0.0008","90","","90","","90","","1489.73","0.07","180","2","180","2","","","","","","","","3","P 43 21 2","P 4nw 2abw","96","","(R)-(+)-2,2'-Diamino-1,1'-binaphthalene","","- C20 H16 N2 -","- C20 H16 N2 -","- C80 H64 N8 -","4","0.5","CF6256","Jones, Matthew D.; Almeida Paz, Filipe A.; Davies, John E.; Johnson, Brian F. G.","(<i>R</i>)-(+)-2,2'-Diamino-1,1'-binaphthyl","Acta Crystallographica Section E","2003","59","7","o910","o912","10.1107/S1600536803011681","","","0.71073","MoKα","","0.0428","0.0365","","","0.0952","0.0999","","","","","","1.015","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202418","7.3537","0.0008","5.5149","0.0008","19.29","0.002","90","","100.928","0.009","90","","768.12","0.16","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","1-(2',3'-Anhydro-5'-O-benzoyl-β-D-lyxofuranoyl)-5-fluorouracil","","- C16 H13 F N2 O6 -","- C16 H13 F N2 O6 -","- C32 H26 F2 N4 O12 -","2","1","CF6257","Wagner, Timothy R.; Gadikota, Rajendrakumar Reddy; Callam, Christopher S.; Lowary, Todd L.","1-(2',3'-Anhydro-5'-<i>O</i>-benzoyl-β-<small>D</small>-lyxofuransoyl)-5-fluorouracil","Acta Crystallographica Section E","2003","59","7","o1063","o1065","10.1107/S1600536803012352","","","0.71073","MoKα","","0.1066","0.0519","","","0.1146","0.1511","","","","","","1.052","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202419","26.822","0.004","7.758","0.002","6.079","0.003","90","","94.03","0.01","90","","1261.8","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-(4-dimethylaminophenylethenyl)pyridine N-oxide","","- C15 H16 N2 O -","- C15 H16 N2 O -","- C60 H64 N8 O4 -","4","1","CF6258","Ivashevskaja, Svetlana N.; Aleshina, Lyudmila A.; Andreev, Vladimir P.; Nizhnik, Yakov P.; Chernyshev, Vladimir V.; Schenk, Hendrik","4-(4'-Dimethylaminostyryl)pyridine <i>N</i>-oxide from powder data","Acta Crystallographica Section E","2003","59","7","o1006","o1008","10.1107/S1600536803012340","","","1.54056","CuKα~1~","","","","","","","","","","1.5","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202420","24.281","0.003","17.339","0.002","17.715","0.002","90","","103.63","0.01","90","","7248.1","1.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Aqua(5,17-dihydroxy-11,23-dimethylbicyclo[18.3.1.1^9,13^]hexacosa- 1(25),2,7,9,11,13(26),21,23-octaene-25,26-diolato)dinitrato-κ^2^O,O';κO- gadolinium nitrate‒methanol‒water (1/0.5/1.75)","","- C24.5 H35.5 Gd N7 O16.25 -","- C24.5 H35.5 Gd N7 O16.25 -","- C196 H284 Gd8 N56 O130 -","8","1","CF6259","Hu, Xue-Lei; Li, Yi-Zhi; Luo, Qin-Hui; Mei, Guang-Quan; Wang, Zhi-Lin","Aqua[5,17-dihydroxy-11,23-dimethylbicyclo[18.3.1.1^9,13^]hexacosa-1(25),2,7,9,11,13(26),21,23-octaene-25,26-diolato]dinitrato-κ^2^<i>O,O</i>';κ<i>O</i>-gadolinium nitrate‒methanol‒water (1/0.5/1.75)","Acta Crystallographica Section E","2003","59","7","m491","m493","10.1107/S1600536803013114","","","0.71073","MoKα","","0.0582","0.0432","","","0.1126","0.1181","","","","","","1.083","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202421","9.3372","0.0001","12.8346","0.0003","13.0991","0.0003","90","","103.316","0.001","90","","1527.58","0.05","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Di-μ-iodo-bis{[methyltris(methylthiomethyl)silane-κ^2^S,S']copper(I)}","","- C14 H36 Cu2 I2 S6 Si2 -","- C14 H36 Cu2 I2 S6 Si2 -","- C28 H72 Cu4 I4 S12 Si4 -","2","0.5","CF6260","Yim, Hing W.; Rabinovich, Daniel; Lam, Kin-Chung; Golen, James A.; Rheingold, Arnold L.","Di-μ-iodo-bis{[methyltris(methylthiomethyl)silane-κ^2^<i>S,S</i>']copper(I)}","Acta Crystallographica Section E","2003","59","8","m556","m558","10.1107/S1600536803012947","","","0.71073","MoKα","","0.0565","0.042","","","0.0817","0.09","","","","","","1.277","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202422","13.2543","0.0015","5.9923","0.0007","14.5744","0.0017","90","","101.633","0.002","90","","1133.8","0.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","5,8-Dimethoxy-3-methyl-1H-isochroman","","- C12 H16 O3 -","- C12 H16 O3 -","- C48 H64 O12 -","4","1","CF6261","de Koning, Charles B.; Fernandes, Manuel A.; Li, Lap K.; Michael, Joseph P.; van Otterlo, Willem A. L.","5,8-Dimethoxy-3-methylisochroman","Acta Crystallographica Section E","2003","59","7","o992","o993","10.1107/S1600536803013151","","","0.71073","MoKα","","0.0824","0.0556","","","","0.1788","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202423","9.236","0.005","9.62","0.005","10.887","0.005","69.897","0.005","87.328","0.005","69.501","0.005","847.9","0.7","120","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C19 H16 Cl N O4 -","- C19 H16 Cl N O4 -","- C38 H32 Cl2 N2 O8 -","2","1","CF6262","Philip J. Cox; Pamela L. Manson","γ-Indomethacin at 120K","Acta Crystallographica Section E","2003","59","7","o986","o988","10.1107/S160053680301290X","","","0.71073","MoKα","","","0.0443","","","","0.1047","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202424","35.327","0.005","5.618","0.001","6.682","0.001","90","","101.554","0.005","90","","1299.3","0.4","120","2","","","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C15 H10 O6 -","- C15 H10 O6 -","- C60 H40 O24 -","4","1","CF6263","Philip J. Cox; Yashodharan Kumarasamy; Lutfun Nahar; Satyajit D. Sarker; Mohammad Shoeb","Luteolin","Acta Crystallographica Section E","2003","59","7","o975","o977","10.1107/S1600536803013229","","","0.71073","MoKα","","","0.0925","","","","0.1896","","","","","","1.178","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202425","6.7813","0.0001","10.0636","0.0002","12.9753","0.0003","76.7537","0.0007","75.6074","0.0007","74.3971","0.0013","813.5","0.03","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C6 H20 N2 O12 S2 U -","- C6 H20 N2 O12 S2 U -","- C12 H40 N4 O24 S4 U2 -","2","1","CF6264","Doran, Michael B.; Norquist, Alexander J.; O'Hare, Dermot","<i>catena</i>-Poly[cyclohexane-1,4-diammonium [[dioxo(sulfato-κ^2^<i>O,O</i>')uranium(VI)]-μ-sulfato] dihydrate]","Acta Crystallographica Section E","2003","59","9","m765","m767","10.1107/S1600536803015836","","","0.71073","MoKα","","","0.0201","","","","0.047","","","","","","0.866","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2202426","12.456","0.004","8.0362","0.0011","13.533","0.003","90","","112.86","0.02","90","","1248.2","0.5","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C13 H18 O2 -","- C13 H18 O2 -","- C52 H72 O8 -","4","2","CF6266","Hansen, Lars Kr.; Perlovich, German L.; Bauer-Brandl, Annette","Redetermination and H-atom refinement of (<i>S</i>)-(+)-ibuprofen","Acta Crystallographica Section E","2003","59","9","o1357","o1358","10.1107/S160053680301451X","","","0.71069","MoKα","","0.079","0.0385","","","0.0915","0.105","","","","","","0.982","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202427","14.1283","0.0015","9.023","0.001","10.3639","0.0011","90","","111.474","0.001","90","","1229.5","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Potassium Benzilate","Potassium α‒Hydroxy‒α‒phenylbenzeneacetate","","- C14 H11 K O3 -","- C14 H11 K O3 -","- C56 H44 K4 O12 -","4","1","CF6267","Loguard S. Rojas; Belkis M. Ramírez; Asiloé J. Mora; Gerzon E. Delgado; Graciela Díaz de Delgado","Redetermination of potassium benzilate","Acta Crystallographica Section E","2003","59","8","m647","m651","10.1107/S1600536803015915","","","0.71073","MoKα","","0.0576","0.0426","","","0.113","0.1195","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202428","8.939","0.0004","15.222","0.0004","16.81","0.0006","115.747","0.0019","97.316","0.002","96.671","0.002","2005.47","0.13","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H29 Cl4 N5 O2 Zn -","- C50 H29 Cl4 N5 O2 Zn -","- C100 H58 Cl8 N10 O4 Zn2 -","2","1","CF6268","Mikki Vinodu; Israel Goldberg","A low-temperature polymorph of [5,10,15,20-<i>meso</i>-tetrakis(4-chlorophenyl)porphyrinato-κ^4^<i>N</i>]zinc(II) nitrobenzene clathrate","Acta Crystallographica Section E","2003","59","8","m565","m567","10.1107/S1600536803014752","","","0.71073","MoKα","","0.1058","0.0533","","","0.1097","0.1338","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202429","3.6831","0.0003","16.4717","0.0014","6.0485","0.0004","90","","90.229","0.005","90","","366.94","0.05","120","2","","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","","","- C8 H6 O5 -","- C8 H6 O5 -","- C16 H12 O10 -","2","0.5","CF6269","Philip J Cox; Marion T. Murphy","Disordered 4-hydroxyisophthalic acid","Acta Crystallographica Section E","2003","59","8","o1108","o1110","10.1107/S1600536803014740","","","0.71073","MoKα","","","0.0842","","","","0.2145","","","","","","1.003","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202430","11.9806","0.0001","12.2749","0.0001","14.7679","0.0002","90","","91.561","0.004","90","","2170.97","0.04","120","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H26 Cl N O5 -","- C23 H26 Cl N O5 -","- C92 H104 Cl4 N4 O20 -","4","1","CF6270","Philip J. Cox; Pamela L. Manson","Indomethacin <i>tert</i>-butanol solvate at 120K","Acta Crystallographica Section E","2003","59","8","o1189","o1191","10.1107/S160053680301506X","","","0.71073","MoKα","","","0.0363","","","","0.0915","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202431","11.97","0.002","12.27","0.003","12.758","0.003","90","","90","","90","","1873.8","0.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H26 O3 P Rh -","- C16 H26 O3 P Rh -","- C64 H104 O12 P4 Rh4 -","4","1","CF6271","Edgar Ocando-Mavarez; Julián Ascanio; Teresa González; Reinaldo Atencio; Merlín Rosales","(Acetylacetonato)carbonyl[diallyl(<i>tert</i>-butyl)phosphine]rhodium(I)","Acta Crystallographica Section E","2003","59","8","m633","m635","10.1107/S1600536803015691","","","0.71073","MoKα","","0.0264","0.0216","","","0.0471","0.0487","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202432","6.4106","0.0003","11.4036","0.0006","11.5775","0.0006","90","","103.64","0.001","90","","822.49","0.07","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H18 Cl4 Mn N8 O4 -","- C4 H18 Cl4 Mn N8 O4 -","- C8 H36 Cl8 Mn2 N16 O8 -","2","0.5","CF6272","Bremner, Colin A.; Harrison, William T. A.","Bis(1-carbamoylguanidinium) diaquatetrachloromanganate(II)","Acta Crystallographica Section E","2003","59","8","m596","m598","10.1107/S160053680301523X","","","0.71073","MoKα","","0.05","0.0311","","","0.0719","0.0779","","","","","","0.946","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202433","9.353","0.004","10.558","0.003","12.794","0.004","100.26","0.03","107.64","0.03","97.33","0.03","1162.3","0.8","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","[Na1,2-bis[{3-(2-pyridyl)-pyrazol-1-yl}methyl]benzene][ClO~4~]","","- C24 H20 Cl N6 Na O4 -","- C24 H20 Cl N6 Na O4 -","- C48 H40 Cl2 N12 Na2 O8 -","2","1","CF6273","Zoe R. Bell; Michael D. Ward","(1,2-Bis{[3-(2-pyridyl)pyrazol-1-yl]methyl}benzene)perchloratosodium","Acta Crystallographica Section E","2003","59","9","m787","m789","10.1107/S160053680301554X","","","0.71073","MoKα","","0.0696","0.0417","","","0.1013","0.1117","","","","","","1.012","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202434","7.445","0.005","8.79","0.006","12.549","0.007","89.28","0.04","87.08","0.05","68.74","0.04","764.3","0.9","220","2","150","2","","","","","","","","5","P -1","-P 1","2","","2-(2,4-Dichlorophenoxy)-N-(4,6-dimethylpyridin-2-yl)acetamide","","- C15 H14 Cl2 N2 O2 -","- C15 H14 Cl2 N2 O2 -","- C30 H28 Cl4 N4 O4 -","2","1","CF6274","Daniel E. Lynch; Sanjeev Bagga; Simon Parsons","2-(2,4-Dichlorophenoxy)-<i>N</i>-(4,6-dimethylpyridin-2-yl)acetamide","Acta Crystallographica Section E","2003","59","9","o1299","o1300","10.1107/S1600536803016350","","","0.71073","MoKα","","0.055","0.0393","","","0.1005","0.1092","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202435","8.2512","0.0008","9.5494","0.0009","17.1248","0.0017","90","","90","","90","","1349.3","0.2","150","2","150","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","Bis(benzimidazol-2-ylmethyl)amine","","- C16 H15 N5 -","- C16 H15 N5 -","- C64 H60 N20 -","4","0.5","CF6275","Tarazon Navarro, Ana; McKee, Vickie","Redetermination of bis(benzimidazol-2-ylmethyl)amine","Acta Crystallographica Section E","2003","59","8","o1199","o1201","10.1107/S1600536803016349","","","0.71073","MoKα","","0.0404","0.0343","","","0.0791","0.0837","","","","","","1.061","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202436","6.7852","0.001","7.829","0.002","17.55","0.003","90","","95.894","0.01","90","","927.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H28 N6 O2 -","- C16 H28 N6 O2 -","- C32 H56 N12 O4 -","2","0.5","CF6276","Çoruh, Ufuk; Ustabaş, Reşat; Sancak, Kemal; Şaşmaz, Selami; Ag̃ar, Erbil; Youngme Kim","Octane-1,8-diylbis[3-ethyl-1<i>H</i>-1,2,4-triazol-5(4<i>H</i>)-one]","Acta Crystallographica Section E","2003","59","9","o1277","o1279","10.1107/S1600536803016726","","","0.71073","MoKα","","0.0928","0.0457","","","0.1168","0.1361","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202437","13.1677","0.0018","8.5716","0.0012","13.8499","0.0019","90","","117.024","0.002","90","","1392.5","0.3","293","2","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Tetra-μ-acetato-bis[aquacopper(II)]","","- C8 H16 Cu2 O10 -","- C8 H16 Cu2 O10 -","- C32 H64 Cu8 O40 -","4","0.5","CF6277","Ferguson, George; Glidewell, Christopher","The compound described as tetra-μ-nitroaminato-bis[aquacopper(II)] is tetra-μ-acetato-bis[aquacopper(II)]","Acta Crystallographica Section E","2003","59","9","m710","m712","10.1107/S1600536803017331","","","0.71073","MoKα","","0.0579","0.0478","","","0.0937","0.0958","","","","","","1.356","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202438","27.976","0.005","13.333","0.003","14.07","0.003","90","","97.896","0.003","90","","5198.4","1.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Hexaaquanickel(II) dichromate bis(hexamethylenetetramine) monohydrate","","- C12 H38 Cr2 N8 Ni O14 -","- C12 H38 Cr2 N8 Ni O14 -","- C96 H304 Cr16 N64 Ni8 O112 -","8","2","CF6280","Dagur, Pritesh; Chopra,Deepak; Prakash, A. S.; Guru Row, T. N.; Hegde, M. S.","Hexaaquanickel(II) dichromate bis(hexamethylenetetramine) monohydrate","Acta Crystallographica Section E","2003","59","12","m1129","m1130","10.1107/S1600536803024875","","","0.71073","MoKα","","0.0624","0.0483","","","0.1229","0.1304","","","","","","1.339","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2202439","10.535","0.002","11.624","0.003","8.148","0.002","90","","109.69","0.03","90","","939.5","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C10 H6 N2 O4 -","- C10 H6 N2 O4 -","- C40 H24 N8 O16 -","4","0.5","CF6281","Moreno-Fuquen, Rodolfo; Valencia, Hoover; Abonia, Rodrigo; Kennedy, Alan R.; Graham Duncan","<i>p</i>-Nitrophenylmaleimide","Acta Crystallographica Section E","2003","59","11","o1717","o1718","10.1107/S1600536803022426","","","0.71073","MoKα","","0.0344","0.0302","","","0.0815","0.0845","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202440","8.0474","0.0007","8.0474","0.0007","25.518","0.003","90","","90","","90","","1652.6","0.3","296","1","296","1","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","dichloro[(6R,7S,8S,14R)-(-)-α-isosparteine-κ^2^N,N']zinc(II)","dichloro[(6R,7S,8R,14S)-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-κ^2^N,N']zinc(II)","","- C15 H26 Cl2 N2 Zn -","- C15 H26 Cl2 N2 Zn -","- C60 H104 Cl8 N8 Zn4 -","4","0.5","CF6282","Alcántara-Flores, José Luis; Bernès, Sylvain; Reyes-Ortega, Yasmi; Zamorano-Ulloa, Rafael","Dichloro[(6<i>R</i>,7<i>S</i>,8<i>S</i>,14<i>R</i>)-({-})-α-isosparteine-κ^2^<i>N,N</i>']zinc(II)","Acta Crystallographica Section E","2003","59","11","m988","m990","10.1107/S1600536803022414","","","0.71073","MoKα","","0.047","0.0318","","","0.0603","0.065","","","","","","1.111","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202441","9.451","0.002","15.294","0.004","17.049","0.004","90","","98.47","0.02","90","","2437.4","1","293","","20","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H35 Cl2 Co N5 O8 -","- C15 H35 Cl2 Co N5 O8 -","- C60 H140 Cl8 Co4 N20 O32 -","4","1","CF6283","Feng Zhang; Jian-Rong Zhang; Dao-Li Deng; Ronald Hage","(1,4,7,10,13-Pentamethyl-1,4,7,10,13-pentaazacyclopentadecane-κ^5^<i>N</i>)cobalt(II) perchlorate","Acta Crystallographica Section E","2003","59","12","m1099","m1101","10.1107/S1600536803025030","","","0.7107","MoKα","","","0.052","","","","0.061","","","","","","1.75","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202442","8.547","0.005","9.431","0.006","10.222","0.006","96.143","0.01","94.232","0.009","103.217","0.009","793.4","0.8","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Trans-bis{2-[(3-cyclohexylaminopropylimino)methyl]}cobalt(III) chlorate","","- C32 H46 Cl Co N4 O6 -","- C32 H46 Cl Co N4 O6 -","- C32 H46 Cl Co N4 O6 -","1","0.5","CF6284","You, Zhong-Lu; Qu, Yang; Liu, Wei-Sheng; Tan, Min-Yu; Zhu, Hai-Liang","<i>trans</i>-Bis{2-[3-(cyclohexylamino)propyliminomethyl]phenolato-κ^3^<i>O,N,N</i>'}cobalt(III) perchlorate","Acta Crystallographica Section E","2003","59","11","m1038","m1040","10.1107/S1600536803023092","","","0.71073","MoKα","","0.1012","0.0658","","","0.1355","0.1492","","","","","","0.897","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202443","9.7238","0.0003","5.6312","0.0002","16.2836","0.0005","90","","92.0137","0.0014","90","","891.08","0.05","190","","190","","","","","","","","","4","P 1 21 1","P 2yb","4","","isopropyl 6-amino-2,5-anhydro-3,6-dideoxy-6-N-(2,5-anhydro-6- azido-3,6-dideoxy-L-arabino-hexonyl)-L-arabino-hexonate","","- C15 H24 N4 O7 -","- C15 H24 N4 O7 -","- C30 H48 N8 O14 -","2","1","CF6285","Cooper, Richard I.; Edwards, Alison, A.; Fleet, George W. J.; Watkin, David J.","Isopropyl 6-amino-2,5-anhydro-3,6-dideoxy-6-<i>N</i>-(2,5-anhydro-6-azido-3,6-dideoxy-<small>L</small>-<i>arabino</i>-hexonyl)-<small>L</small>-<i>arabino</i>-hexonate","Acta Crystallographica Section E","2003","59","11","o1712","o1714","10.1107/S1600536803022451","","","0.71073","MoKα","","0.0542","0.0542","","0.1059","0.1059","0.1059","","","","","","0.9472","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202444","9.562","0.001","20.489","0.001","18.303","0.001","90","","95.95","0.01","90","","3566.5","0.5","83","2","83","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","tris(pentafluorophenyl)phosphine oxide","","","- C18 F15 O P -","- C18 F15 O P -","- C144 F120 O8 P8 -","8","2","CF6286","Nicholson, Brian K.; Thwaite, Susanna E.","Tris(pentafluorophenyl)phosphine oxide","Acta Crystallographica Section E","2003","59","11","o1700","o1701","10.1107/S1600536803022463","","","0.71073","MoKα","","0.0658","0.0399","","","0.0842","0.096","","","","","","1.026","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202445","10.449","0.0008","12.0126","0.0008","9.2196","0.0009","111.068","0.006","94.851","0.007","86.328","0.006","1075.31","0.16","298.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C21 H20 F3 N3 O5 S -","- C21 H20 F3 N3 O5 S -","- C42 H40 F6 N6 O10 S2 -","2","1","CF6287","K. Vyas; A. Sivalakshmidevi; S. K. Singh; Y. Koteswar Rao; G. Om Reddy","5-[5-(4-Methoxyphenyl)-3-trifluoromethyl-1<i>H</i>-pyrazol-1-yl]-2-sulfamoylbenzyl propionate: a novel 1,5-diraylpyrazole class of COX-2 inhibitor","Acta Crystallographica Section E","2003","59","11","o1731","o1732","10.1107/S160053680302275X","","","1.5418","CuKα","","","0.058","","","","0.088","","","","","","1.037","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202446","7.3092","0.0001","12.9075","0.0002","26.3277","0.0006","90","","90","","90","","2483.85","0.08","180","2","180","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","trans-Bis[(S)-(-)-2-aminomethyl-1-ethylpyrrolidine-κ^2^N]palladium(II) dichloride methanol trisolvate","","- C17 H44 Cl2 N4 O3 Pd -","- C17 H44 Cl2 N4 O3 Pd -","- C68 H176 Cl8 N16 O12 Pd4 -","4","1","CF6288","Jones, Matthew D.; Almeida Paz, Filipe A.; Davies, John E.; Johnson, Brian F. G.; Klinowski, Jacek","<i>trans</i>-Bis[(<i>S</i>)-({-})-2-aminomethyl-1-ethylpyrrolidine-κ^2^<i>N</i>]palladium(II) dichloride methanol trisolvate","Acta Crystallographica Section E","2003","59","11","m1031","m1034","10.1107/S1600536803022943","","","0.71073","MoKα","","0.047","0.036","","","0.071","0.075","","","","","","1.007","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202447","13.4869","0.001","13.4869","0.001","31.046","0.004","90","","90","","120","","4890.6","0.8","170","2","170","2","","","","","","","","4","P 31 2 1","P 31 2""","152","Beclomethasone Dipropionate (BDP)","9α-chloro-16β-methyl-3,20-dioxo-1,4-pregnadiene-11β,17,21-triol 17,21-dipropionate","","- C32 H49 Cl O9 -","- C28 H37 Cl O7 -","- C168 H222 Cl6 O42 -","6","1","CF6289","Philip J. Kuehl; Carducci, Michael D.; Paul B. Myrdal","An ethanol solvate of Beclomethasone dipropionate","Acta Crystallographica Section E","2003","59","12","o1888","o1890","10.1107/S1600536803024425","","","0.71073","MoKα","","0.0959","0.0665","","","0.1099","0.1182","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202448","7.6","0.003","10.089","0.002","10.261","0.003","89.6","0.03","77.52","0.02","85.63","0.03","765.9","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","Barium ferron tetrahydrate","triaqua(μ-8-hydroxy-7-iodoquinoline-5-sulfonato)barium(II) monohydrate","","- C9 H12 Ba I N O8 S -","- C9 H12 Ba I N O8 S -","- C18 H24 Ba2 I2 N2 O16 S2 -","2","1","CF6290","Packianathan Thomas Muthiah; Savarimuthu Francis; Gabriele Bocelli; Andrea Cantoni","Supramolecular organization <i>via</i> varied coordination modes in triaqua(μ-8-hydroxy-7-iodoquinoline-5-sulfonato)barium(II) monohydrate","Acta Crystallographica Section E","2003","59","12","m1164","m1167","10.1107/S1600536803024322","","","0.71069","MoKα","","0.0822","0.0768","","","0.2296","0.2358","","","","","","1.055","","","","has coordinates,has Fobs","189185","2020-10-21","18:00:00",""
"2202449","12.9463","0.0014","7.3819","0.001","16.8664","0.0017","90","","98.562","0.006","90","","1593.9","0.3","300","1","300","1","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C33 H50 O6 -","- C33 H50 O6 -","- C66 H100 O12 -","2","1","CF6291","Sandoval-Ramírez, Jesús; Meza-Reyes, Socorro; Montiel-Smith, Sara; Bernès, Sylvain; Hernández-Linares, Guadalupe; Viñas Bravo, Omar","Solving the problem of the configuration of the double bond at C22 in (25<i>S</i>)-23-acetyl-5β-furost-22-ene-3β,26-diyl diacetate","Acta Crystallographica Section E","2003","59","11","o1817","o1819","10.1107/S1600536803023754","","","0.71073","MoKα","","0.0539","0.0451","","","0.1259","0.1327","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202450","18.929","0.006","10.197","0.003","11.214","0.004","90","","90","","90","","2164.5","1.2","168","","168","","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C11 H18 F3 Fe N2 O6 S5 -","- C11 H18 F3 Fe N2 O6 S5 -","- C44 H72 F12 Fe4 N8 O24 S20 -","4","0.5","CF6293","Wu, Bei; Taylor, Max R.; Martin, Lisandra L.","Aquabis(4-morpholinyldithiocarbamato)iron(III) trifluoromethanesulfonate","Acta Crystallographica Section E","2003","59","11","m1083","m1085","10.1107/S1600536803024462","","","0.71073","MoKα","","0.067","0.042","","0.096","","0.094","","","0.989","","","1.008","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2202451","16.036","0.003","16.604","0.003","18.487","0.004","90","","95.1","0.03","90","","4902.9","1.7","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis(μ-N,N-dibutyldithiocarbamato- κ^2^S:S')bis[(N,N-dibutyldithiocarbamato-κ^2^S,S')zinc(II)]","","- C36 H72 N4 S8 Zn2 -","- C36 H72 N4 S8 Zn2 -","- C144 H288 N16 S32 Zn8 -","4","1","CF6295","Almeida Paz, Filipe A.; Neves, Marcia C.; Trindade, Tito; Klinowski, Jacek","The first dinuclear zinc(II) dithiocarbamate complex with butyl substituent groups","Acta Crystallographica Section E","2003","59","11","m1067","m1069","10.1107/S160053680302419X","","","0.71073","MoKα","","0.0967","0.0664","","","0.1722","0.1958","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202452","11.7449","0.0005","14.5747","0.0007","22.97","0.0012","90","","90","","90","","3932","0.3","180","2","180","2","","","","","","","","7","C 2 2 21","C 2c 2","20","","[(S)-(-)-2-aminomethyl-1-ethylpyrrolidine- κ^2^N,N'](1,5-cyclooctadiene)rhodium(I) trifluoromethanesulfonate","","- C16 H28 F3 N2 O3 Rh S -","- C16 H28 F3 N2 O3 Rh S -","- C128 H224 F24 N16 O24 Rh8 S8 -","8","1","CF6296","Jones, Matthew D.; Almeida Paz, Filipe A.; Davies, John E.; Johnson, Brian F. G.; Klinowski, Jacek","A new polymorph of [(<i>S</i>)-({-})-2-aminomethyl-1-ethylpyrrolidine-κ^2^<i>N,N</i>'](1,5-cyclooctadiene)rhodium(I) trifluoromethanesulfonate","Acta Crystallographica Section E","2003","59","12","m1091","m1093","10.1107/S1600536803024760","","","0.71073","MoKα","","0.0482","0.0407","","","0.096","0.1014","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202453","9.185","0.002","12.681","0.003","7.7791","0.0017","90","","110.579","0.003","90","","848.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Bis(morpholinebiguanido)copper(II)]","Bis{N'-[(E)-amino(imino)methyl]morpholine-4-carboximidamido}copper(II)","","- C12 H24 Cu N10 O2 -","- C12 H24 Cu N10 O2 -","- C24 H48 Cu2 N20 O4 -","2","0.5","CF6297","Lu, Liping; Zhu, Miaoli","Bis{<i>N</i>'-[(<i>E</i>)-amino(imino)methyl]morpholinocarboximidamido}copper(II)","Acta Crystallographica Section E","2003","59","12","m1086","m1088","10.1107/S1600536803024784","","","0.71073","MoKα","","0.0325","0.0278","","","0.0776","0.0796","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202454","7.102","0.003","11.11","0.005","25.177","0.01","90","","97.608","0.007","90","","1969.1","1.4","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","{2-[(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4- ylimino)methyl]phenoxy}acetic acid nitrate","","- C20 H20 N4 O7 -","- C20 H20 N4 O7 -","- C80 H80 N16 O28 -","4","1","CF6298","You, Zhong-Lu; Zhu, Hai-Liang; Liu, Wei-Sheng; Tan, Min-Yu","{2-[(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-4-ylimino)methyl]phenoxy}acetic acid nitrate","Acta Crystallographica Section E","2003","59","12","o1920","o1922","10.1107/S1600536803025339","","","0.71073","MoKα","","0.1193","0.0653","","","0.1688","0.198","","","","","","0.89","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202455","9.5897","0.0006","27.024","0.002","14.3392","0.0014","90","","90","","90","","3716","0.5","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4,5-Dicyano-1,2-bis(2-dimethylaminoethylsulfanyl)benzene","","- C16 H22 N4 S2 -","- C16 H22 N4 S2 -","- C128 H176 N32 S16 -","8","1","CF6299","Çoruh, Ufuk; Ustabaş, Reşat; Yılmaz, İsmail; Yavuz, Metin","4,5-Dicyano-1,2-bis(2-dimethylaminoethylsulfanyl)benzene","Acta Crystallographica Section E","2003","59","12","o1938","o1940","10.1107/S1600536803025376","","","0.71073","MoKα","","0.1499","0.0452","","","0.0781","0.0955","","","","","","0.716","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202456","10.03","0.0009","10.3536","0.0006","16.7649","0.0013","90","","98.817","0.004","90","","1720.4","0.2","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","C60 thiophene solvate","fullerene thiophene disolvate","","- C68 H8 S2 -","- C68 H8 S2 -","- C136 H16 S4 -","2","0.5","CF6301","Bond, Andrew D.","C~60~ thiophene disolvate","Acta Crystallographica Section E","2003","59","12","o1992","o1993","10.1107/S1600536803026321","","","0.71073","MoKα","","0.1212","0.0769","","","0.2095","0.2271","","","","","","1.235","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202457","6.498","0.002","8.002","0.007","16.208","0.006","99.45","0.05","100.93","0.03","98.42","0.05","802.4","0.8","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H28 N2 O8 -","- C38 H28 N2 O8 -","- C38 H28 N2 O8 -","1","0.5","CI6221","Lee, Ting Wai; Lau, Jasmine Po Kwan; Szeto, Lap","Diphenic acid‒4,4'-bipyridine (2/1)","Acta Crystallographica Section E","2003","59","7","o942","o944","10.1107/S1600536803012194","","","0.7107","MoKα","","0.1087","0.0361","","","0.0425","0.0538","","","","","","1.306","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2202458","15.274","0.004","12.617","0.003","19.795","0.004","90","","129.996","0.013","90","","2922.4","1.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-Dimethylaminopyridinium picrate","4-N,N-Dimethylaminopyridinium 2,4,6-trinitrophenolate","","- C13 H13 N5 O7 -","- C13 H13 N5 O7 -","- C104 H104 N40 O56 -","8","2","CI6222","Vembu, Nagarajan; Nallu, Maruthai; Garrison, Jered; Youngs, Wiley J.","4-Dimethylaminopyridinium picrate: supramolecular aggregation through extensive N—H···O and C—H···O interactions","Acta Crystallographica Section E","2003","59","7","o913","o916","10.1107/S1600536803012212","","","0.71073","MoKα","","0.0891","0.0718","","","0.1479","0.1547","","","","","","1.203","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202459","19.675","0.003","6.115","0.001","26.584","0.002","90","","109.6","0.1","90","","3013","2","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","phenylalaninium trichloroacetate","L-Phenylalaninium trichloroacetate","","- C22 H26 Cl6 N2 O9 -","- C22 H26 Cl6 N2 O9 -","- C88 H104 Cl24 N8 O36 -","4","1","CI6224","K. Rajagopal; R. V. Krishnakumar; M. Subha Nandhini; T. S. Cameron; S. Natarajan","<small>L</small>-Phenylalaninium trichloroacetate hemihydrate","Acta Crystallographica Section E","2003","59","7","o1084","o1086","10.1107/S1600536803013916","","","0.71069","MoKα","","0.1094","0.0379","","","0.0934","0.1165","","","","","","1.014","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202460","7.538","0.002","13.71","0.003","27.629","0.008","90","","90","","90","","2855.3","1.3","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(4aR,6bR,12aR)-10-Hydroxy-2,2,4a,6b,9,9,12a-heptamethyl- 2,3,4,4a,5,6,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydro- 1H-picene-6a-carboxylic acid methanol solvate","","- C31 H52 O4 -","- C31 H52 O4 -","- C124 H208 O16 -","4","1","CI6226","Hong-Xiang Sun; Yi-Ping Ye; Kui-Wu Wang; Yuan-Jiang Pan","3β-Hydroxyolean-12-en-27-oic acid methanol solvate: a cytotoxic and apoptosis-inducing triterpenoid from the rhizome of <i>Astilbe chinensis</i>","Acta Crystallographica Section E","2003","59","7","o989","o991","10.1107/S1600536803012571","","","0.71073","MoKα","","0.0975","0.0573","","","0.1439","0.1577","","","","","","0.888","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202461","9.298","0.002","9.011","0.001","13.99","0.002","90","","108.07","0.01","90","","1114.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(2,2-dichloroacetylamino)-3-methyl butyric acid hydrate (1/0.41)","","- C7 H11.82 Cl2 N O3.41 -","- C7 H11.82 Cl2 N O3.41 -","- C28 H47.28 Cl8 N4 O13.64 -","4","1","CI6227","Jin, Zhi-Min; Li, Yi-Zhi; Wang, Hai-Bin; Li, Mei-Chao; Hu, Mao-Lin; Shen, Liang","<i>N</i>-Dichloroacetyl-<small>DL</small>-valine‒water (1/0.41)","Acta Crystallographica Section E","2003","59","7","o1043","o1044","10.1107/S1600536803013850","","","0.71073","MoKα","","0.067","0.0402","","","0.0895","0.095","","","","","","1.14","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202462","15.918","0.003","7.56","0.001","15.924","0.003","90","","114.26","0.01","90","","1747.1","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,6-Dimethylpyridinium nitrate","","- C7 H10 N2 O3 -","- C7 H10 N2 O3 -","- C56 H80 N16 O24 -","8","1","CI6228","Zhi Min Jin; Zu Guang Li; Mei Chao Li; Mao Lin Hu; Liang Shen","2,6-Dimethylpyridinium nitrate","Acta Crystallographica Section E","2003","59","7","o903","o904","10.1107/S1600536803011553","","","0.71073","MoKα","","0.0836","0.0344","","","0.0682","0.0768","","","","","","0.864","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202463","3.911","0.005","5.893","0.005","25.367","0.005","90","","94.155","0.005","90","","583.1","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","3,3'-dichloroazobenzene","trans-Bis(3-chlorophenyl)diazine oxide","","- C12 H8 Cl2 N2 O -","- C12 H8 Cl2 N2 O -","- C24 H16 Cl4 N4 O2 -","2","0.5","CI6229","Jose Kavitha, Savaridasson; Srinivasan Chandrasekar; Panchanatheswaran, Krishnaswamy","<i>trans</i>-1,2-Bis(3-chlorophenyl)diazene oxide","Acta Crystallographica Section E","2003","59","7","o947","o949","10.1107/S1600536803012200","","","0.71069","MoKα","","0.0629","0.0476","","","0.1266","0.1396","","","","","","1.109","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202464","6.409","0.001","13.062","0.001","14.842","0.001","90","","90","","90","","1242.5","0.2","293","2","293","","","","","","","","","5","P n 21 a","P -2ac -2n","33","o-Vanillin chlorophenyl imine","3-methoxysalicylidene-2-chloroaniline","","- C14 H12 Cl N O2 -","- C14 H12 Cl N O2 -","- C56 H48 Cl4 N4 O8 -","4","1","CI6231","Savarimuthu Francis; Packianathan Thomas Muthiah; Galmari Venkatachalam; Rengan Ramesh","2-Chloro-(3-methoxysalicylidene)aniline","Acta Crystallographica Section E","2003","59","7","o1045","o1047","10.1107/S1600536803013606","","","1.5418","CuKα","","0.0527","0.0501","","","0.1403","0.144","","","","","","1.055","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202465","5.5021","0.0006","6.6396","0.0008","23.821","0.003","90","","96.22","0.01","90","","865.1","0.18","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(DL-alanine)tetraaquacobalt(II) dinitrate","","- C6 H22 Co N4 O14 -","- C6 H22 Co N4 O14 -","- C12 H44 Co2 N8 O28 -","2","0.5","CI6232","K.Rajagopal; R.V.Krishnakumar; M.Subha Nandhini; K.Ravikumar; S.Natarajan","Bis(<small>DL</small>-alanine)tetraaquacobalt(II) dinitrate","Acta Crystallographica Section E","2003","59","8","m562","m564","10.1107/S1600536803014533","","","0.71073","MoKα","","0.0509","0.0482","","","0.1396","0.1414","","","","","","1.245","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202466","8.757","0.0004","16.8849","0.0008","15.307","0.0006","90","","97.591","0.002","90","","2243.47","0.17","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","fac-tris(isothiocyanato)-tris(dimethylformamide)-iron(III)","","- C12 H21 Fe N6 O3 S3 -","- C12 H21 Fe N6 O3 S3 -","- C48 H84 Fe4 N24 O12 S12 -","4","1","CI6233","Ming-Sheng Wang; Li-Zhen Cai; Guo-Cong Guo; Jin-Shun Huang","<i>fac</i>-Tris(dimethylformamide)tris(isothiocyanato)iron(III)","Acta Crystallographica Section E","2003","59","7","m436","m437","10.1107/S1600536803012881","","","0.71073","MoKα","","","0.0621","","","0.1113","0.146","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202467","18.345","0.002","11.022","0.004","20.924","0.004","90","","103.17","0.013","90","","4119.5","1.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(1,3-diphenylpropane-1,3-dionato-κ^2^O,O')dioxo(triphenylphosphine oxide-κO)uranium(VI)","","- C48 H37 O7 P U -","- C48 H37 O7 P U -","- C192 H148 O28 P4 U4 -","4","1","CI6234","M. Alagar; K.Rajagopal; R.V. Krishnakumar; M. Subha Nandhini; S. Kannan; S.Natarajan","Bis(1,3-diphenylpropane-1,3-dionato-κ^2^<i>O,O</i>')dioxo(triphenylphosphine oxide-κ<i>O</i>)uranium(VI)","Acta Crystallographica Section E","2003","59","7","m524","m526","10.1107/S1600536803012923","","","0.71073","MoKα","","0.07","0.0356","","","0.0646","0.0842","","","","","","1.288","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202468","7.8868","0.0004","9.4298","0.0004","11.8789","0.0005","90","","107.318","0.002","90","","843.4","0.07","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","m-nitrobenzenesulfonyl chloride","3-Nitrobenzenesulfonyl chloride","","- C6 H4 Cl N O4 S -","- C6 H4 Cl N O4 S -","- C24 H16 Cl4 N4 O16 S4 -","4","1","CI6235","Nagarajan Vembu; Maruthai Nallu; Elinor C. Spencer; Judith A. K. Howard","3-Nitrobenzenesulfonyl chloride: molecular aggregation through C—H···O interactions","Acta Crystallographica Section E","2003","59","7","o1036","o1038","10.1107/S1600536803013321","","","0.71073","MoKα","","0.0452","0.0392","","","0.1015","0.1057","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202469","8.2921","0.001","12.2799","0.0016","14.2746","0.0018","90","","101.229","0.003","90","","1425.7","0.3","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Methyl p-tosyloxybenzoate","Methyl 4-tosyloxybenzoate","","- C15 H14 O5 S -","- C15 H14 O5 S -","- C60 H56 O20 S4 -","4","1","CI6236","Nagarajan Vembu; Maruthai Nallu; Elinor C. Spencer; Judith A. K. Howard","Methyl 4-tosyloxybenzoate: supramolecular aggregation through C—H···O, C—H···π and π‒π interactions","Acta Crystallographica Section E","2003","59","7","o1009","o1011","10.1107/S1600536803013333","","","0.71073","MoKα","","0.0552","0.0416","","","0.1081","0.1159","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202470","5.587","0.004","9.822","0.005","11.813","0.009","90","","90","","90","","648.2","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","L-aspartic acid monohydrate","L-aspartic acid monohydrate","","- C4 H9 N O5 -","- C4 H9 N O5 -","- C16 H36 N4 O20 -","4","1","CI6237","K. Umadevi; K. Anitha; B. Sridhar; N. Srinivasan; R. K. Rajaram","<small>L</small>-Aspartic acid monohydrate","Acta Crystallographica Section E","2003","59","7","o1073","o1075","10.1107/S1600536803014041","","","0.70165","MoKα","","0.0626","0.0613","","","0.1711","0.1734","","","","","","1.057","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202471","10.7951","0.0019","14.402","0.003","15.118","0.003","90","","95.274","0.003","90","","2340.5","0.8","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","[Bis[(2,2'-bipyridyl)silver(I)]-μ~2~-[1,4-bis(diphenylphosphino)butane]] ditetrafluoroborate","","- C48 H44 Ag2 B2 F8 N4 P2 -","- C48 H44 Ag2 B2 F8 N4 P2 -","- C96 H88 Ag4 B4 F16 N8 P4 -","2","0.5","CI6238","Li, Zhang; Chunlong, Chen; Qian, Zhang; Huaxin, Zhang; Beisheng, Kang","μ-1,4-Bis(diphenylphosphino)butane-κ^2^<i>P</i>:<i>P</i>'-bis[(2,2'-bipyridyl)silver(I)] ditetrafluoroborate","Acta Crystallographica Section E","2003","59","7","m536","m537","10.1107/S1600536803013813","","","0.71073","MoKα","","0.0532","0.0471","","","0.126","0.1312","","","","","","1.072","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202472","7.706","0.003","9.007","0.003","16.213","0.006","94.985","0.006","91.165","0.006","114.879","0.005","1015","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4,5,6,7-Tetrachloro-2-(naphthalen-1-yl)isoindole-1,3-dione acetone solvate","","- C21 H13 Cl4 N O3 -","- C21 H13 Cl4 N O3 -","- C42 H26 Cl8 N2 O6 -","2","1","CI6239","Zhou, Li-shan; Feng, Ya-Qing; Bo Gao; Da-xin Shi; Li, Xiao-Fang","4,5,6,7-Tetrachloro-2-(1-naphthyl)isoindole-1,3-dione acetone solvate","Acta Crystallographica Section E","2003","59","7","o1066","o1067","10.1107/S1600536803014077","","","0.71073","MoKα","","0.0588","0.0399","","","","0.105","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202473","7.125","0.001","8.798","0.001","25.625","0.002","90","","91.214","0.001","90","","1606","0.3","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3,3-Bis(2-furylmethyl)-2-methyl-4-oxocyclohex-1-ene-1-carboxylic acid","","- C18 H18 O5 -","- C18 H18 O5 -","- C72 H72 O20 -","4","1","CI6240","Ray, Jayanta Kumar; Mal, Sajal Kanti; Canle, L. M.; Santaballa, J. A.; Mahía, Jose","3,3-Bis(2-furylmethyl)-2-methyl-4-oxocyclohex-1-ene-1-carboxylic acid","Acta Crystallographica Section E","2003","59","8","o1141","o1142","10.1107/S1600536803015113","","","0.71073","MoKα","","0.0602","0.048","","","0.1293","0.1391","","","","","","1.059","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202474","15.138","0.002","9.458","0.001","15.248","0.002","90","","111.884","0.016","90","","2025.8","0.5","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H26 N10 Ni2 -","- C12 H26 N10 Ni2 -","- C48 H104 N40 Ni8 -","4","1","CI6241","Muga, Iñaki; Vitoria, Pablo; Reinoso, Santiago; Gutiérrez-Zorrilla, Juan M.","Bis(diethylenetriamine)nickel(II) tetracyanonickelate(II)","Acta Crystallographica Section E","2003","59","8","m576","m578","10.1107/S160053680301479X","","","0.71073","MoKα","","0.1278","0.0422","","","0.064","0.0782","","","","","","0.701","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202475","9.5831","0.0002","15.606","0.0003","18.1212","0.0003","90","","90","","90","","2710.1","0.09","150","","150","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C10 H28 N4 O20 S4 U2 -","- C10 H28 N4 O20 S4 U2 -","- C40 H112 N16 O80 S16 U8 -","4","0.5","CI6242","Doran, Michael B.; Norquist, Alexander J.; O'Hare, Dermot","Poly[[1,4-bis-(3-aminopropyl)piperazinium] [[dioxouranium(VI)]-di-μ~2~,μ~3~-sulfato]]","Acta Crystallographica Section E","2003","59","9","m762","m764","10.1107/S160053680301715X","","","0.71073","MoKα","","","0.023","","","0.0528","0.0528","","","","","","0.8872","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202476","11.521","0.0002","14.8794","0.0002","14.9455","0.0003","79.4462","0.0006","70.0605","0.0007","69.4812","0.0011","2249.76","0.07","150","","150","","","","","","","","","6","P -1","-P 1","2","","[7-(cyclooctane-1,5-diyl)-2,3,11,12-tetraethyl-6,8-dioxa-5,9-diaza-7- boratridecane-1,13-dicarbaldehyde dioximato-κ^4^N]nickel(II)","","- C20 H35 B N4 Ni O4 -","- C20 H35 B N4 Ni O4 -","- C80 H140 B4 N16 Ni4 O16 -","4","2","CI6243","Krivokapić, Alexander; Faiz, Jonathan A.; Anderson, Harry L.","Mono-BBN (9-borabicyclo[3.3.1]nonane) adduct of bis(diethylglyoximato)nickel(II)","Acta Crystallographica Section E","2003","59","9","m745","m747","10.1107/S160053680301729X","","","0.71073","MoKα","","0.0447","0.0298","","0.0455","0.0375","0.0375","","","","","","1.0385","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202477","7.4047","0.0001","19.2467","0.0002","10.5508","0.0002","90","","94.7398","0.0005","90","","1498.52","0.04","150","","150","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[2,9-bis(cyclooctane-1,5-diyl)-4,6,11,13-tetraethyl-1,3,8,10-tetraoxa- 4,7,11,14-tetraaza-2,9-diboracyclotetradecane-4,6,11,13-tetraene- κ^4^N]nickel(II)","","- C28 H48 B2 N4 Ni O4 -","- C28 H48 B2 N4 Ni O4 -","- C56 H96 B4 N8 Ni2 O8 -","2","0.5","CI6244","Krivokapić, Alexander; Faiz, Jonathan A.; Anderson, Harry L.","Bis-BBN (9-borabicyclo[3.3.1]nonane) adduct of bis(diethylglyoximato)nickel(II)","Acta Crystallographica Section E","2003","59","9","m748","m749","10.1107/S1600536803017288","","","0.71073","MoKα","","0.031","0.0249","","0.0349","0.0314","0.0314","","","","","","1.0376","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202478","4.7309","0.0005","7.8835","0.0009","8.0592","0.0009","65.18","0.002","86.143","0.002","85.995","0.002","271.91","0.05","93","2","93","2","","","","","","","","4","P -1","-P 1","2","","2,3,5,6-tetrahydroxy-1,4-dinitrocyclohexane dihydrate","","- C6 H14 N2 O10 -","- C6 H14 N2 O10 -","- C6 H14 N2 O10 -","1","0.5","CI6245","Gilardi, Richard; Evans, Robin N.","2,3,5,6-Tetrahydroxy-1,4-dinitrocyclohexane dihydrate","Acta Crystallographica Section E","2003","59","8","o1226","o1227","10.1107/S1600536803016532","","","0.71073","MoKα","","0.054","0.0427","","","0.1028","0.1078","","","","","","1.092","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202479","11.874","0.003","20.058","0.004","21.348","0.005","90","","100.48","0.01","90","","5000","2","223","1","223","1","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","Rac-bis[(1S,2S)-trans-3,3'-(1,2-cyclohexanediyldinitrilo)bis- (2-methylpropane-2-thiolato)]-1κ^4^N^1^,N^1'^,S^1^,S^1'^;- 2κ^4^N^2^,N^2'^,S^2^,S^2'^;3κ^2^S^1^,S^2'^;4κ^2^S^1'^,S^2^;- 5κ^2^S^1'^,S^2'^-trichloro-3κCl,4κCl,5κCl-tricopper(I)- dinickel(II) bis(dimethylformamide) solvate","","- C34 H70 Cl3 Cu3 N6 Ni2 O2 S4 -","- C34 H70 Cl3 Cu3 N6 Ni2 O2 S4 -","- C136 H280 Cl12 Cu12 N24 Ni8 O8 S16 -","4","0.5","CI6246","Robert T. Stibrany; Harvey J. Schugar; Joseph A. Potenza","A pentanuclear complex exhibiting two short Ni‒Cu distances","Acta Crystallographica Section E","2003","59","8","m630","m632","10.1107/S1600536803015496","","","0.71073","MoKα","","0.0478","0.0354","","","0.0854","0.0918","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202480","6.83","0.001","11.339","0.002","14.627","0.002","94.58","0.01","95.92","0.01","102.54","0.02","1093.8","0.3","294","1","294","1","","","","","","","","6","P -1","-P 1","2","","Dipotassium aquabis(pyrazine-2,3-dicarboxylato-κ^2^N,O)cuprate(II) hexahydrate","","- C12 H18 Cu K2 N4 O15 -","- C12 H18 Cu K2 N4 O15 -","- C24 H36 Cu2 K4 N8 O30 -","2","1","CI6247","Castillo, Oscar; Beobide, Garikoitz; Luque, Antonio; Román , Pascual","Dipotassium aquabis(pyrazine-2,3-dicarboxylato-κ^2^<i>N</i>,<i>O</i>)cuprate(II) hexahydrate","Acta Crystallographica Section E","2003","59","9","m800","m802","10.1107/S160053680301732X","","","0.71073","MoKα","","0.098","0.054","","","0.124","0.158","","","","","","0.944","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202481","9.6452","0.0007","10.1247","0.0008","11.1168","0.0009","81.359","0.001","80.165","0.001","64.92","0.001","965.11","0.13","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N-(4a-Morpholino-2,3,4,4a,9,9a-hexahydro-1H-xanthen-9-yl)phenylamine","","- C23 H28 N2 O2 -","- C23 H28 N2 O2 -","- C46 H56 N4 O4 -","2","1","CI6248","Sundari Bhaskaran; S. Selvanayagam; D. Velmurugan; K. Ravikumar; M. Anniyappan; D. Muralidharan; P. T. Perumal","<i>N</i>-(4a-Morpholino-2,3,4,4a,9,9a-hexahydro-1<i>H</i>-xanthen-9-yl)phenylamine","Acta Crystallographica Section E","2003","59","9","o1301","o1303","10.1107/S1600536803017173","","","0.71073","MoKα","","0.0818","0.0678","","","0.1674","0.1788","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202482","8.586","0.0007","12.909","0.001","14.7552","0.0011","65.065","0.001","84.701","0.001","76.522","0.001","1442.1","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","34,35-Dimethyl-13,20-dioxa-10,23-diaza-3,30- dithiapentacyclo[30.4.0.0^4,9^.0^14,19^.0^24,29^]hexatriconta- 1(36),4,6,8,14,16,18,24,26,28,32,34-dodecane-11,22-dione","","- C32 H30 N2 O4 S2 -","- C32 H30 N2 O4 S2 -","- C64 H60 N4 O8 S4 -","2","1","CI6249","Sundari Bhaskaran; S. Selvanayagam; V. Rajakannan; D. Velmurugan; K. Ravikumar; A. Mohammed Abdul Rasheed; P. Rajakumar","34,35-Dimethyl-13,20-dioxa-10,23-diaza-3,30-dithiapentacyclo[30.4.0.0^4,9^.0^14,19^.0^24,29^]hexatriconta-1(36),4,6,8,14,16,18,24,26,28,32,34-dodecane-11,22-dione","Acta Crystallographica Section E","2003","59","9","o1304","o1306","10.1107/S160053680301660X","","","0.71073","MoKα","","0.0705","0.0503","","","0.1282","0.142","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202483","8.539","0.002","10.029","0.002","11.098","0.002","114.7","0.01","97.18","0.02","107","0.01","791.6","0.3","296.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C40 H28 Cu N2 O6 -","- C40 H28 Cu N2 O6 -","- C40 H28 Cu N2 O6 -","1","0.5","CI6250","Okabe, Nobuo; Yamamoto, Emi; Yasunori, Muranishi","<i>trans</i>-Bis(3-hydroxy-2-phenyl-4<i>H</i>-1-benzopyran-4-onato)bis(pyridine)copper(II)","Acta Crystallographica Section E","2003","59","9","m715","m716","10.1107/S1600536803017392","","","0.7107","MoKα","","","0.0432","","","","0.152","","","","","","0.946","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202484","9.394","0.002","9.396","0.001","11.005","0.002","94.98","0.01","98.3","0.01","102.95","0.01","929.6","0.3","292","2","292","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 2-amino-4-(4-methylphenyl)-4H-benzo[f]chromene-3-carboxylate","","- C23 H21 N O3 -","- C23 H21 N O3 -","- C46 H42 N2 O6 -","2","1","CI6251","Daqing Shi; Hui Wu; Xiangshan Wang; Qiya Zhuang; Hongwen Hu","Ethyl 2-amino-4-(4-methylphenyl)-4<i>H</i>-benzo[<i>f</i>]chromene-3-carboxylate","Acta Crystallographica Section E","2003","59","9","o1263","o1264","10.1107/S1600536803017033","","","0.71073","MoKα","","0.0643","0.0413","","","0.1086","0.1174","","","","","","1.009","","","","has coordinates,has disorder,has Fobs","201973","2020-10-21","18:00:00",""
"2202485","17.6","0.001","9.775","0.001","17.089","0.001","90","","97.33","0.01","90","","2916","0.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Thiazolidin-4-one","2-(4-Chlorophenyl)-3-cyclohexylthiazolidin-4-one","","- C15 H18 Cl N O S -","- C15 H18 Cl N O S -","- C120 H144 Cl8 N8 O8 S8 -","8","1","CI6252","Sharon, Ashoke; Srivastava, Tumul; Katti, B. S.; Maulik, Prakas R.","2-(4-Chlorophenyl)-3-cyclohexylthiazolidin-4-one","Acta Crystallographica Section E","2003","59","8","o1239","o1240","10.1107/S1600536803016477","","","0.71073","MoKα","","0.0944","0.0478","","","0.1011","0.119","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202486","7.119","0.0015","14.408","0.003","8.6396","0.0013","90","","107.98","0.02","90","","842.9","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","catena-Poly[[dicadmium(II)]-μ-DL-alanine-di-μ-chloro-monohydrato]","catena-poly[[[dicadmium(II)]-μ-DL-alanine-di-μ-chloro] monohydrate]","","- C3 H9 Cd Cl2 N O3 -","- C3 H7 Cd Cl2 N O3 -","- C12 H28 Cd4 Cl8 N4 O12 -","4","1","CI6253","M.Subha Nandhini; R.V. Krishnakumar; S.Natarajan","A hydrated complex of <small>DL</small>-alanine with cadmium chloride","Acta Crystallographica Section E","2003","59","9","m756","m758","10.1107/S1600536803017720","","","0.71073","MoKα","","0.0489","0.0479","","","0.132","0.1335","","","","","","1.154","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202487","16.1401","0.0011","12.5692","0.001","16.565","0.0011","90","","92.435","0.005","90","","3357.5","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H30.5 Co N8 O12.25 -","- C34 H30 Co N8 O12.25 -","- C136 H120 Co4 N32 O49 -","4","0.5","CI6254","Bulut, Ahmet; İçbudak, Hasan; Yeşilel, Okan Zafer; Ölmez, Halis; Büyükgüngör, Orhan","Diaquabis(1,10-phenanthroline)cobalt(II) diorotate 2.25-hydrate","Acta Crystallographica Section E","2003","59","9","m736","m738","10.1107/S1600536803017161","","","0.71073","MoKα","","0.0552","0.0368","","","0.0955","0.1003","","","","","","0.906","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202488","11.468","0.0007","15.5987","0.0009","6.706","0.002","90","","90","","90","","1199.6","0.4","298.2","","298.2","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","Gemcitabine Hydrochloride","2'-deoxy-2',2'-difluorocytidine monohydrochloride","","- C9 H12 Cl F2 N3 O4 -","- C9 H12 Cl F2 N3 O4 -","- C36 H48 Cl4 F8 N12 O16 -","4","1","CI6255","A. Sivalakshmidevi; K. Vyas; S. D. V. N. Sivaram; P. Veerabhadra Swamy; Ramachandra Puranik; P. Sairam; G. Om Reddy","2'-Deoxy-2',2'-difluorocytidine monohydrochloride (Gemcitabine hydrochloride)","Acta Crystallographica Section E","2003","59","10","o1435","o1437","10.1107/S1600536803018816","","","1.5418","CuKα","","","0.06","","","","0.06","","","","","","1.134","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202489","7.3191","0.0007","8.9264","0.0009","12.2024","0.0012","105.247","0.002","91.771","0.002","104.378","0.002","741.11","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-Chloro-3-(9-ethyl-6-methyl-9H-carbazol-3-yl)propenal","","- C18 H16 Cl N O -","- C18 H16 Cl N O -","- C36 H32 Cl2 N2 O2 -","2","1","CI6256","Aravindan, P. G.; Selvanayagam, S.; Yogavel, M.; Velmurugan, D.; Ravikumar, K.; Nagarajan, N.; Perumal, P. T.","3-Chloro-3-(9-ethyl-6-methyl-9<i>H</i>-carbazol-3-yl)propenal","Acta Crystallographica Section E","2003","59","9","o1432","o1434","10.1107/S1600536803018348","","","0.71073","MoKα","","0.06","0.048","","","0.122","0.13","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202490","9.878","0.0009","5.64","0.002","15.448","0.002","90","","105.844","0.003","90","","827.9","0.3","288","2","288","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","N-Carboxy-DL-leucine anhydride","4-isobutyl-1,3-oxazolidine-2,5-dione","","- C7 H11 N O3 -","- C7 H11 N O3 -","- C28 H44 N4 O12 -","4","1","CI6257","Kanazawa, Hitoshi","<i>N</i>-Carboxy-<small>DL</small>-leucine anhydride","Acta Crystallographica Section E","2003","59","9","o1309","o1311","10.1107/S1600536803017185","","","0.7107","MoKα","","0.054","0.048","","","0.152","0.159","","","","","","1.167","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202491","9.91","0.001","6.914","0.001","16.578","0.002","90","","91.86","0.01","90","","1135.3","0.2","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxy-N-methyl-1-hexanaminium-2- [2-methyl-3-(trifluoromethyl)anilino]nicotinate","","- C21 H28 F3 N3 O7 -","- C21 H28 F3 N3 O7 -","- C42 H56 F6 N6 O14 -","2","1","CI6259","Xiao-Ji Cao; Yuan-Jiang Pan","The complex of flunixin and meglumine","Acta Crystallographica Section E","2003","59","10","o1471","o1473","10.1107/S1600536803019470","","","0.71073","MoKα","","0.0436","0.0334","","","0.0822","0.0847","","","","","","0.975","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202492","25.706","0.005","9.718","0.0019","12.245","0.002","90","","93.44","0.03","90","","3053.4","1","150","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Ethyl cis-3-(2-methoxyphenyl)-1-4-thiazine-2-carboxylate 1,1-dioxide","","- C14 H19 N O5 S -","- C14 H19 N O5 S -","- C112 H152 N8 O40 S8 -","8","1","CI6260","M.Subha Nandhini; R.Banurekha; R.V. Krishnakumar; A.Mostad; N. Bhavani; S. Perumal; S.Natarajan","Ethyl <i>cis</i>-3-(2-methoxyphenyl)-1-4-thiazine-2-carboxylate 1,1-dioxide at 150K","Acta Crystallographica Section E","2003","59","9","o1400","o1402","10.1107/S1600536803018579","","","0.71073","MoKα","","0.0369","0.0322","","","0.0879","0.1002","","","","","","1.149","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202493","10.411","0.002","10.975","0.001","13.296","0.002","103.54","0.01","112.97","0.01","93.89","0.01","1338.2","0.4","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","2,2'-[1,2-bis(4-chlorophenyl)ethane-1,2-diyl]bis(1-tetralone)","","- C34 H28 Cl2 O2 -","- C34 H28 Cl2 O2 -","- C68 H56 Cl4 O4 -","2","1","CI6261","Daqing Shi; Liangce Rong; Juxian Wang; Xiangshan Wang; Hongwen Hu","2,2'-[1,2-Bis(4-chlorophenyl)ethane-1,2-diyl]bis(1-tetralone)","Acta Crystallographica Section E","2003","59","9","o1376","o1378","10.1107/S1600536803017768","","","0.71073","MoKα","","0.0549","0.0366","","","0.0837","0.0884","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202494","8.6001","0.0006","23.0681","0.0016","13.9192","0.0009","90","","100.132","0.002","90","","2718.3","0.3","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","8-Quinolyl m-nitrobenzene sulfonate","8-Quinolyl 3-nitrobenzenesulfonate","","- C15 H10 N2 O5 S -","- C15 H10 N2 O5 S -","- C120 H80 N16 O40 S8 -","8","2","CI6262","Vembu, Nagarajan; Nallu, Maruthai; Spencer, Elinor C.; Howard, Judith A. K.","8-Quinolyl 3-nitrobenzenesulfonate","Acta Crystallographica Section E","2003","59","9","o1379","o1382","10.1107/S1600536803018166","","","0.71073","MoKα","","0.067","0.038","","","0.072","0.078","","","","","","0.904","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202495","7.7246","0.0009","8.1665","0.001","10.8838","0.0013","96.916","0.003","92.63","0.003","101.618","0.003","665.88","0.14","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","4-Dimethylaminopyridinium 2,4-dinitrophenolate","","- C13 H14 N4 O5 -","- C13 H14 N4 O5 -","- C26 H28 N8 O10 -","2","1","CI6263","Vembu, Nagarajan; Nallu, Maruthai; Spencer, Elinor C.; Howard, Judith A. K.","4-Dimethylaminopyridinium 2,4-dinitrophenolate: supramolecular aggregation through N—H···O, C—H···O, C—H···π and π‒π interactions","Acta Crystallographica Section E","2003","59","9","o1383","o1386","10.1107/S1600536803018178","","","0.71073","MoKα","","0.075","0.037","","","0.062","0.067","","","","","","0.798","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202496","27.73","0.002","4.7374","0.0003","10.78","0.0008","90","","90","","90","","1416.15","0.17","120","2","120","2","","","","","","","","5","P c a 21","P 2c -2ac","29","2,4-dinitrophenyl m-nitrobenzenesulfonate","2,4-Dinitrophenyl 3-nitrobenzenesulfonate","","- C12 H7 N3 O9 S -","- C12 H7 N3 O9 S -","- C48 H28 N12 O36 S4 -","4","1","CI6264","Vembu, Nagarajan; Nallu, Maruthai; Spencer, Elinor C.; Howard, Judith A. K.","2,4-Dinitrophenyl 3-nitrobenzenesulfonate","Acta Crystallographica Section E","2003","59","9","o1387","o1389","10.1107/S160053680301818X","","","0.71073","MoKα","","0.036","0.03","","","0.058","0.059","","","","","","0.967","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202497","19.9671","0.0008","12.7083","0.0005","5.1306","0.0002","90","","90","","90","","1301.88","0.09","120","2","120","2","","","","","","","","5","P n a 21","P 2c -2n","33","o-Nitrophenyl m-nitrobenzenesulfonate","2-Nitrophenyl 3-nitrobenzenesulfonate","","- C12 H8 N2 O7 S -","- C12 H8 N2 O7 S -","- C48 H32 N8 O28 S4 -","4","1","CI6265","Nagarajan Vembu; Maruthai Nallu; Elinor C. Spencer; Judith A. K. Howard","2-Nitrophenyl 3-nitrobenzenesulfonate","Acta Crystallographica Section E","2003","59","9","o1390","o1392","10.1107/S1600536803018191","","","0.71073","MoKα","","0.0458","0.0338","","","0.0667","0.0699","","","","","","0.962","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202498","8.2981","0.0007","13.525","0.002","16.528","0.0013","104.16","0.02","90.05","0.02","107.34","0.02","1711.4","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(1,10-phenanthroline)diperchloratobis(pyridine-4-carboxaldehyde oxime-κN^1^)copper(II)‒pyridine-4-carboxaldehyde oxime (1/1)","","- C30 H26 Cl2 Cu N8 O11 -","- C30 H26 Cl2 Cu N8 O11 -","- C60 H52 Cl4 Cu2 N16 O22 -","2","1","CI6266","Zhang, Baofeng; Chu, Sheng; Wang, Xiaoqing; Shen, Guangqiu; Wang, Ru-Ji","An adduct of (1,10-phenanthroline)diperchloratobis(pyridine-4-carboxaldehyde oxime-κ<i>N</i>^1^)copper(II) and pyridine-4-carboxaldehyde oxime","Acta Crystallographica Section E","2003","59","9","m824","m826","10.1107/S1600536803018737","","","0.71073","MoKα","","0.133","0.0686","","","0.109","0.1217","","","","","","1.016","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202499","12.377","0.003","5.293","0.003","15.23","0.002","90","","98.02","0.01","90","","988","0.6","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","trans-Diaquabis(isoquinoline-1-carboxylato-κ^2^N,O)iron(II) dihydrate","","- C20 H20 Fe N2 O8 -","- C20 H20 Fe N2 O8 -","- C40 H40 Fe2 N4 O16 -","2","0.5","CI6267","Muranishi, Yasunori; Okabe, Nobuo","<i>trans</i>-Diaquabis(isoquinoline-1-carboxylato-κ^2^<i>N,O</i>)iron(II) dihydrate","Acta Crystallographica Section E","2003","59","10","m883","m885","10.1107/S1600536803019391","","","0.7107","MoKα","","","0.0382","","","","0.1114","","","","","","1.013","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202500","21.879","0.008","31.062","0.012","11.129","0.005","90","","104.415","0.007","90","","7325","5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Ethyl 5''-(2,6-dichlorophenyl)-1'-methyl-4-(1-naphthyl)-2,3''-dioxo- 2,3,2'',3''-tetrahydro-1H-indole-3-spiro-2'-pyrrolidine-3'-spiro-2''- thiazolo[3'',2''-a]pyrimidine-6''-carboxylate ethyl acetate hemisolvate","","- C39 H34 Cl2 N4 O5 S -","- C39 H34 Cl2 N4 O5 S -","- C312 H272 Cl16 N32 O40 S8 -","8","2","CI6268","Li, Xiao-Fang; Feng, Ya-Qing; Chen, Hong-Liang; Shi, Da-Xin","Ethyl 5''-(2,6-dichlorophenyl)-1'-methyl-4-(1-naphthyl)-2,3''-dioxo-2,3,2'',3''-tetrahydro-1<i>H</i>-indole-3-spiro-2'-pyrrolidine-3'-spiro-2''-thiazolo[3'',2''-<i>a</i>]pyrimidine-6''-carboxylate ethyl acetate hemisolvate","Acta Crystallographica Section E","2003","59","11","o1618","o1620","10.1107/S1600536803021548","","","0.71073","MoKα","","0.169","0.067","","","","0.17","","","","","","0.984","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2202501","8.318","0.001","15.2","0.003","7.204","0.001","90","","96.896","0.003","90","","904.2","0.2","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Clavatol","1-(2,4-Dihydroxy-3,5-dimethyl-phenyl)-ethanone","","- C10 H12 O3 -","- C10 H12 O3 -","- C40 H48 O12 -","4","1","CI6269","Li, Sheng-Ying; Wang, Jian-Feng; Zheng, Zhong-Hui; Xu, Qing-Yan; Huang, Yao-Jian; Zhao, Yu-Fen; Su, Wen-Jin","1-(2,4-Dihydroxy-3,5-dimethylphenyl)-ethanone (Clavatol)","Acta Crystallographica Section E","2003","59","10","o1469","o1470","10.1107/S160053680301938X","","","0.71073","MoKα","","0.0584","0.0515","","","0.1481","0.1554","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202502","15.214","0.003","8.7408","0.0017","14.885","0.003","90","","90.75","0.03","90","","1979.3","0.7","105","2","105","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2,6-bis-4-(methylphenyl)-3-phenyl-pipridin-4-one","2,6-bis-4-(methylphenyl)-3-phenyl-pipridin-4-one","","- C25 H25 N O -","- C25 H25 N O -","- C100 H100 N4 O4 -","4","1","CI6270","Subha Nandhini, M.; M. Srinivasan; R. V. Krishnakumar; A. Mostad; S. Perumal; S. Selvaraj; S. Natarajan","2,6-Bis(4-methylphenyl)-3-phenylpiperidin-4-one","Acta Crystallographica Section E","2003","59","10","o1538","o1540","10.1107/S1600536803020063","","","0.71073","MoKα","","0.0516","0.0394","","","0.1122","0.1275","","","","","","1.064","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202503","10.2571","0.001","12.3622","0.0007","14.2374","0.001","94.326","0.005","108.527","0.006","96.725","0.006","1687.8","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","6,22-dioxaparazylenyl 2,10,18,26-tetrathia-33,35 diaza pentacyclo (27.3.1.1^4,8^.1^12,16^.1^20,24^)hexatriconta-4,6,8(36),12,14,16(35),20,22, 24(34),28,30,32-dodecaene","","- C38 H36 N2 O2 S4 -","- C38 H36 N2 O2 S4 -","- C76 H72 N4 O4 S8 -","2","1","CI6271","Sundari Bhaskaran; S. Selvanayagam; V. Rajakannan; D. Velmurugan; S. Narasingarao; M. Dhanasekaran; P. Rajakumar; Moon-Jib-Kim","6,22-Dioxaparazylenyl 2,10,18,26-tetrathia-33,35 diazapentacyclo[27.3.1.1^4,8^.1^12,16^.1^20,24^]hexatriconta-4,6,8(36),12,14,16(35),20,22,24(34),28,30,32-dodecaene","Acta Crystallographica Section E","2003","59","10","o1567","o1569","10.1107/S1600536803020014","","","0.71073","MoKα","","0.0924","0.044","","","0.109","0.1257","","","","","","0.989","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202504","9.9667","0.0014","10.4946","0.0015","11.2637","0.0016","116.931","0.011","99.441","0.011","93.57","0.012","1023.6","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4,5-Bis(1-naphthoxy)phthalonitrile","","- C28 H16 N2 O2 -","- C28 H16 N2 O2 -","- C56 H32 N4 O4 -","2","1","CI6272","Karakurt, Tuncay; Dinçer, Muharrem; Nesuhi, Akdemir; Kantar, Cihan; Ağar, Erbil","4,5-Bis(1-naphthoxy)phthalonitrile","Acta Crystallographica Section E","2003","59","11","o1748","o1750","10.1107/S1600536803022207","","","0.71073","MoKα","","0.0999","0.0353","","","0.0608","0.0693","","","","","","0.804","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202505","9.248","0.002","16.462","0.002","10.802","0.001","90","","94.7","0.01","90","","1639","0.4","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H16 N2 O4 Pd -","- C18 H16 N2 O4 Pd -","- C72 H64 N8 O16 Pd4 -","4","1","CI6273","Okabe, Nobuo; Muranishi, Yasunori","(1,2-Benzenediolato-κ^2^<i>O,O</i>')(1,10-phenanthroline-κ^2^<i>N,N</i>')palladium(II) dihydrate","Acta Crystallographica Section E","2003","59","10","m936","m938","10.1107/S1600536803020166","","","0.7107","MoKα","","","0.0258","","","","0.0714","","","","","","1.129","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202506","28.85","0.004","7.4438","0.0005","15.3364","0.0019","90","","111.853","0.01","90","","3056.9","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1-Benzoyl-3-methyl-4-benzylidenamino-4,5-dihydro-1,2,4-triazol-5-one","","- C17 H14 N4 O2 -","- C17 H14 N4 O2 -","- C136 H112 N32 O16 -","8","1","CI6275","Karakurt, Tuncay; Dinçer, Muharrem; Kahveci, Bahittin; Aǧar, Erbil; Aǧar, Ayşen; Şaşmaz, Selami","1-Benzoyl-3-methyl-4-benzylidenamino-4,5-dihydro-1,2,4-triazol-5-one","Acta Crystallographica Section E","2003","59","11","o1616","o1617","10.1107/S160053680302110X","","","0.71073","MoKα","","0.051","0.038","","","0.093","0.096","","","","","","0.87","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202507","7.546","0.002","17.417","0.002","10.342","0.002","90","","99.87","0.01","90","","1339.1","0.5","100","1","100","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(1-phenyl-1,3-butandionate)bis(3-aminopyridine)nickel(II)","","- C30 H30 N4 Ni O4 -","- C30 H30 N4 Ni O4 -","- C60 H60 N8 Ni2 O8 -","2","0.5","CI6276","Dejan-Krešimir Bučar; Ernest Meštrović","A bis(1-phenyl-1,3-butanedionato)nickel(II) adduct with 3-aminopyridine","Acta Crystallographica Section E","2003","59","11","m985","m987","10.1107/S1600536803021111","","","0.71073","MoKα","","0.0586","0.048","","","0.1096","0.116","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202508","11.066","0.002","5.9348","0.0013","14.075","0.003","90","","102.809","0.004","90","","901.4","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(4-chlorophenyl)propane-1,2-dione 2-oxime","","- C9 H8 Cl N O2 -","- C9 H8 Cl N O2 -","- C36 H32 Cl4 N4 O8 -","4","1","CI6277","C. R. Girija; Noor Shahina Begum; G. Nagendrappa","1-(4-Chlorophenyl)propane-1,2-dione 2-oxime","Acta Crystallographica Section E","2003","59","11","o1666","o1667","10.1107/S1600536803021664","","","0.71073","MoKα","","0.0481","0.0418","","","0.1185","0.1249","","","","","","0.95","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202509","7.6426","0.0004","9.1932","0.0005","54.362","0.003","90","","90","","90","","3819.5","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","14β-hydroxy-3β-o-(L-thevetosyl)-5β-card-20(22)-enolide dichloroform solvate","","- C32 H48 Cl6 O8 -","- C32 H48 Cl6.001 O8 -","- C128 H192 Cl24.004 O32 -","4","1","CI6278","Saroj Cheenpracha; Suchada Chantrapromma; Chatchanok Karalai; Shazia Anjum; Kan Chantrapromma; Azhar Abdul Rahman; Xue-Mei Li; Hoong-Kun Fun","Absolute configuration of 14β-hydroxy-3β-<i>O</i>-(<small>L</small>-thevetosyl)-5β-card-20(22)-enolide chloroform disolvate","Acta Crystallographica Section E","2003","59","11","o1694","o1696","10.1107/S1600536803021822","","","0.71073","MoKα","","0.113","0.077","","","0.1974","0.2265","","","","","","1.04","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2202510","12.664","0.003","6.4003","0.0015","13.801","0.003","90","","97.015","0.005","90","","1110.2","0.4","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","Pachysamine A","[17-(1-Dimethylamino-ethyl)-10,13-dimethyl-hexadecahydro-cyclopenta[a] phenanthren-3-yl]-methyl-amine","","- C24 H44 N2 -","- C24 H44 N2 -","- C48 H88 N4 -","2","1","CI6279","M. Iqbal Choudhary; Kirshina Devkota; Shazia Anjum; Azhar Abdul Rahman; Hoong-Kun Fun; Atta-ur-Rahman","20-Dimethylamino-3α-methylamino-5α-pregnane","Acta Crystallographica Section E","2003","59","11","o1682","o1684","10.1107/S1600536803021810","","","0.71073","MoKα","","0.0688","0.058","","","0.1497","0.1587","","","","","","1.048","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202511","20.261","0.004","7.5561","0.0015","23.034","0.005","90","","100.11","0.03","90","","3471.6","1.3","150","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3-carbethoxy-2,6-diphenyl-4-piperidone","Ethyl 4-oxo-2,6-diphenyl-4-piperidine-3-carboxylate","","- C20 H21 N O3 -","- C20 H21 N O3 -","- C160 H168 N8 O24 -","8","2","CI6281","M. Subha Nandhini; V. Vijayakumar; A. Mostad; M. Sundaravadivelu; S. Natarajan","Ethyl 4-oxo-2,6-diphenyl-4-piperidine-3-carboxylate","Acta Crystallographica Section E","2003","59","11","o1672","o1674","10.1107/S1600536803021792","","","0.71073","MoKα","","0.0872","0.0676","","","0.1661","0.183","","","","","","1.103","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202512","26.99","0.02","9.862","0.009","19.276","0.017","90","","133.473","0.01","90","","3723","6","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","Bis{2-[(cyclopropylimino)methyl]phenolato}zinc(II)","","- C20 H20 N2 O2 Zn -","- C20 H20 N2 O2 Zn -","- C160 H160 N16 O16 Zn8 -","8","2","CI6282","You, Zhong-Lu; Lin, Yong-Shan; Liu, Wei-Sheng; Tan, Min-Yu; Zhu, Hai-Liang","Bis[2-(cyclopropyliminomethyl)phenolato]zinc(II)","Acta Crystallographica Section E","2003","59","11","m1025","m1027","10.1107/S1600536803023109","","","0.71073","MoKα","","0.0985","0.055","","","0.1292","0.159","","","","","","0.883","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202513","13.676","0.001","13.676","0.001","22.192","0.003","90","","90","","90","","4150.6","0.7","293","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Pyridine-2-carbaldehyde thiosemicarbazone 1.75-hydrate","","- C7 H11.5 N4 O1.75 S -","- C7 H11.5 N4 O1.75 S -","- C112 H184 N64 O28 S16 -","16","1","CI6283","Zhi Min Jin; Liang Shen; Lin He; Hong Guo; Hua Tong Wang","Pyridine-2-carbaldehyde thiosemicarbazone 1.75-hydrate","Acta Crystallographica Section E","2003","59","12","o1909","o1911","10.1107/S160053680302511X","","","0.71073","MoKα","","0.0655","0.0397","","","0.0878","0.0951","","","","","","0.93","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2202514","6.272","0.005","7.993","0.005","9.199","0.007","90","","108.645","0.009","90","","437","0.6","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","Levetiracetam","(-)-(S)-α-ethyl-2-oxo-1-pyrrolidineacetamide (2S)-2-(2-Oxo-pyrrolidin-1-yl)butanamide","","- C8 H14 N2 O2 -","- C8 H14 N2 O2 -","- C16 H28 N4 O4 -","2","1","CI6284","Song, Jian; Lou, Ke-Xia; Li, Xiao-Jun; Wu, Xiao-Ping; Feng, Rong-Xiu","2-(2-Oxopyrrolidin-1-yl)butyramide","Acta Crystallographica Section E","2003","59","11","o1772","o1773","10.1107/S1600536803022578","","","0.71073","MoKα","","0.0701","0.0448","","","0.1317","0.1442","","","","","","1.081","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202515","9.185","0.004","11.737","0.005","22.328","0.008","90","","95.167","0.006","90","","2397.3","1.7","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(2-aminopyridine)bis(4-fluorobenzoato)cadmium(II)","","- C24 H20 Cd F2 N4 O4 -","- C24 H20 Cd F2 N4 O4 -","- C96 H80 Cd4 F8 N16 O16 -","4","1","CI6285","Zhu, Hai-Liang; Qu, Yang; You, Zhong-Lu; Wang, Zhen-Dong; Yang, Feng; Tan, Min-Yu","Bis(2-aminopyridine)bis(4-fluorobenzoato)cadmium(II)","Acta Crystallographica Section E","2003","59","11","m1028","m1030","10.1107/S1600536803023006","","","0.71073","MoKα","","0.0408","0.0267","","","0.0582","0.0637","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202516","9.7154","0.0016","10.4598","0.0017","10.6997","0.0018","110.436","0.004","94.184","0.004","98.581","0.003","998.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-[(4-hydroxy-3-methoxyphenyl)ethenyl]-N-methylpyridinium p-toluenesulfonate","","- C22 H23 N O5 S -","- C22 H23 N O5 S -","- C44 H46 N2 O10 S2 -","2","1","CI6286","Azhar A. Rahman; Ibrahim Abdul Razak; Hoong-Kun Fun; Pornchai Saenee; Boonwasana Jindawong; Suchada Chantrapromma; Chatchanok Karalai","4-[(4-Hydroxy-3-methoxyphenyl)ethenyl]-<i>N</i>-methylpyridinium <i>p</i>-toluenesulfonate","Acta Crystallographica Section E","2003","59","11","o1798","o1800","10.1107/S1600536803023286","","","0.71073","MoKα","","0.0693","0.0646","","","0.1517","0.1551","","","","","","1.11","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202517","13.41","0.003","6.7225","0.0013","13.946","0.003","90","","104.032","0.004","90","","1219.7","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","Cyclovirobuxine D","4,4,14-Trimethyl-3α,20-bis(methylamino)-9,19-cyclo-5α-pregnan-16-ol","","- C26 H46 N2 O -","- C26 H46 N2 O -","- C52 H92 N4 O2 -","2","1","CI6287","M. Iqbal Choudhary; Shamsher Ali; Shazia Anjum; Azhar Abdul Rahman; Hoong-Kun Fun; Atta-ur-Rahman","4,4,14-Trimethyl-3α,20-bis(methylamino)-9,19-cyclo-5α-pregnan-16-ol","Acta Crystallographica Section E","2003","59","11","o1751","o1753","10.1107/S1600536803022499","","","0.71073","MoKα","","0.08","0.0641","","","0.1771","0.1919","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202518","12.34","0.002","6.8289","0.0013","21.71","0.004","90","","100.037","0.004","90","","1801.5","0.6","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","","17-Ethynyl-3,17α-dimethyoxy-5β-estra-1,3,5(10)-triene","","- C22 H28 O2 -","- C22 H28 O2 -","- C88 H112 O8 -","4","1","CI6288","Choudhary, M. Iqbal; Musharraf, Syed Ghulam; Anjum, Shazia; Rahman, Azhar Abul; Fun, Hoong-Kun; Atta-ur-Rahman","17-Ethynyl-3,17α-dimethoxy-5β-estra-1,3,5(10)-triene","Acta Crystallographica Section E","2003","59","11","o1745","o1747","10.1107/S1600536803022955","","","0.71073","MoKα","","0.059","0.058","","","0.149","0.151","","","","","","1.195","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202519","8.7281","0.0005","8.272","0.0004","16.9772","0.0009","90","","102.047","0.0009","90","","1198.74","0.11","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Dispiro[cyclopropane-1,1'(2'H)-cyclobuta[b]naphthalene-2',1''-cyclopropane] -3',8'-dione","","- C16 H12 O2 -","- C16 H12 O2 -","- C64 H48 O8 -","4","2","CI6289","Xue-Mei Li; Lei Wang; Jian-Hua Xu; Shu-Sheng Zhang; Hoong-Kun Fun","Dispiro[cyclopropane-1,1'(2'<i>H</i>)-cyclobuta[<i>b</i>]naphthalene-2',1''-cyclopropane]-3',8'-dione","Acta Crystallographica Section E","2003","59","11","o1742","o1744","10.1107/S1600536803022992","","","0.71073","MoKα","","0.0424","0.036","","","0.0946","0.1004","","","","","","1.044","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202520","7.5839","0.0008","7.9343","0.0007","23.543","0.002","90","","92.954","0.008","90","","1414.8","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-[4-(1-Oxo-3-phenylprop-2-en-1-yl)phenyl]sydnone","","- C17 H12 N2 O3 -","- C17 H12 N2 O3 -","- C68 H48 N8 O12 -","4","1","CI6290","Thamotharan, S.; Parthasarathi, V.; Hunnur, Raveendra K.; Shinge, Prashant S.; Badami, Bharati; Schenk, Kurt J.","3-[4-(1-Oxo-3-phenylprop-2-en-1-yl)phenyl]sydnone","Acta Crystallographica Section E","2003","59","11","o1762","o1763","10.1107/S1600536803022967","","","0.71073","MoKα","","0.0804","0.0647","","","0.192","0.207","","","","","","1.029","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202521","18.482","0.007","17.045","0.007","8.635","0.003","90","","117.094","0.005","90","","2421.7","1.6","293","2","293","2","","","","","","","","3","C 1 c 1","C -2yc","9","","{4-[(1-Naphthyl)vinyl]phenyl}di-p-tolylamine","","- C32 H27 N -","- C32 H27 N -","- C128 H108 N4 -","4","1","CI6291","Cao, Xiao-Dan; Liu, Dong-Zhi; Zhou,Xue-Qin; Sun, Shao-Feng","{4-[(1-Naphthyl)vinyl]phenyl}di-<i>p</i>-tolylamine","Acta Crystallographica Section E","2003","59","12","o1923","o1924","10.1107/S1600536803025285","","","0.71073","MoKα","","0.0896","0.0563","","","0.135","0.1544","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202522","7.7531","0.0008","9.7146","0.001","11.4051","0.0012","113.649","0.002","92.989","0.002","109.089","0.002","726.74","0.13","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 3-methyl-1-(2,4-dinitrophenyl)-1H-pyrazole-4-carboxylate","","- C13 H12 N4 O6 -","- C13 H12 N4 O6 -","- C26 H24 N8 O12 -","2","1","CI6292","S. Etti; G. Shanmugam; M. N. Ponnuswamy; R. Sridhar; R. Murugan; P. T. Perumal; K.Ravikumar","Ethyl 3-methyl-1-(2,4-dinitrophenyl)-1<i>H</i>-pyrazole-4-carboxylate","Acta Crystallographica Section E","2003","59","11","o1835","o1837","10.1107/S1600536803024371","","","0.71073","MoKα","","0.0532","0.0431","","","0.1195","0.128","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202523","14.8302","0.0011","7.3973","0.0005","25.3885","0.0018","90","","106.167","0.001","90","","2675.1","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2a,5a-Dichloro-4-methyl-1-methylene-2-phenyl-2a,5a-dihydrocyclobuta[c]pyrrole- 3,5-dione","","- C14 H11 Cl2 N O2 -","- C14 H11 Cl2 N O2 -","- C112 H88 Cl16 N8 O16 -","8","1","CI6293","Xue-Mei Li; Hua-You Hu; Jian-Hua Xu; Shu-Sheng Zhang; Hoong-Kun Fun","2a,5a-Dichloro-4-methyl-1-methylene-2-phenyl-2a,5a-dihydrocyclobuta[<i>c</i>]pyrrole-3,5-dione","Acta Crystallographica Section E","2003","59","11","o1822","o1823","10.1107/S1600536803024103","","","0.71073","MoKα","","0.0809","0.0633","","","0.1317","0.1379","","","","","","1.204","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202524","16.1912","0.001","10.3984","0.0006","12.6742","0.0008","90","","107.432","0.001","90","","2035.9","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Acetyl-4',5a'-diphenyl-2',2a',5',5a'-tetrahydrospiro[1H-indole-3,2'- oxeto[5,4-b]oxazol]-2(3H)-one","","- C25 H18 N2 O4 -","- C25 H18 N2 O4 -","- C100 H72 N8 O16 -","4","1","CI6294","Xue-Mei Li; Lei Wang; Jian-Hua Xu; Shu-Sheng Zhang; Hoong-Kun Fun","1-Acetyl-4',5'a-diphenyl-2',2'a,5',5'a-tetrahydrospiro[1<i>H</i>-indole-3,2'-oxeto[5,4-<i>b</i>]oxazol]-2(3<i>H</i>)-one","Acta Crystallographica Section E","2003","59","12","o1883","o1885","10.1107/S1600536803024644","","","0.71073","MoKα","","0.0788","0.0598","","","0.1274","0.1362","","","","","","1.167","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202525","5.5848","0.0001","8.0987","0.0002","31.2943","0.0006","90","","90","","90","","1415.43","0.05","160","2","160","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-(4-Butylphenyl)salicylaldimine","","- C17 H19 N O -","- C17 H19 N O -","- C68 H76 N4 O4 -","4","1","CI6295","Thamotharan, S.; Parthasarathi, V.; Anitha, S.M.; Prasad, Archana; Rao, T.R.; Linden, Anthony","<i>N</i>-(4-Butylphenyl)salicylaldimine at 160K","Acta Crystallographica Section E","2003","59","11","o1856","o1857","10.1107/S1600536803024231","","","0.71073","MoKα","","0.0647","0.0435","","","0.1002","0.1115","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202526","6.2333","0.0007","10.4182","0.0012","22.788","0.003","90","","90","","90","","1479.8","0.3","208","2","208","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","2-Hydroxy-3-tert-butyl-5-methylazobenzene","2-tert-butyl-4-metyl-6-(phenyldiazenyl)phenol","","- C17 H20 N2 O -","- C17 H20 N2 O -","- C68 H80 N8 O4 -","4","1","CI6296","Kocaokutgen, Hasan; Soylu, M. Serkan; Lörnecke, Peter; Özkınalı, Sevil","2-<i>tert</i>-Butyl-4-methyl-6-(phenyldiazenyl)phenol","Acta Crystallographica Section E","2003","59","12","o1932","o1934","10.1107/S1600536803025261","","","0.71073","MoKα","","0.0446","0.0369","","","0.0853","0.0894","","","","","","1.07","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202527","12.5558","0.001","8.5131","0.0007","18.6076","0.0015","90","","104.834","0.001","90","","1922.7","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","3α-feruloyltaraxerol dicholomethane","","- C41 H60 Cl2 O4 -","- C41 H60 Cl2 O4 -","- C82 H120 Cl4 O8 -","2","1","CI6298","Suchada Chantrapromma; Hoong-Kun Fun; Ibrahim Abdul Razak; Surat Laphookhieo; Chatchanok Karalai","Absolute configuration of 3α-feruloyltaraxerol dichloromethane solvate","Acta Crystallographica Section E","2003","59","12","o1864","o1866","10.1107/S1600536803024838","","","0.71073","MoKα","","0.0783","0.062","","","0.1416","0.1524","","","","","","1.112","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2202528","15.033","0.0003","6.8414","0.0001","16.1593","0.0004","90","","111.012","0.0008","90","","1551.43","0.05","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(R)-[1-Hydroxy-1-(3-nitrophenyl)-3-oxo-1,3-dihydroisoindol-2-yl] acetic acid methyl ester","","- C17 H14 N2 O6 -","- C17 H14 N2 O6 -","- C68 H56 N8 O24 -","4","1","CI6299","Baell, Jonathan B.; Duggan, Peter J.; Fallon, Gary D.; Lok, Y. Phei","Methyl (<i>RS</i>)-[1-hydroxy-1-(3-nitrophenyl)-3-oxo-1,3-dihydroisoindol-2-yl]acetate","Acta Crystallographica Section E","2003","59","12","o1958","o1959","10.1107/S1600536803025790","","","0.71073","MoKα","","0.1258","0.0472","","","0.0865","0.1094","","","","","","1.004","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202529","15.8948","0.001","8.7186","0.0005","13.5633","0.0009","90","","120.563","0.001","90","","1618.47","0.18","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4b,4c,9a,9c-Tetrachloro-4b,4c,9b,9c-tetrahydroindeno[1',2':3,4] cyclobuta[1,2-a]indene-5,10-dione","","- C18 H8 Cl4 O2 -","- C18 H8 Cl4 O2 -","- C72 H32 Cl16 O8 -","4","0.5","CI6300","Shu-Sheng Zhang; Min Zhang; Jian-Hua Xu; Xue-Mei Li; Hoong-Kun Fun","4b,4c,9b,9c-Tetrahydro-4b,4c,9b,9c-tetrachlorocyclobuta[1,2-<i>a</i>:3,4-<i>a</i>']diindene-5,10-dione","Acta Crystallographica Section E","2003","59","12","o1930","o1931","10.1107/S1600536803025236","","","0.71073","MoKα","","0.0325","0.0291","","","0.0814","0.0845","","","","","","1.054","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202530","8.242","0.001","8.819","0.0013","5.64","0.0006","104.325","0.011","107.919","0.009","108.32","0.011","342.37","0.09","296","2","296","2","","","","","","","","4","P -1","-P 1","2","2-dicyanomethylene-1,3-dithiole","(1,3-Dithiol-2-ylidene)propanedinitrile","","- C6 H2 N2 S2 -","- C6 H2 N2 S2 -","- C12 H4 N4 S4 -","2","1","CI6301","Tomura, Masaaki; Yamashita, Yoshiro","(1,3-Dithiol-2-ylidene)propanedinitrile","Acta Crystallographica Section E","2003","59","12","o1941","o1943","10.1107/S160053680302556X","","","0.71069","MoKα","","0.1761","0.0484","","","0.1075","0.1392","","","","","","0.948","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202531","7.382","0.005","26.375","0.005","7.511","0.005","90","","92.911","0.005","90","","1460.5","1.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(3-Ethyl-2,3,4,5-tetrahydro-4-oxo-2-thioxo-4-thiazolidin-5-ylidene)- 1,2-dihydroacenaphthylen-1-one","","- C17 H11 N O2 S2 -","- C17 H11 N O2 S2 -","- C68 H44 N4 O8 S8 -","4","1","CI6302","Sundar, T.V.; Parthasarathi, V.; García-Granda, S.; Jain, Abhinandan; Pardasani, R.T.","2-(3-Ethyl-2,3,4,5-tetrahydro-4-oxo-2-thioxo-4-thiazolidin-5-ylidene)-1,2-dihydroacenaphthylen-1-one","Acta Crystallographica Section E","2003","59","12","o1967","o1969","10.1107/S160053680302600X","","","1.5418","CuKα","","0.0941","0.0517","","","0.1231","0.1512","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202532","16.082","0.003","6.745","0.001","8.467","0.002","90","","90","","90","","918.4","0.3","298","2","298","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","catena-Poly[[triaquacobalt(II)]-μ-2,3-pyridinedicarboxylato-κ^2^O^2^:O^3^]","","- C7 H9 Co N O7 -","- C7 H9 Co N O7 -","- C28 H36 Co4 N4 O28 -","4","1","CI6305","Zhang, Xian-Ming; Fang, Rui-Qin; Wu, Hai-Shun; Ng, Seik Weng","<i>catena</i>-Poly[[triaquacobalt(II)]-μ-2,3-pyridinedicarboxylato-κ^2^<i>O</i>^2^:<i>O</i>^3^]","Acta Crystallographica Section E","2003","59","12","m1143","m1145","10.1107/S1600536803026023","","","0.71073","MoKα","","0.035","0.035","","","0.067","0.068","","","","","","0.97","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202533","21.7449","0.0007","5.637","0.0002","16.4499","0.0005","90","","96.83","0.002","90","","2002.05","0.11","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Benzylammonium hydrogen oxalate hemihydrate","","- C9 H12 N O4.5 -","- C9 H12 N O4.5 -","- C72 H96 N8 O36 -","8","1","CM6043","Barnes, John C.","Benzylammonium hydrogen oxalate hemihydrate","Acta Crystallographica Section E","2003","59","7","o931","o933","10.1107/S1600536803012303","","","0.71073","MoKα","","0.0438","0.0367","","","0.09","0.0947","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202534","9.4875","0.0002","6.7174","0.0002","18.3121","0.0005","90","","92.842","0.0001","90","","1165.62","0.05","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H14 Cl4 Co N2 -","- C6 H14 Cl4 Co N2 -","- C24 H56 Cl16 Co4 N8 -","4","1","CM6044","Bremner, Colin A.; Harrison, William T. A.","1,4-Diazoniabicyclo[2.2.2]octane tetrachlorocobaltate","Acta Crystallographica Section E","2003","59","7","m425","m426","10.1107/S1600536803011668","","","0.71073","MoKα","","0.0399","0.0324","","","0.075","0.0784","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202535","14.1639","0.0014","11.263","0.0011","8.6098","0.0008","90","","90","","90","","1373.5","0.2","150","2","150","2","","","","","","","","4","P n a 21","P 2c -2n","33","","4-(2-Allylphenoxy)phthalonitrile","","- C17 H12 N2 O -","- C17 H12 N2 O -","- C68 H48 N8 O4 -","4","1","CM6045","Köysal, Yavuz; Şamil Işık; Akdemir, Nasuhi; Erbil Ag̃ar; Vickee Mckee","4-(2-Allylphenoxy)phthalonitrile","Acta Crystallographica Section E","2003","59","8","o1183","o1184","10.1107/S1600536803015769","","","0.71073","MoKα","","0.0698","0.0578","","","0.1653","0.1782","","","","","","1.082","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202536","11.1814","0.0003","19.7359","0.0004","20.3672","0.0004","90","","90","","90","","4494.53","0.18","180","2","180","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","(η^3^-allyl)[(R)-(+)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl]palladium(II) trifluoromethanesulfonate dichloromethane solvate","","- C49 H39 Cl2 F3 O3 P2 Pd S -","- C49 H39 Cl2 F3 O3 P2 Pd S -","- C196 H156 Cl8 F12 O12 P8 Pd4 S4 -","4","1","CM6046","Jones, Matthew D.; Almeida Paz, Filipe A.; Davies, John E.; Johnson, Brian F. G.; Klinowski, Jacek","(η^3^-Allyl)[(<i>R</i>)-(+)-2,2'-bis(diphenylphosphino)-1,1'-binaphthyl]palladium(II) trifluoromethanesulfonate dichloromethane solvate","Acta Crystallographica Section E","2003","59","7","m538","m540","10.1107/S1600536803012741","","","0.71073","MoKα","","0.0538","0.0406","","","0.0705","0.0747","","","","","","1.051","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202537","13.0005","0.0014","13.2362","0.0015","13.8867","0.0009","68.062","0.002","74.315","0.002","71.376","0.002","2069.2","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H36 Cl6 Cu4 N8 O3 -","- C32 H36 Cl6 Cu4 N8 O3 -","- C64 H72 Cl12 Cu8 N16 O6 -","2","1","CM6047","Yun-Qian Zhang; Duan-Jun Xu; Jian-Rong Su","μ~4~-Oxo-hexa-μ~2~-chloro-tetrakis[(benzimidazole-κ<i>N</i>)copper(II)] ethanol disolvate: a reformulation","Acta Crystallographica Section E","2003","59","10","m919","m920","10.1107/S160053680301420X","","","0.71069","MoKα","","0.079","0.051","","","0.161","0.185","","","","","","0.859","","","","has coordinates,has disorder,has Fobs","199607","2020-10-21","18:00:00",""
"2202538","14.579","0.002","11.866","0.001","8.758","0.002","90","","123.13","0.01","90","","1268.8","0.4","210","2","210","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C8 H16 N2 O10 V -","- C8 H16 N2 O10 V -","- C32 H64 N8 O40 V4 -","4","0.5","CM6048","Kaludjerović, Goran N.; Heinemann, Frank W.; Leovac, Vukadin M.; Trifunović, Srećko R.; Sabo, Tibor J.","Ethylenediammonium aquabis(malonato)oxovanadate(IV)","Acta Crystallographica Section E","2003","59","7","m541","m542","10.1107/S160053680301417X","","","0.71073","MoKα","","0.0275","0.0253","","","0.0646","0.066","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202539","7.8718","0.0007","8.5597","0.0007","10.1327","0.0009","67.749","0.001","88.179","0.001","75.389","0.001","609.92","0.09","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","Bis(diisopropylammonium) 2,6-naphthalenedicarboxylate","","- C24 H38 N2 O4 -","- C24 H38 N2 O4 -","- C24 H38 N2 O4 -","1","0.5","CM6049","Ng, Seik Weng","Bis(diisopropylammonium) 2,6-naphthalenedicarboxylate","Acta Crystallographica Section E","2003","59","7","o1028","o1029","10.1107/S1600536803013862","","","0.71073","MoKα","","0.094","0.059","","","0.134","0.141","","","","","","0.72","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202540","11.3774","0.0006","12.4823","0.0007","18.437","0.001","90","","90","","90","","2618.4","0.2","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Morpholinium dihydrogen citrate dihydrate","","- C10 H19 N O9 -","- C10 H19 N O9 -","- C80 H152 N8 O72 -","8","1","CM6050","Chen, Can-Yu; Wei, Zan-Bin; Zhou, Zhao-Hui; Ng, Seik Weng","Morpholinium dihydrogen citrate hydrate","Acta Crystallographica Section E","2003","59","7","o1030","o1032","10.1107/S1600536803013874","","","0.71073","MoKα","","0.061","0.055","","","0.139","0.143","","","","","","1.15","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202541","7.0455","0.0015","21.623","0.004","6.5622","0.0013","90","","92.831","0.003","90","","998.5","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H10 Ca O7 -","- C8 H10 Ca O7 -","- C32 H40 Ca4 O28 -","4","1","CM6053","Dale, Sophie H.; Elsegood, Mark R. J.","<i>catena</i>-Poly[[diaquacalcium(II)]-μ~3~-terephthalato-μ~2~-aqua] at 150K","Acta Crystallographica Section E","2003","59","8","m586","m587","10.1107/S1600536803015071","","","0.71073","MoKα","","0.0794","0.0544","","","0.1311","0.1433","","","","","","1.045","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202542","19.522","0.004","10.738","0.002","13.628","0.003","90","","90","","90","","2856.8","1","153","2","153","2","","","","","","","","6","I m m a","-I 2b 2","74","","(η^6^-benzene)bis(η^6^-p-cymene)tri-μ-hydrido-μ~3~-oxo-triruthenium hexafluorophosphate","","- C26 H37 F6 O P Ru3 -","- C26 H37 F6 O P Ru3 -","- C104 H148 F24 O4 P4 Ru12 -","4","0.25","CM6054","Vieille-Petit, Ludovic; Therrien, Bruno; Süss-Fink, Georg","(η^6^-Benzene)bis(η^6^-<i>p</i>-cymene)tri-μ-hydrido-μ~3~-oxo-triruthenium hexafluorophosphate","Acta Crystallographica Section E","2003","59","8","m669","m670","10.1107/S1600536803016222","","","0.71073","MoKα","","0.0469","0.0329","","","0.0745","0.0775","","","","","","0.917","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202543","24.457","0.002","7.5165","0.0012","23.865","0.002","90","","116.768","0.009","90","","3917","0.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H27 N2 O3.5 -","- C20 H27 N2 O3.5 -","- C160 H216 N16 O28 -","8","1","CM6055","Hökelek, Tuncer; Bilge, Selen; Kılıç, Zeynel","1,15-Diaza-3,4:12,13-dibenzo-5,8,11-trioxacycloheptadecane hemihydrate","Acta Crystallographica Section E","2003","59","11","o1607","o1609","10.1107/S1600536803021615","","","0.71073","MoKα","","0.1202","0.0516","","","0.1388","0.1686","","","","","","1.015","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202544","9.552","0.001","13.461","0.001","11.357","0.001","90","","106.235","0.007","90","","1402","0.2","296.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H9 Co O3 S6 -","- C6 H9 Co O3 S6 -","- C24 H36 Co4 O12 S24 -","4","1","CM6056","Tetsuzo Ito","Tris(<i>O</i>-methyl dithiocarbonato)cobalt(III)","Acta Crystallographica Section E","2003","59","10","m892","m893","10.1107/S1600536803019937","","","0.7107","MoKα","","","0.029","","","","0.036","","","","","","1.66","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202545","12.7305","0.0011","6.1929","0.0006","9.5856","0.001","90","","100.073","0.008","90","","744.07","0.13","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,3,4,5,6-Pentafluorobenzamide","","- C7 H2 F5 N O -","- C7 H2 F5 N O -","- C28 H8 F20 N4 O4 -","4","1","CM6057","Maria Gdaniec","2,3,4,5,6-Pentafluorobenzamide","Acta Crystallographica Section E","2003","59","11","o1642","o1644","10.1107/S1600536803021871","","","0.71073","MoKα","","0.0396","0.0352","","","0.0869","0.0904","","","","","","1.128","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202546","8.555","0.003","9.445","0.002","11.322","0.004","83.76","0.02","72.52","0.03","77.18","0.02","850","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","isopropyl 2-methyl-4-(3-nitrophenyl)-5,7-dioxo-4,5,6,7-tetrahydro-1H- pyrrolo[3,4-b]pyridine-3-carboxylate","","- C18 H17 N3 O6 -","- C18 H17 N3 O6 -","- C36 H34 N6 O12 -","2","1","CM6058","Vrábel, Viktor; Marchalín, Štefan; Kožišek, Jozef","Isopropyl 2-methyl-4-(3-nitrophenyl)-5,7-dioxo-4,5,6,7-tetrahydro-1<i>H</i>-pyrrolo[3,4-<i>b</i>]pyridine-3-carboxylate","Acta Crystallographica Section E","2003","59","10","o1570","o1571","10.1107/S1600536803021020","","","0.71069","MoKα","","0.2153","0.0599","","","0.0733","0.0833","","","","","","0.878","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202547","12.461","0.005","23.934","0.005","18.541","0.005","90","0.005","96.545","0.005","90","0.005","5494","3","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","decacarbonyltetrahydrobis(tricyclopentylphosphine)-tetrahedro-tetraruthenium","","- C46 H70 O10 P2 Ru4 -","- C46 H70 O10 P2 Ru4 -","- C184 H280 O40 P8 Ru16 -","4","1","CV6193","Lozano Diz, Enrique; Therrien, Bruno; Süss-Fink, Georg","Decacarbonyltetra-μ-hydrido-bis(tricyclohexylphosphine)-<i>tetrahedro</i>-tetraruthenium","Acta Crystallographica Section E","2003","59","7","m431","m433","10.1107/S1600536803010833","","","0.71073","MoKα","","0.0704","0.0266","","","0.0394","0.0446","","","","","","0.745","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202548","14.1354","0.0007","5.5364","0.0003","15.5323","0.0007","90","","116.354","0.001","90","","1089.21","0.09","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Triethanolammonium dihydrogenphosphate","","- C6 H18 N O7 P -","- C6 H17.187 N O7 P -","- C24 H68.748 N4 O28 P4 -","4","2","CV6195","Demir, Selcuk; Yilmaz, Veysel T.; Harrison, William T. A.","Triethanolammonium dihydrogenphosphate","Acta Crystallographica Section E","2003","59","7","o907","o909","10.1107/S1600536803011188","","","0.71073","MoKα","","0.0511","0.0368","","","0.0799","0.0843","","","","","","0.978","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202549","7.029","0.0015","10.141","0.002","11.205","0.003","96.4","0.02","102.944","0.017","108.394","0.016","724.2","0.3","293","2","293","","","","","","","","","5","P -1","-P 1","2","","3-Benzyl-4-(p-Fluorobenzylidenamino)-4,5-dihydro-1H-1,2,4-triazol-5-one","","- C16 H13 F N4 O -","- C16 H13 F N4 O -","- C32 H26 F2 N8 O2 -","2","1","CV6196","Şamil Işık; Kahveci, Bahittin; Ayşen Ag̃ar; Selami Şaşmaz","3-Benzyl-4-(<i>p</i>-fluorobenzylidenamino)-4,5-dihydro-1<i>H</i>-1,2,4-triazol-5-one","Acta Crystallographica Section E","2003","59","7","o1053","o1054","10.1107/S1600536803011474","","","0.71073","MoKα","","0.0701","0.0472","","","0.1288","0.153","","","","","","0.997","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202550","4.0135","0.0008","11.691","0.002","11.986","0.002","117.09","0.03","90.79","0.03","91.89","0.03","500.2","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-Amino-2-(p-chlorophenyl)-5-methyl-3,4-dihydro-2H-1,2,4-triazol-3-one","","- C9 H9 Cl N4 O -","- C9 H9 Cl N4 O -","- C18 H18 Cl2 N8 O2 -","2","1","CV6198","Thamotharan, S.; Parthasarathi, V.; Kavali, Jyoti R.; Badami, Bharati; Schenk, Kurt J.","4-Amino-2-(<i>p</i>-chlorophenyl)-5-methyl-3,4-dihydro-2<i>H</i>-1,2,4-triazol-3-one","Acta Crystallographica Section E","2003","59","7","o964","o966","10.1107/S1600536803012480","","","0.71073","MoKα","","0.0482","0.0422","","","0.1117","0.1173","","","","","","1.062","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202551","9.7951","0.0017","11.342","0.002","11.952","0.002","75.037","0.003","75.962","0.003","89.058","0.003","1243","0.4","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","triphenyl(methylcyclohexyl)dithiocarbamato tin(IV)","","- C26 H29 N S2 Sn -","- C26 H29 N S2 Sn -","- C52 H58 N2 S4 Sn2 -","2","1","CV6199","Normah Awang; Ibrahim Baba; M. Sukeri M. Yusof; Bohari M. Yamin","(<i>N</i>-Cyclohexyl-<i>N</i>-methyldithiocarbamato)triphenyltin(IV)","Acta Crystallographica Section E","2003","59","7","m414","m415","10.1107/S1600536803011991","","","0.71073","MoKα","","0.026","0.025","","","0.069","0.07","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202552","11.134","0.002","8.379","0.002","11.265","0.002","90","","115.39","0.03","90","","949.4","0.4","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Aqua(4,4-bipyridine)phthalatonickel(II) trihydrate","","- C18 H20 N2 Ni O8 -","- C18 H20 N2 Ni O8 -","- C36 H40 N4 Ni2 O16 -","2","1","CV6200","Yang, Shi-Yao; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","Aqua(4,4-bipyridine)phthalatonickel(II) trihydrate","Acta Crystallographica Section E","2003","59","7","m507","m509","10.1107/S1600536803013448","","","0.71073","MoKα","","0.091","0.06","","","0.137","0.153","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202553","16.621","0.005","9.004","0.005","31.494","0.005","90","0.005","90","0.005","90","0.005","4713","3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4,4'-(N-Phenyl-2,2'-iminodiethanoxy)diphthalonitrile","","- C26 H19 N5 O2 -","- C26 H19 N5 O2 -","- C208 H152 N40 O16 -","8","1","CV6201","Ocak, Nazan; Aǧar, Ayşen; Akdemir, Nesuhi; Aǧar, Erbil; García-Granda, S.; Erdönmez, Ahmet","4,4'-(<i>N</i>-Phenyl-2,2'-iminodiethanoxy)diphthalonitrile","Acta Crystallographica Section E","2003","59","7","o1000","o1001","10.1107/S1600536803013400","","","1.5418","CuKα","","0.0969","0.0443","","","0.1044","0.1376","","","","","","1.009","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202554","10.748","0.0002","8.328","0.0001","27.9084","0.0004","90","","90","","90","","2498.06","0.07","160","2","160","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-[(2-Oxopyrrolidin-1-yl)carbonylmethyl]-2,3-dihydro-1H-isoindole-1,3-dione","","- C14 H12 N2 O4 -","- C14 H12 N2 O4 -","- C112 H96 N16 O32 -","8","1","CV6202","Thamotharan, S.; Parthasarathi, V.; Gupta, P.; Jindal, D. P.; Piplani, P.; Linden, Anthony","2-[(2-Oxopyrrolidin-1-yl)carbonylmethyl]-2,3-dihydro-1<i>H</i>-isoindole-1,3-dione: an antiamnesic agent","Acta Crystallographica Section E","2003","59","7","o1012","o1013","10.1107/S1600536803013679","","","0.71073","MoKα","","0.0869","0.0465","","","0.1097","0.1285","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202555","12.213","0.002","22.317","0.002","7.091","0.005","89.47","0.02","89.17","0.02","84.72","0.08","1924.2","1.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","Ethane-1,2-diammonium bis(4-nitrobenzoate) bishydrate","","- C16 H22 N4 O10 -","- C16 H22 N4 O10 -","- C64 H88 N16 O40 -","4","2","CV6203","Daniel E. Lynch; Peter C. Healy","Ethane-1,2-diammonium bis(4-nitrobenzoate) dihydrate","Acta Crystallographica Section E","2003","59","7","o1058","o1059","10.1107/S1600536803014144","","","0.71073","MoKα","","0.1228","0.0436","","","0.1161","0.1501","","","","","","0.995","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202556","8.9941","0.0002","19.8913","0.0004","10.3244","0.0002","90","","90","","90","","1847.08","0.07","160","2","160","1","","","","","","","","4","P n a 21","P 2c -2n","33","","4-Furoyl-2,3,4,5,6,7-hexahydro-r-2,c-7-diphenyl-1H-1,4-diazepin-5-one","","- C22 H20 N2 O3 -","- C22 H20 N2 O3 -","- C88 H80 N8 O12 -","4","1","CV6204","S. Thamotharan; V. Parthasarathi; M. Muthukumar; K. Thanikasalam; R. Jeyaraman; Linden, Anthony","4-Furoyl-2,3,4,5,6,7-hexahydro-<i>r</i>-2,<i>c</i>-7-diphenyl-1<i>H</i>-1,4-diazepin-5-one: supramolecular aggregation through C—H···O interactions","Acta Crystallographica Section E","2003","59","8","o1117","o1119","10.1107/S1600536803014661","","","0.71073","MoKα","","0.0437","0.0365","","","0.0907","0.096","","","","","","1.055","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2202557","51.8464","0.0006","5.9134","0.0001","8.3112","0.0001","90","","97.4569","0.0005","90","","2526.57","0.06","160","2","160","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N,N-dimethyl-2-(2-naphthyloxy)acetamide monohydrate","","- C14 H17 N O3 -","- C14 H17 N O3 -","- C112 H136 N8 O24 -","8","1","CV6205","Thamotharan, S.; Parthasarathi, V.; Gupta, P.; Jindal, D. P.; Piplani, P.; Linden, Anthony","<i>N,N</i>-Dimethyl-2-(2-naphthyloxy)acetamide monohydrate","Acta Crystallographica Section E","2003","59","8","o1120","o1122","10.1107/S1600536803014739","","","0.71073","MoKα","","0.0949","0.066","","","0.1887","0.2129","","","","","","1.073","","","","has coordinates,has disorder,has Fobs","194389","2020-10-21","18:00:00",""
"2202558","14.3423","0.0015","5.8708","0.0003","15.273","0.0014","90","","114.963","0.007","90","","1165.86","0.19","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H11 Cl N4 O -","- C10 H11 Cl N4 O -","- C40 H44 Cl4 N16 O4 -","4","1","CV6206","Ocak, Nazan; Kahveci, Bahattin; Şaşmaz, Selami; Aǧar, Erbil; Erdönmez, Ahmet","4-(<i>m</i>-Chlorobenzylamino)-3-methyl-4,5-dihydro-1<i>H</i>-1,2,4-triazol-5-one","Acta Crystallographica Section E","2003","59","8","o1137","o1138","10.1107/S1600536803015058","","","0.71073","MoKα","","0.1004","0.0625","","","0.1899","0.2053","","","","","","0.856","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202559","7.69","0.004","10.214","0.006","11.643","0.006","98.479","0.013","94.262","0.012","110.338","0.013","840.3","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis{μ-N-[1-(2- oxidophenyl)ethylidene]benzohydrazido}bis[(dimethylsulfoxido)zinc(II)]","","- C34 H36 N4 O6 S2 Zn2 -","- C34 H36 N4 O6 S2 Zn2 -","- C34 H36 N4 O6 S2 Zn2 -","1","0.5","CV6208","Hapipah Ali; Zuraina Kadir; M. Sukeri M. Yusof; Bohari M. Yamin","Bis{μ-<i>N</i>-[1-(2-oxidophenyl)ethylidene]benzohydrazido}bis[(dimethylsulfoxide)zinc(II)]","Acta Crystallographica Section E","2003","59","8","m655","m657","10.1107/S1600536803016118","","","0.71073","MoKα","","0.025","0.024","","","0.067","0.068","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202560","10.14","0.0013","8.6742","0.0009","19.65","0.002","90","","100.834","0.009","90","","1697.5","0.3","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C8 H16 F6 Li N O6 S2 -","- C8 H16 F6 Li N O6 S2 -","- C32 H64 F24 Li4 N4 O24 S8 -","4","1","CV6209","Lerner, Hans-Wolfram; Bolte, Michael","Lithium triethylammonium bis(trifluoromethanesulfonate)","Acta Crystallographica Section E","2003","59","8","m625","m626","10.1107/S1600536803015241","","","0.71073","MoKα","","0.0504","0.0293","","","0.0564","0.0579","","","","","","0.899","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202561","8.8574","0.0008","10.595","0.001","8.0634","0.0005","90","","118.939","0.006","90","","662.22","0.1","300","2","300","2","","","","","","","","5","C 1 2 1","C 2y","5","","Dichloro[trans-(1R,2R)-N,N,N',N'-tetramethylcyclohexane-1,2-diamine]copper(II)","","- C10 H22 Cl2 Cu N2 -","- C10 H22 Cl2 Cu N2 -","- C20 H44 Cl4 Cu2 N4 -","2","0.5","CV6210","Svitlana V. Pavlova; Wen, Yuh-Sheng; Sunney I. Chan","Dichloro[<i>trans</i>-(1<i>R</i>,2<i>R</i>)-<i>N,N,N</i>',<i>N</i>'-tetramethylcyclohexane-1,2-diamine]copper(II)","Acta Crystallographica Section E","2003","59","9","m792","m793","10.1107/S1600536803017264","","","0.71073","MoKα","","0.0497","0.0392","","","0.0956","0.1508","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202562","9.66","0.003","22.381","0.008","10.441","0.004","90","","99.049","0.005","90","","2229.3","1.4","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","tetramolybdenumcobaltdiphosphonate","octasodium(I) cobalt(II) tetramolybdenum(VI) bis(1-hydroxyethylidenediphosphate) octadecahydrate","","- C4 H42 Co Mo4 Na8 O44 P4 -","- C4 H6 Co Mo4 Na8 O44 P4 -","- C8 H12 Co2 Mo8 Na16 O88 P8 -","2","0.5","CV6211","Ren, Shuhua; Xue, Ganglin; Li, Jun; Shi, Qizhen; Wang, Daqi; Wang, Jiwu","A new tetramolybdenumcobaltdiphosphonate, Na~8~[CoMo~4~O~12~{MeC(O)(PO~3~)~2~}~2~]·18H~2~O","Acta Crystallographica Section E","2003","59","9","m759","m761","10.1107/S1600536803017835","","","0.71073","MoKα","","0.0765","0.0355","","","0.0601","0.0686","","","","","","0.848","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202563","13.2141","0.0009","9.8945","0.0005","17.8861","0.0012","90","","97.336","0.005","90","","2319.4","0.3","293","2","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Phenyl-5-p-tolyl-4-(3,4,5-trimethoxybenzylamino)-4H-1,2,4-triazole","","- C25 H25 N4 O3 -","- C25 H26 N4 O3 -","- C100 H104 N16 O12 -","4","1","CV6212","Şamil Işık; B. Can Olcay; Ayşen Ag̃ar; Selami Şaşmaz","3-Phenyl-5-<i>p</i>-tolyl-4-(3,4,5-trimethoxybenzylamino)-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2003","59","10","o1535","o1537","10.1107/S1600536803017148","","","0.71073","MoKα","","0.118","0.0699","","","0.2076","0.2244","","","","","","0.834","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202564","12.955","0.002","5.5463","0.001","11.423","0.002","90","","106.288","0.004","90","","787.8","0.2","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis(8-quinolinolato-κ^2^N,O)zinc(II)","","- C18 H16 N2 O4 Zn -","- C18 H16 N2 O4 Zn -","- C36 H32 N4 O8 Zn2 -","2","0.5","CV6213","Chen, Zhen-Feng; Zhang, Ming; Shi, Shao-Ming; Huang, Ling; Liang, Hong; Zhou, Zhong-Yuan","Diaquabis(8-quinolinolato-κ^2^<i>N</i>,<i>O</i>)zinc(II)","Acta Crystallographica Section E","2003","59","9","m814","m815","10.1107/S1600536803018427","","","0.71073","MoKα","","0.056","0.042","","","0.109","0.117","","","","","","1.024","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2202565","8.5176","0.0007","15.5566","0.0012","17.2643","0.0015","113.407","0.006","94.601","0.007","103.763","0.006","1999.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 4-[1-(4-bromophenyl)-3-methyl-5-oxo-4,5-dihydro- 1H-1,2,4-triazol-4-yliminomethyl]phenoxyacetate","","- C20 H19 Br N4 O4 -","- C20 H19 Br N4 O4 -","- C80 H76 Br4 N16 O16 -","4","2","CV6214","Thamotharan, S; Parthasarathi, V; Sunagar, Vinay; Badami, Bharati; Schenk, Kurt J.","Ethyl 4-[1-(4-bromophenyl)-3-methyl-5-oxo-4,5-dihydro-1<i>H</i>-1,2,4-triazol-4-yliminomethyl]phenoxyacetate","Acta Crystallographica Section E","2003","59","9","o1272","o1274","10.1107/S1600536803016969","","","0.71073","MoKα","","0.0777","0.0462","","","0.1123","0.1262","","","","","","1.018","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202566","8.4277","0.0007","14.2923","0.0011","17.4582","0.0013","103.671","0.002","98.23","0.002","103.877","0.002","1938.6","0.3","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","cis-Bis[N-(2-chlorobenzoyl)-N',N'-diphenylthioureato]nickel(II) dichloromethane solvate","","- C41 H30 Cl4 N4 Ni O2 S2 -","- C41 H30 Cl4 N4 Ni O2 S2 -","- C82 H60 Cl8 N8 Ni2 O4 S4 -","2","1","CV6215","Binzet, Gün; Flörke, Ulrich; Külcü, Nevzat; Arslan, Hakan","<i>cis</i>-Bis[<i>N</i>-(2-chlorobenzoyl)-<i>N</i>',<i>N</i>'-diphenylthioureato]nickel(II) dichloromethane solvate","Acta Crystallographica Section E","2003","59","9","m705","m706","10.1107/S1600536803017069","","","0.71073","MoKα","","0.084","0.043","","","0.054","0.063","","","","","","0.81","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202567","9.9294","0.0016","7.291","0.0012","9.1653","0.0015","90","","90","","90","","663.52","0.19","200","2","200","2","","","","","","","","4","P n a 21","P 2c -2n","33","","(1α,6α,7α,7aβ)-2,3,5,6,7,7a-Hexahydro-1,6-epoxy-1H-pyrrolizin-7-ol","","- C7 H11 N O2 -","- C7 H11 N O2 -","- C28 H44 N4 O8 -","4","1","CV6216","Richard S. Glass; Donald R.Deardorff; Nhu Y. T. Stessman; Carducci, Michael D.","(1α,6α,7α,7aβ)-2,3,5,6,7,7a-Hexahydro-1,6-epoxy-1<i>H</i>-pyrrolizin-7-ol","Acta Crystallographica Section E","2003","59","9","o1270","o1271","10.1107/S1600536803016970","","","0.71073","MoKα","","0.0385","0.032","","","0.0767","0.0809","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202568","7.928","0.0007","5.5192","0.0005","12.794","0.0011","90","","104.803","0.002","90","","541.24","0.08","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C6 H18 N O6 P -","- C6 H18 N O6 P -","- C12 H36 N2 O12 P2 -","2","1","CV6217","Harrison, William T. A.","Triethanolammonium dihydrogenphosphite","Acta Crystallographica Section E","2003","59","9","o1267","o1269","10.1107/S1600536803016982","","","0.71073","MoKα","","0.0592","0.0394","","","0.0807","0.0865","","","","","","0.938","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202569","11.532","0.005","11.532","0.005","5.328","0.005","90","","90","","120","","613.6","0.7","293","2","293","2","","","","","","","","3","P 31","P 31","144","","","","- C7 H10 O5 -","- C7 H10 O5 -","- C21 H30 O15 -","3","1","CV6218","Blann, Kevin; Williams, D. Bradley G.; Roodt, Andreas; Muller, Alfred","(1<i>R</i>*,5<i>R</i>*,6<i>S</i>*,7<i>R</i>*)-6,7-Dihydroxy-6-hydroxymethyl-2-oxabicyclo[3.2.0]heptan-3-one","Acta Crystallographica Section E","2003","59","10","o1551","o1553","10.1107/S1600536803017975","","","0.71069","MoKα","","0.0883","0.0347","","","0.0569","0.0671","","","","","","0.897","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202570","4.0213","0.0001","6.912","0.0001","23.0998","0.0003","90","","90","","90","","642.06","0.02","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","1-nitro-7,8-diazapentalene","1-nitro-7,8-diazapentalene","","- C6 H5 N3 O2 -","- C6 H5 N3 O2 -","- C24 H20 N12 O8 -","4","1","CV6219","Butcher, Ray J.; Bottaro, Jeffrey C.; Gilardi, R.","1-Nitro-7,8-diazapentalene","Acta Crystallographica Section E","2003","59","11","o1777","o1779","10.1107/S160053680302004X","","","1.54178","CuKα","","0.0356","0.0345","","","0.092","0.0929","","","","","","1.062","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202571","7.0098","0.0015","9.363","0.002","13.344","0.003","90","","90","","90","","875.8","0.3","93","2","93","2","","","","","","","","4","P c 21 b","P -2bc -2c","29","1,3,4-trinitro-7,8-diazapentalene","1,3,4-trinitro-7,8-diazapentalene","","- C6 H3 N5 O6 -","- C6 H3 N5 O6 -","- C24 H12 N20 O24 -","4","1","CV6220","Butcher, Ray J.; Bottaro, Jeffrey C.; Gilardi, R.","1,3,4-Trinitro-7,8-diazapentalene","Acta Crystallographica Section E","2003","59","11","o1780","o1782","10.1107/S1600536803020051","","","0.71073","MoKα","","0.0513","0.0479","","","0.109","0.1104","","","","","","1.183","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202572","7.211","0.001","9.48","0.002","16.451","0.003","96.16","0.01","102.41","0.01","105.3","0.01","1043.2","0.3","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","2,7-dicyano-9-dicyanomethylene-4,5-dinitrofluorene‒benzonitrile (1/1)","","- C25 H9 N7 O4 -","- C25 H9 N7 O4 -","- C50 H18 N14 O8 -","2","1","CV6221","Batsanov, Andrei S.; Perepichka, Dmitrii F.","A 1:1 cocrystal of 2,7-dicyano-9-dicyanomethylene-4,5-dinitrofluorene and benzonitrile","Acta Crystallographica Section E","2003","59","9","o1318","o1320","10.1107/S160053680301794X","","","0.71073","MoKα","","0.102","0.0473","","","0.0891","0.1055","","","","","","0.953","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202573","10.6427","0.0002","8.8035","0.0002","14.4306","0.0002","90","","110.974","0.0011","90","","1262.47","0.04","160","2","160","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(2-naphthyloxymethylcarbonyl)pyrrolidine","","- C16 H17 N O2 -","- C16 H17 N O2 -","- C64 H68 N4 O8 -","4","1","CV6222","Thamotharan, S.; Parthasarathi, V.; Gupta, P.; Jindal, D.P.; Piplani, P.; Linden, Anthony","<i>N</i>-(2-Naphthyloxymethylcarbonyl)pyrrolidine","Acta Crystallographica Section E","2003","59","9","o1334","o1335","10.1107/S1600536803017987","","","0.71073","MoKα","","0.0719","0.0516","","","0.1307","0.1439","","","","","","1.052","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202574","6.702","0.002","13.099","0.005","14.893","0.003","90","","90","","90","","1307.4","0.7","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H22 N2 O6 -","- C12 H22 N2 O6 -","- C48 H88 N8 O24 -","4","1","CV6223","Furneaux, Richard H.; Gainsford, Graeme J.; Mason, Jennifer M.; Tyler, Peter C.","(1<i>R</i>,2<i>R</i>,3<i>S</i>,5<i>R</i>,6<i>R</i>,7<i>S</i>,9a<i>R</i>,10a<i>R</i>)-4a,8a-Diazaperhydroanthracene-1,2,3,5,6,7-hexaol","Acta Crystallographica Section E","2003","59","9","o1370","o1371","10.1107/S1600536803018397","","","0.71073","MoKα","","0.066","0.046","","","0.087","0.094","","","","","","0.976","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202575","6.8961","0.0008","11.2426","0.0009","12.5118","0.0014","90","","90.611","0.009","90","","969.99","0.17","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Trichloro(diethyl ether-κO)aluminum(III)","","- C4 H10 Al Cl3 O -","- C4 H10 Al Cl3 O -","- C16 H40 Al4 Cl12 O4 -","4","1","CV6224","Hubener, Lukas; Lerner, Hans-Wolfram; Bolte, Michael","Trichloro(diethyl ether-κ<i>O</i>)aluminium(III) from a twinned crystal","Acta Crystallographica Section E","2003","59","10","m929","m930","10.1107/S1600536803018403","","","0.71073","MoKα","","0.046","0.041","","","0.103","0.11","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202576","25.236","0.001","9.6427","0.0005","14.0761","0.0006","90","","90","","90","","3425.3","0.3","173","2","173","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","trans-μ-But-2-ene-1,4-diyl-dichlorobis(tri-tert- butylsilyl)digermanium(Ge‒Ge)","","- C28 H60 Cl2 Ge2 Si2 -","- C28 H60 Cl2 Ge2 Si2 -","- C112 H240 Cl8 Ge8 Si8 -","4","0.5","CV6225","Lerner, Hans-Wolfram; Dürner, Gerd; Bolte, Michael","<i>trans</i>-μ-But-2-ene-1,4-diyldichlorobis(tri-<i>tert</i>-butylsilyl)digermanium(Ge‒Ge)","Acta Crystallographica Section E","2003","59","9","m816","m817","10.1107/S1600536803018415","","","0.71073","MoKα","","0.046","0.027","","","0.055","0.059","","","","","","0.867","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202577","12.3359","0.001","12.5288","0.0012","13.9855","0.0011","90","","96.272","0.006","90","","2148.6","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,5-Diphenyl-4-(3,4,5-trimethoxybenzylidenamino)-4H-1,2,4-triazole","","- C24 H22 N4 O3 -","- C24 H22 N4 O3 -","- C96 H88 N16 O12 -","4","1","CV6226","Atalay, Şehriman; Yavuz, Metin; Bekircan,Olcay; Aǧar, Ayşen; Şaşmaz, Selami","3,5-Diphenyl-4-(3,4,5-trimethoxybenzylideneamino)-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2003","59","10","o1528","o1529","10.1107/S1600536803020270","","","0.71073","MoKα","","0.0765","0.0412","","","0.0906","0.0965","","","","","","0.743","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202578","10.4722","0.0016","24.3161","0.0009","13.6729","0.0014","90","","93.627","0.001","90","","3474.7","0.7","293","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aqua(oxydiacetato-κ^3^O,O',O'')(1,10-phenanthroline-κ^2^N,N')cobalt(II) sesquihydrate","","- C16 H17 Co N2 O7.5 -","- C16 H17 Co N2 O7.5 -","- C128 H136 Co8 N16 O60 -","8","2","CV6227","Zhi-Yong Wu; Yu-Hong Xue; Duan-Jun Xu","Aqua(oxydiacetato-κ^3^<i>O,O</i>',<i>O</i>'')(1,10-phenanthroline-κ^2^<i>N,N</i>')cobalt(II) sesquihydrate","Acta Crystallographica Section E","2003","59","9","m809","m811","10.1107/S1600536803018762","","","0.71073","MoKα","","0.07","0.038","","","0.079","0.109","","","","","","0.933","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202579","8.839","0.0012","10.157","0.004","12.672","0.002","79.37","0.02","72.31","0.02","87.93","0.02","1065","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","tpthio","S-(3,5-dimethoxyphenyl)-triphenylmethanethiolate","","- C27 H24 O2 S -","- C27 H24 O2 S -","- C54 H48 O4 S2 -","2","1","CV6228","Vande Velde, Christophe M.L.; Geise, Herman J.; Blockhuys, Frank","1,3-Dimethoxy-5-(triphenylmethylthio)benzene","Acta Crystallographica Section E","2003","59","10","o1512","o1513","10.1107/S1600536803019718","","","0.71073","MoKα","","0.0746","0.0387","","","0.1006","0.1129","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202580","10.798","0.002","6.281","0.001","15.045","0.002","90","","100.82","0.01","90","","1002.2","0.3","296.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H20 Fe N2 O6 -","- C22 H20 Fe N2 O6 -","- C44 H40 Fe2 N4 O12 -","2","0.5","CV6229","Okabe, Nobuo; Muranishi, Yasunori","<i>trans</i>-Bis(isoquinoline-3-carboxylato-κ^2^<i>N,O</i>)bis(methanol-κ<i>O</i>)iron(II)","Acta Crystallographica Section E","2003","59","10","m897","m899","10.1107/S160053680301972X","","","0.7107","MoKα","","","0.0388","","","","0.1414","","","","","","0.863","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202581","6.865","0.001","21.647","0.003","17.214","0.003","90","","113.21","0.02","90","","2351.1","0.7","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H16 Cu N10 O4 -","- C24 H16 Cu N10 O4 -","- C96 H64 Cu4 N40 O16 -","4","1","CV6230","Albada, Gerard A. van; Mutikainen, Ilpo; Turpeinen, Urho; Reedijk, Jan","Bis(2,2-bipyridine <i>N</i>,<i>N</i>'-dioxide-κ^2^<i>O</i>,<i>O</i>')bis(dicyanamido-κ<i>N</i>^1^)copper(II)","Acta Crystallographica Section E","2003","59","10","m889","m891","10.1107/S1600536803019639","","","0.71073","MoKα","","0.1022","0.0535","","","0.1129","0.1281","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202582","10.098","0.002","10.477","0.002","8.22","0.002","90","","90","","90","","869.6","0.3","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","1,2-diaminoethanesilver(I) hexafluoroarsenate","","- C2 H8 Ag As F6 N2 -","- C2 H8 Ag As F6 N2 -","- C8 H32 Ag4 As4 F24 N8 -","4","0.5","CV6231","Zhu, Hai-Liang; Sun, Zhi-Yuan; Rong, Na-Na; Zhang, Biao; Zhang, Min; Li, Yong","<i>catena</i>-Poly[[silver(I)-μ-1,2-diaminoethane] hexafluoroarsenate]","Acta Crystallographica Section E","2003","59","10","m906","m907","10.1107/S1600536803019731","","","0.71073","MoKα","","0.0554","0.0478","","","0.1311","0.1354","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202583","12.483","0.0007","12.6558","0.0008","19.0259","0.0013","94.608","0.003","100.871","0.003","98.399","0.003","2902.1","0.3","298","2","298","2","","","","","","","","3","P -1","-P 1","2","Fulvic acid","3,7,8-Trihydroxy-3-methyl-10-oxo-4,10-dihydro-1H,3H-pyrano[4,3-b]chromene- 9-carboxylic acid (fulvic acid)","","- C14.75 H15 O8.75 -","- C14.75 H15 O8.75 -","- C118 H120 O70 -","8","4","CV6232","Wang, Jian-Feng; Fang, Mei-Juan; Huang, Hui-Qiong; Li, Gui-Ling; Su, Wen-Jin; Zhao, Yu-Fen","3,7,8-Trihydroxy-3-methyl-10-oxo-4,10-dihydro-1<i>H</i>,3<i>H</i>-pyrano[4,3-<i>b</i>]chromene-9-carboxylic acid (fulvic acid) methanol 0.75-solvate","Acta Crystallographica Section E","2003","59","10","o1517","o1518","10.1107/S1600536803020336","","","0.71073","MoKα","","0.1625","0.0746","","","0.1531","0.1958","","","","","","1.014","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202584","11.293","0.003","12.955","0.004","15.027","0.004","114.946","0.004","96.953","0.005","96.393","0.005","1946.2","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4,11-Bis(4-methoxyphenyl)-3,10-bis(2,6-dichlorophenyl)-1,8-dioxa-2,9- diazadispiro[4.1.4.3]tetradeca-2,9-dien-6-one‒chloroform‒water (2/2/1)","","- C37.5 H31 Cl7 N2 O5.5 -","- C37.5 H31 Cl7 N2 O5.5 -","- C75 H62 Cl14 N4 O11 -","2","1","CV6234","Li, Xiao-Fang; Feng, Ya-Qing; Gao, Bo; Li, Nan","4,11-Bis(4-methoxyphenyl)-3,10-bis(2,6-dichlorophenyl)-1,8-dioxa-2,9-diazadispiro[4.1.4.3]tetradeca-2,9-dien-6-one‒chloroform‒methanol (2/2/1)","Acta Crystallographica Section E","2003","59","11","o1626","o1627","10.1107/S1600536803020348","","","0.71073","MoKα","","0.105","0.0678","","","","0.2317","","","","","","1.028","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202585","22.308","0.008","13.224","0.005","15.054","0.006","90","","102.25","0.008","90","","4340","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","4'-(4-Chlorophenyl)-1'-methyl-4'',5'',6'',7''-tetrahydro- 1H-indole-3-spiro-2'-pyrrolidine-3'-spiro-2''-(thiazolo[3,2-a]pyrimidine)- 2(3H),3''(2''H)-dione","","- C23 H21 Cl N4 O2 S -","- C23 H21 Cl N4 O2 S -","- C184 H168 Cl8 N32 O16 S8 -","8","1","CV6235","Li, Xiao-Fang; Feng, Ya-Qing; Gao, Bo; Li, Nan","4'-(4-Chlorophenyl)-1'-methyl-4'',5'',6'',7''-tetrahydro-1<i>H</i>-indole-3-spiro-2'-pyrrolidine-3'-spiro-2''-(thiazolo[3,2-<i>a</i>]pyrimidine)-2(3<i>H</i>),3''(2''<i>H</i>)-dione","Acta Crystallographica Section E","2003","59","11","o1624","o1625","10.1107/S1600536803020294","","","0.71073","MoKα","","0.1008","0.061","","","","0.1697","","","","","","1.043","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202586","8.25","0.002","10.74","0.002","12.02","0.002","66.05","0.03","76.82","0.03","81.95","0.03","946.3","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-Ethyl-1-(4-methylphenylsulfonyl)-4-phenethyl-4,5-dihydropyrrole","","- C21 H25 N O2 S -","- C21 H25 N O2 S -","- C42 H50 N2 O4 S2 -","2","1","CV6236","Hu, Yi-Min; Li, Yi-Zhi; Li, Yan-Jie; Zhu, Cheng-Jian; Pan, Yi","3-Ethyl-1-(4-methylphenylsulfonyl)-4-phenethyl-4,5-dihydropyrrole","Acta Crystallographica Section E","2003","59","11","o1636","o1637","10.1107/S1600536803021342","","","0.71073","MoKα","","0.1224","0.0557","","","0.1313","0.1596","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202587","13.358","0.003","7.864","0.002","9.313","0.002","90","","91.714","0.003","90","","977.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis(aminopropyl)-1,4-benzylidenediammonium diperchlorate","","- C14 H24 Cl2 N4 O8 -","- C14 H24 Cl2 N4 O8 -","- C28 H48 Cl4 N8 O16 -","2","0.5","CV6238","Yang, Shi-Ping; Chen, Hong-Mei; Znang, Fan; Yu, Xi-Bin; Weng, lin-Hong","<i>N,N</i>'-Bis(aminopropyl)-1,4-benzylidenediammonium diperchlorate","Acta Crystallographica Section E","2003","59","11","o1830","o1831","10.1107/S160053680302436X","","","0.71073","MoKα","","0.0552","0.0493","","","0.1318","0.1384","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202588","9.9771","0.0005","16.1368","0.0008","8.2899","0.0004","90","","98.129","0.001","90","","1321.25","0.11","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","7-Chloromethylbenzo[b]naphtho[1,2-d]pyran-6-one","","- C18 H11 Cl O2 -","- C18 H11 Cl O2 -","- C72 H44 Cl4 O8 -","4","1","CV6239","Hoong-Kun Fun; Hua-You Hu; Jian-Hua Xu; Xue-Mei Li; Shu-Sheng Zhang","7-Chloromethylbenzo[<i>b</i>]naphtho[1,2-<i>d</i>]pyran-6-one","Acta Crystallographica Section E","2003","59","11","o1670","o1671","10.1107/S1600536803021962","","","0.71073","MoKα","","0.0376","0.0341","","","0.0999","0.104","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202589","19.153","0.006","6.2858","0.0019","16.968","0.005","90","","95.218","0.005","90","","2034.3","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1'-Methyl-4'-tolyl-1H-indole-3-spiro-2'-pyrrolidine-3'-spiro-5''- (thiazolo[3,2-b][1,2,4]triazole)-2,6''(3H,5''H)-dione","","- C22 H19 N5 O2 S -","- C22 H19 N5 O2 S -","- C88 H76 N20 O8 S4 -","4","1","CV6240","Li, Xiao-Fang; Feng, Ya-Qing; Gao, Bo; You, Xu-Dong","1'-Methyl-4'-tolyl-1<i>H</i>-indole-3-spiro-2'-pyrrolidine-3'-spiro-5''-(thiazolo[3,2-<i>b</i>][1,2,4]triazole)-2,6''(3<i>H</i>,5''<i>H</i>)-dione","Acta Crystallographica Section E","2003","59","11","o1796","o1797","10.1107/S1600536803023316","","","0.71073","MoKα","","","0.0658","","","","0.1564","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202590","8.4662","0.0006","14.113","0.0009","14.1329","0.001","90","","106.253","0.001","90","","1621.16","0.19","103","2","103","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H11 Cl3 In N3 -","- C15 H11 Cl3 In N3 -","- C60 H44 Cl12 In4 N12 -","4","1","CV6241","Butcher, Ray J.; George, C.; Muratore, Nicole; Purdy, Andrew P.","Trichloro(2,6-di-2-pyridylpyridine-κ^3^<i>N</i>)indium(III)","Acta Crystallographica Section E","2003","59","12","m1107","m1109","10.1107/S1600536803024401","","","0.71073","MoKα","","0.0259","0.0235","","","0.0565","0.0578","","","","","","1.085","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202591","10.406","0.0019","10.64","0.002","13.152","0.002","93.067","0.004","98.772","0.004","105.796","0.004","1377.9","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(Dimethyl sulfoxide-κS)bis[2'-(3-methylthiophen-2-ylmethylene)furan- 2-carbohydrazido]zinc(II)","","- C24 H24 N4 O5 S3 Zn -","- C24 H24 N4 O5 S3 Zn -","- C48 H48 N8 O10 S6 Zn2 -","2","1","CV6242","Ali, Hapipah; Omar, Sh Rohaiza. S.; Yusof, M. Sukeri. M.; Yamin, Bohari. M.","(Dimethyl sulfoxide-κ<i>S</i>)bis[2'-(3-methylthiophen-2-ylmethylene)furan-2-carbohydrazido]zinc(II)","Acta Crystallographica Section E","2003","59","12","m1118","m1120","10.1107/S1600536803025194","","","0.71073","MoKα","","0.065","0.052","","","0.142","0.149","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202592","12.882","0.0006","12.116","0.0005","30.7987","0.0013","90","","90","","90","","4807","0.4","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1,3-Dibenzoyl-5,8-dimethoxy-2-phenyl-5,8-dihydroindolizine","","- C30 H25 N O4 -","- C30 H25 N O4 -","- C240 H200 N8 O32 -","8","1","CV6243","Hoong-Kun Fun; Yun Li; Jian-Hua Xu; Xue-Mei Li; Shu-Sheng Zhang","1,3-Dibenzoyl-5,8-dimethoxy-2-phenyl-5,8-dihydroindolizine","Acta Crystallographica Section E","2003","59","12","o1901","o1902","10.1107/S1600536803023195","","","0.71073","MoKα","","0.0534","0.0441","","","0.1286","0.1431","","","","","","0.789","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202593","9.885","0.002","10.083","0.002","11.269","0.003","90","","101.14","0.02","90","","1102","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Potassium HQS monohydrate","aqua(8-hydroxyquinoline-5-sulfonato-κ^2^N,O)potassium(I)","","- C9 H8 K N O5 S -","- C9 H8 K N O5 S -","- C36 H32 K4 N4 O20 S4 -","4","1","CV6244","Savarimuthu Francis; Packianathan Thomas Muthiah; Gabriele Bocelli; Andrea Cantoni","Hydrogen-bonded supramolecular motifs in aqua(8-hydroxyquinoline-5-sulfonato-κ^2^<i>N,O</i>)potassium(I)","Acta Crystallographica Section E","2003","59","12","m1154","m1156","10.1107/S1600536803024309","","","0.71069","MoKα","","0.0669","0.0459","","","0.1464","0.1565","","","","","","1.128","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202594","9.348","0.002","9.614","0.002","9.872","0.002","77.015","0.004","63.933","0.003","88.2","0.004","774.3","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 1-acetyl-2'-methyl-2-oxo-4',5'-dihydro-1H-indoline- 3-spiro-5'-oxazole-4'-carboxylate","","- C16 H16 N2 O5 -","- C16 H16 N2 O5 -","- C32 H32 N4 O10 -","2","1","CV6245","Hoong-Kun Fun; Lei Wang; Jian-Hua Xu; Xue-Mei Li; Shu-Sheng Zhang","Ethyl 1-acetyl-2'-methyl-2-oxo-4',5'-dihydro-1<i>H</i>-indoline-3-spiro-5'-oxazole-4'-carboxylate","Acta Crystallographica Section E","2003","59","11","o1827","o1829","10.1107/S1600536803024206","","","0.71073","MoKα","","0.0428","0.0365","","","0.0968","0.1031","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202595","7.321","0.002","9.682","0.003","22.817","0.003","90","","96.54","0.02","90","","1606.8","0.7","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","copper ferron hexahydrate","diaqua(μ-8-hydroxy-7-iodoquinoline-5-sulfonato-κ^4^N,O,O',O'')copper(II) tetrahydrate","","- C9 H16 Cu I N O10 S -","- C9 H16 Cu I N O10 S -","- C36 H64 Cu4 I4 N4 O40 S4 -","4","1","CV6246","Savarimuthu Francis; Packianathan Thomas Muthiah; Gabriele Bocelli; Andrea Cantoni","Polymeric diaqua(μ-8-hydroxy-7-iodoquinoline-5-sulfonato-κ^4^<i>N,O,O</i>',<i>O</i>'')copper(II) tetrahydrate","Acta Crystallographica Section E","2003","59","12","m1157","m1159","10.1107/S1600536803024589","","","0.71069","MoKα","","0.059","0.0411","","","0.0801","0.0901","","","","","","1.068","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202596","9.449","0.003","14.33","0.002","19.449","0.003","111.08","0.002","93.73","0.003","104.77","0.002","2339.9","0.9","293","","293","","","","","","","","","5","P -1","-P 1","2","","Bis(4,4'-bipyridinium) bis(8-hydroxyquinoline-5-sulfonate) bipyridine pentahydrate","","- C48 H48 N8 O13 S2 -","- C48 H48 N8 O13 S2 -","- C96 H96 N16 O26 S4 -","2","1","CV6247","Savarimuthu Baskar Raj; Packianathan Thomas Muthiah; Gabriele Bocelli; Andrea Cantoni","Bis(4,4'-bipyridinium) bis(8-hydroxyquinoline-5-sulfonate) bipyridine pentahydrate","Acta Crystallographica Section E","2003","59","12","o1980","o1983","10.1107/S1600536803026138","","","0.71069","MoKα","","0.0993","0.0606","","","0.1567","0.1743","","","","","","0.977","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202597","12.6892","0.0009","12.6892","0.0009","13.3798","0.0019","90","","90","","120","","1865.7","0.3","100","2","100","2","","","","","","","","4","R 3 c :H","R 3 -2""c","161","1,3,5-Trimethoxybenzene chromium tricarbonyl","Tricarbonyl(η^6^-1,3,5-trimethoxybenzene)chromium(0)","","- C12 H12 Cr O6 -","- C12 H12 Cr O6 -","- C72 H72 Cr6 O36 -","6","0.333333","CV6248","Zeller, Matthias; Hunter, Allen D.","Tricarbonyl(η^6^-1,3,5-trimethoxybenzene)chromium(0)","Acta Crystallographica Section E","2003","59","11","m1078","m1079","10.1107/S1600536803024292","","","0.71073","MoKα","","0.0256","0.0255","","","0.0688","0.0688","","","","","","1.069","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202598","7.7205","0.0005","8.8797","0.0006","14.1801","0.001","82.795","0.001","80.241","0.001","64.415","0.001","862.63","0.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 2-(acetylamino)-2-(9-hydroxy-10-oxo-9,10-dihydro-9-phenanthrenyl)acetate","","- C20 H19 N O5 -","- C20 H19 N O5 -","- C40 H38 N2 O10 -","2","1","CV6250","Xue-Mei Li; Lei Wang; Jian-Hua Xu; Shu-Sheng Zhang; Hoong-Kun Fun","Ethyl 2-(acetylamino)-2-(9-hydroxy-10-oxo-9,10-dihydro-9-phenanthrenyl)acetate","Acta Crystallographica Section E","2003","59","12","o1907","o1908","10.1107/S1600536803024590","","","0.71073","MoKα","","0.0496","0.0421","","","0.1096","0.1168","","","","","","1.078","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202599","29.2648","0.0015","7.1628","0.001","16.4396","0.0013","90","","98.601","0.01","90","","3407.3","0.6","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H15 N3 O3 -","- C20 H15 N3 O3 -","- C160 H120 N24 O24 -","8","1","CV6251","Shang Shan; Hai-Gang Yu; Wei-Xiao Hu; Duan-Jun Xu","Benzil 4-nitrophenylhydrazone","Acta Crystallographica Section E","2003","59","12","o1886","o1887","10.1107/S1600536803024942","","","0.71073","MoKα","","0.067","0.049","","","0.117","0.127","","","","","","1.053","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202600","5.14","0.001","15.575","0.003","16.05","0.003","90","","96.995","0.003","90","","1275.3","0.4","292","2","292","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(2R,4S)-3-N-(Fluoren-9-ylmethoxycarbonyl)-4-methyl-2-nonyloxazolidin-5-one","","- C28 H35 N O4 -","- C28 H35 N O4 -","- C56 H70 N2 O8 -","2","1","DN6073","Hughes, Andrew B.; Mackay, Maureen F.; Marianne Sleebs","(2<i>R</i>,4<i>S</i>)-3-<i>N</i>-(Fluoren-9-ylmethoxycarbonyl)-4-methyl-2-nonyloxazolidin-5-one","Acta Crystallographica Section E","2003","59","7","o1079","o1081","10.1107/S1600536803013485","","","0.71065","MoKα","","0.0694","0.0533","","","0.14","0.1508","","","","","","1.057","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202601","3.5876","0.0007","14.684","0.003","12.237","0.002","90","","94.686","0.003","90","","642.5","0.2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","cis-Diammine(L-pyrolglutamato)platinum(II)","","- C6 H12 N6 O8 Pt -","- C6 H12 N6 O8 Pt -","- C12 H24 N12 O16 Pt2 -","2","0.5","DN6075","Sakai, Ken; Akiyama, Norinobu; Mizota, Mina; Yokokawa, Kazuo; Yokoyama, Yoshimi","Bis(guanidinium) bis(oxalato)platinate(II)","Acta Crystallographica Section E","2003","59","7","m408","m410","10.1107/S1600536803011802","","","0.71073","MoKα","","0.0226","0.0145","","","0.0324","0.0341","","","","","","0.935","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202602","6.0535","0.0005","7.4674","0.0006","25.776","0.002","83.715","0.001","88.57","0.002","82.223","0.001","1147.46","0.16","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","N-Methyl-N'-(3-phthalimidopropyl)-4,4'-bipyridinium diiodide","","- C22 H21 I2 N3 O2 -","- C22 H21 I2 N3 O2 -","- C44 H42 I4 N6 O4 -","2","1","DN6076","Sakai, Ken; Okamoto, Ken; Takahashi, Satoru; Yokokawa, Kazuo","<i>N</i>-Methyl-<i>N</i>'-(3-phthalimidopropyl)-4,4'-bipyridinium diiodide","Acta Crystallographica Section E","2003","59","7","o917","o918","10.1107/S1600536803012376","","","0.71073","MoKα","","0.0499","0.0408","","","0.0968","0.1017","","","","","","1.049","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202603","10.013","0.003","15.656","0.004","21.133","0.005","90","","103.48","0.04","90","","3221.6","1.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H17 F18 O9 Pr -","- C21 H17 F18 O9 Pr -","- C84 H68 F72 O36 Pr4 -","4","1","DN6077","Plakatouras, John, C.; Kavounis, Constantin; Cardin, Christine, J.","(Diethyleneglycol dimethyl ether)tris(1,1,1,5,5,5-hexafluoropentane-2,4-dionato)praseodymium(III)","Acta Crystallographica Section E","2003","59","10","m838","m840","10.1107/S1600536803016556","","","0.71073","MoKα","","0.0423","0.0348","","","0.0801","0.0856","","","","","","1.088","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202604","6.53","0.0002","6.724","0.0002","9.211","0.0003","71.96","0.02","72.84","0.03","73.75","0.03","359.44","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Cytosinium bisulfate","","","- C4 H6 N4 O4 -","- C4 H6 N4 O4 -","- C8 H12 N8 O8 -","2","1","DN6078","Cherouana, Aouatef; Bouchouit, Karim; Bendjeddou, Lamia; Benali-Cherif, Nourredine","Cytosinium nitrate","Acta Crystallographica Section E","2003","59","7","o983","o985","10.1107/S160053680301287X","","","0.71073","MoKα","","0.0463","0.0395","","","0.1077","0.1125","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202605","6.0119","0.0001","7.2082","0.0002","59.0233","0.0018","90","","90","","90","","2557.77","0.11","150","","150","","","","","","","","","5","I 2 c b","I -2a 2","45","","","","- C12 H8 I2 N2 O -","- C12 H8 I2 N2 O -","- C96 H64 I16 N16 O8 -","8","1","DN6079","Krivokapić, Alexander; Wilson, Craig J.; Watkin, David J.; Anderson, Harry L.","<i>N,N</i>'-Bis(4-iodophenyl)diazene <i>N</i>-oxide","Acta Crystallographica Section E","2003","59","7","o1022","o1024","10.1107/S1600536803013618","","","0.71073","MoKα","","0.055","0.055","","0.1052","0.1052","0.1052","","","","","","0.9842","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202606","12.3576","0.0002","19.121","0.0003","13.9169","0.0002","90","","96.182","0.005","90","","3269.3","0.09","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","diaquabis{2-[(5-methylpyrazol-3-yl)methyl]benzimidazole}cobalt(II) dichloride dihydrate acetone solvate","","- C27 H38 Cl2 Co N8 O5 -","- C27 H38 Cl2 Co N8 O5 -","- C108 H152 Cl8 Co4 N32 O20 -","4","1","DN6080","Sbai, F.; Regragui, R.; Essassi, E., M.; Kenz, A.; Pierrot, M.","Complexation du 2-[(5-méthylpyrazol-3-yl)méthyl]benzimidazole par le chlorure du cobalt","Acta Crystallographica Section E","2003","59","8","m571","m573","10.1107/S1600536803014028","","","0.71073","MoKα","","0.0446","0.0371","","","0.0901","0.0969","","","","","","1.096","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2202607","8.113","0.001","12.089","0.001","20.181","0.002","90","","92.79","0.03","90","","1977","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","8,8'-dichloro-1,1',5,5'-tetrahydro-10,10'-bipyrrolo[1,2-b] isoquinolin-3,3'(2H,2'H)-dione","","- C24 H18 Cl2 N2 O2 -","- C24 H18 Cl2 N2 O2 -","- C96 H72 Cl8 N8 O8 -","4","1","DN6081","Camus, Fabrice; Norberg, Bernadette; Bourry, Anne; Akué-Gédu, Rufine; Rigo, Benoît; Durant, François","8,8'-Dichloro-1,1',5,5'-tetrahydro-10,10'-bipyrrolo[1,2-<i>b</i>]isoquinoline-3,3'(2<i>H</i>,2'<i>H</i>)-dione","Acta Crystallographica Section E","2003","59","7","o1002","o1003","10.1107/S1600536803013436","","","1.54178","CuKα","","0.0611","0.0452","","","0.125","0.1351","","","","","","1.037","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202608","7.496","0.002","7.496","0.002","27.941","0.005","90","","90","","90","","1570","0.7","293","2","293","2","","","","","","","","6","P 43","P 4cw","78","","catena-Poly[dibromozinc(II)]-μ-(R,R)-1,2-diacetamidocyclohexane]","","- C10 H18 Br2 N2 O2 Zn -","- C10 H18 Br2 N2 O2 Zn -","- C40 H72 Br8 N8 O8 Zn4 -","4","1","DN6082","Bekaert, Alain; Lemoine, Pascale; Brion, Jean Daniel; Viossat, Bernard","<i>catena</i>-Poly[[dibromozinc(II)]-μ-(<i>R,R</i>)-1,2-diacetamidocyclohexane]","Acta Crystallographica Section E","2003","59","8","m574","m575","10.1107/S1600536803014570","","","0.71073","MoKα","","0.1048","0.0305","","","0.0622","0.0759","","","","","","0.949","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202609","24.604","0.015","6.267","0.004","16.533","0.01","90","","115.533","0.009","90","","2300","2","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","(tert-Butyl)(p-Tolyl)Sulfenamide","N-(tert-Butyl)-S-(4-Methylphenyl)thiohydroxylamine","","- C11 H17 N S -","- C11 H17 N S -","- C88 H136 N8 S8 -","8","1","DN6083","Mahmoudkhani, Amir H.; Vargas-Baca, Ignacio","<i>N</i>-(<i>tert</i>-Butyl)-<i>S</i>-(4-methylphenyl)thiohydroxylamine","Acta Crystallographica Section E","2003","59","7","o1082","o1083","10.1107/S1600536803014247","","","0.71073","MoKα","","0.087","0.044","","","0.098","0.114","","","","","","1.007","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202610","7.4507","0.0008","12.3998","0.0013","15.5348","0.0017","93.227","0.002","98.602","0.002","101.703","0.002","1384","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Bis(2-aminopyridine)(2,2'-bipyridine)platinum(II) bis(oxalato)platinate(II) dihydrate","","- C24 H24 N6 O10 Pt2 -","- C24 H20 N6 O10 Pt2 -","- C48 H40 N12 O20 Pt4 -","2","1","DN6085","Sakai, Ken; Akiyama, Norinobu; Mizota, Mina","Bis(2-aminopyridine)(2,2'-bipyridine)platinum(II) bis(oxalato)platinate(II) dihydrate","Acta Crystallographica Section E","2003","59","8","m636","m638","10.1107/S1600536803015770","","","0.71073","MoKα","","0.0739","0.0411","","","0.0654","0.0718","","","","","","0.845","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202611","4.734","0.0002","24.045","0.0003","9.505","0.0004","90","","98.86","0.004","90","","1069.03","0.07","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Guaninium phosphite dihydrate","","","- C5 H12 N5 O6 P -","- C5 H12 N5 O6 P -","- C20 H48 N20 O24 P4 -","4","1","","Bendheif, Leulmi; Bouchouit, Karim; Benali-Cherif, Nourredine","Guaninium dihydrogenphosphite dihydrate","Acta Crystallographica, Section E: Structure Reports Online","2003","59","9","o1407","o1409","10.1107/s1600536803017501","","","","","","","","","","","","","","","","","","","","","has coordinates","219071","2020-10-21","18:00:00",""
"2202612","14.08","0.002","15.158","0.003","20.233","0.004","90","","90","","90","","4318.2","1.4","296","2","296","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","3,3,6,6-tetramethyl-9-(3,4-methylenedioxylphenyl)- 1,2,3,4,5,6,7,8,9,10-decahydroacridines-1,8-dione","","- C24 H27 N O4 -","- C24 H27 N O4 -","- C192 H216 N8 O32 -","8","2","DN6087","Yuling Li; Xiangshan Wang; Daqing Shi; Baixiang Du; Shujiang Tu","3,3,6,6-Tetramethyl-9-(3,4-methylenedioxylphenyl)-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione","Acta Crystallographica Section E","2003","59","10","o1446","o1448","10.1107/S1600536803019378","","","0.71073","MoKα","","0.1345","0.0399","","","0.0739","0.0895","","","","","","0.748","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202613","5.0135","0.0007","12.7483","0.0011","22.495","0.003","90","","91.553","0.011","90","","1437.2","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-(3-Chloro-4-Metoxyphenyl)-N'-Hydroxy-2-Oxo-2-Phenylacetamidine","","- C15 H13 Cl N2 O3 -","- C15 H13 Cl N2 O3 -","- C60 H52 Cl4 N8 O12 -","4","1","DN6088","Serkan Soylu; Murat Tas̨; Ömer Andaç; Hümeyra Batı; Nezihe Çalıs̨kan; Orhan Büyükgüngör; N-(3-Chloro-4-Metoxyphenyl)-N'-Hydroxy-2-Oxo-2-Phenylacetamidine","<i>N</i>-(3-Chloro-4-methoxyphenyl)-<i>N</i>'-hydroxy-2-oxo-2-phenylacetamidine","Acta Crystallographica Section E","2003","59","10","o1532","o1534","10.1107/S1600536803019305","","","0.71073","MoKα","","0.0506","0.0321","","","0.0746","0.078","","","","","","0.834","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202614","12.6682","0.0012","13.2891","0.001","11.5196","0.001","90","","108.45","0.007","90","","1839.6","0.3","296","1","296","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","4-Hydroxy allyl benzoate","4-Hydroxy-benzoic acid allyl ester","","- C10 H10 O3 -","- C10 H10 O3 -","- C80 H80 O24 -","8","2","DN6090","Herrera, Ana M.; Bernès, Sylvain; .; López, Delia; .","Allyl 4-hydroxybenzoate","Acta Crystallographica Section E","2003","59","10","o1522","o1524","10.1107/S1600536803019962","","","0.71073","MoKα","","0.0984","0.0521","","","0.1284","0.1507","","","","","","1.031","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202615","7.281","0.004","23.637","0.014","10.502","0.005","90","","99.19","0.04","90","","1784.2","1.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dicarbonyl(eta5-methylcyclopentadienyl){eta2- [tricarbonyl(eta6-styrene)chromium(0)]}manganese(I)","","- C19 H15 Cr Mn O5 -","- C19 H15 Cr Mn O5 -","- C76 H60 Cr4 Mn4 O20 -","4","1","DN6091","Crocock, Barry; Long, Conor; Lyons, Michael; Howie, R. Alan","Dicarbonyl(η^5^-methylcyclopentadienyl){η^2^-[tricarbonyl(η^6^-styrene)chromium(0)]}manganese(I)","Acta Crystallographica Section E","2003","59","10","m931","m933","10.1107/S1600536803020282","","","0.71073","MoKα","","0.0787","0.0443","","","0.091","0.0986","","","","","","1.007","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202616","7.4143","0.0007","21.461","0.004","8.3958","0.0011","90","","101.84","0.012","90","","1307.5","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-isopropylamino-7-nitro-1,4,2-benzothiadiazine 1,1-dioxide","","- C10 H11 N3 O4 S2 -","- C10 H11 N3 O4 S2 -","- C40 H44 N12 O16 S8 -","4","1","DN6092","Dupont, Léon; Somers, Fabian; De Tullio, Pascal; Pirotte, Bernard","3-Isopropylamino-7-nitro-1,4,2-benzodithiazine 1,1-dioxide","Acta Crystallographica Section E","2003","59","10","o1509","o1511","10.1107/S1600536803020324","","","1.5418","CuKα","","0.0593","0.0524","","","0.1519","0.1563","","","","","","1.081","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202617","13.181","0.004","9.738","0.003","19.707","0.006","90","","90","","90","","2529.5","1.3","294","2","294","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","cis-DichloroBis[N-(3-chlorophenyl)pyridine-2-carboxamide]manganese(II)","","- C24 H18 Cl4 Mn N4 O2 -","- C24 H18 Cl4 Mn N4 O2 -","- C96 H72 Cl16 Mn4 N16 O8 -","4","0.5","DN6093","Yang, Qi Yun; Qi, Jian Ying; Chan, Gang; Zhou, Zhong Yuan; Chan, Albert S. C.","<i>cis</i>-Dichlorobis[<i>N</i>-(3-chlorophenyl)pyridine-2-carboxamide]manganese(II)","Acta Crystallographica Section E","2003","59","11","m982","m984","10.1107/S1600536803021998","","","0.71073","MoKα","","0.0551","0.0366","","","0.095","0.1045","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202618","13.0331","0.0019","15.61","0.003","16.514","0.003","90","","90","","90","","3359.7","1","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","8-methyl-6-(4-methylpiperazin-1-yl)-11H-pyrido[2,3-b][1,4]benzodiazepine","","- C18 H21 N5 -","- C18 H21 N5 -","- C144 H168 N40 -","8","1","DN6096","Marie-Rose Spirlet; Amaury Graulich; Jean-Francois Liégeois","8-Methyl-6-(4-methylpiperazin-1-yl)-11<i>H</i>-pyrido[2,3-<i>b</i>][1,4]benzodiazepine","Acta Crystallographica Section E","2003","59","12","o1990","o1991","10.1107/S1600536803026448","","","0.71073","MoKα","","0.1365","0.0498","","","0.0839","0.1058","","","","","","0.919","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202620","10.7513","0.0005","12.013","0.0006","13.5273","0.0006","94.063","0.001","112.126","0.001","108.137","0.001","1502.53","0.12","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","1,4-Dimethylpyridinium bis(2-oxo-1,3-dithiole-4,5-dithiolato)diphenylantimonate(1-)","","- C25 H20 N O2 S8 Sb -","- C25 H20 N O2 S8 Sb -","- C50 H40 N2 O4 S16 Sb2 -","2","1","DN6098","Chohan, Zahid H.; Comerlato, Nadia M.; Howie, R. Alan; Skakle, Janet M. S.; Wardell, James L.","1,4-Dimethylpyridinium bis(2-oxo-1,3-dithiole-4,5-dithiolato)diphenylantimonate(V)","Acta Crystallographica Section E","2003","59","11","m1006","m1009","10.1107/S1600536803022190","","","0.71073","MoKα","","0.073","0.038","","","0.064","0.072","","","","","","0.882","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202621","38.562","0.013","4.7679","0.0016","10.344","0.004","90","","103.357","0.006","90","","1850.4","1.1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,5-bis(benzylsulfonyl)-pentane","","- C19 H24 O4 S2 -","- C19 H24 O4 S2 -","- C76 H96 O16 S8 -","4","0.5","DN6099","Jian-Rong Li; Ruo-Hua Zhang; Xian-He Bu","1,5-Bis(benzylsulfonyl)pentane","Acta Crystallographica Section E","2003","59","11","o1738","o1739","10.1107/S1600536803022888","","","0.71073","MoKα","","0.0702","0.0437","","","0.1048","0.1154","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202622","13.1829","0.0005","12.3225","0.0005","15.2605","0.0005","90","","106.861","0.001","90","","2372.44","0.15","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H22 Cl2 N4 O2 -","- C26 H22 Cl2 N4 O2 -","- C104 H88 Cl8 N16 O8 -","4","1","DN6101","Nabih, K.; Baouid, A.; Hasnaoui, A.; Kenz, A.","Stéréochimie du 1,7-bis(4-chlorophényl)-3a,4a,10-triméthyl-3a,4a,8,13-tétrahydro-4<i>H</i>-bis[1,2,4-oxadiazolo][4,5-<i>a</i>:5',4'-<i>d</i>][1,5]benzodiazépine","Acta Crystallographica Section E","2003","59","11","o1774","o1776","10.1107/S1600536803023080","","","0.71073","MoKα","","0.0785","0.0653","","","0.1617","0.1723","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202623","11.416","0.0003","10.509","0.0003","7.681","0.0002","90","","92.562","0.002","90","","920.57","0.04","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","m-carboxyphenylammonium bisulfate","","","- C7 H9 N O6 S -","- C7 H9 N O6 S -","- C28 H36 N4 O24 S4 -","4","1","DN6102","Cherouana, Aouatef; Bendjeddou, Lamia; Benali-Cherif, Nourredine","Hydrogen bonding in <i>m</i>-carboxyphenylammonium bisulfate","Acta Crystallographica Section E","2003","59","11","o1790","o1792","10.1107/S1600536803023134","","","0.71073","MoKα","","0.0431","0.0347","","","0.0995","0.115","","","","","","1.165","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202624","15.7044","0.0004","12.501","0.0004","11.2837","0.0004","90","","103.584","0.0013","90","","2153.26","0.12","299","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C6 H9 Na3 O9 -","- C6 H9 Na3 O9 -","- C48 H72 Na24 O72 -","8","1","DN6103","Andreas Fischer; Giuseppe Palladino","Trisodium citrate dihydrate","Acta Crystallographica Section E","2003","59","11","m1080","m1082","10.1107/S1600536803024395","","","0.71073","MoKα","","0.0792","0.0395","","","0.0813","0.0933","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202625","9.836","0.003","13.065","0.004","14.391","0.004","90","","90","","90","","1849.3","1","123","2","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","(-)-Membrenone C","(2S,2'R,3S,3'S)-(1S)-2,2'-ethane-1,1-diylbis(6-ethyl-3,5-dimethyl-2,3-dihydro- 4H-pyran-4-one)","","- C20 H30 O4 -","- C20 H30 O4 -","- C80 H120 O16 -","4","1","DN6104","Sampson, Rebecca A.; Perkins, Michael V.; Taylor, Max R.","Conformation of (‒)-membrenone-C","Acta Crystallographica Section E","2003","59","12","o1867","o1868","10.1107/S1600536803024796","","","0.71073","MoKα","","","0.04","","","","0.079","","","","","","1.203","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202626","11.8682","0.0017","17.512","0.003","10.279","0.0015","90","","123.074","0.002","90","","1790.2","0.5","123","2","123","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N,N'-bis(2-hydroxycyclohexyl)-trans-cyclohexane-1,2-diamine","","- C18 H34 N2 O2 -","- C18 H34 N2 O2 -","- C72 H136 N8 O8 -","4","0.5","DN6105","de Sousa, Alvaro S.; Fernandes, Manuel A.","<i>N,N</i>'-Bis(2-hydroxycyclohexyl)-<i>trans</i>-cyclohexane-1,2-diamine: a structure reanalysed at low temperature","Acta Crystallographica Section E","2003","59","12","o1872","o1874","10.1107/S1600536803024826","","","0.71073","MoKα","","0.0539","0.0443","","","0.1233","0.1311","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202627","8.5531","0.0008","10.6765","0.0008","17.2457","0.0012","90","","93.347","0.01","90","","1572.1","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","8-chloro-5-(4-methylpiperazin-1-yl)-11H-pyrido[2,3-b][1,5]benzoxazepine","","- C17 H17 Cl N4 O -","- C17 H17 Cl N4 O -","- C68 H68 Cl4 N16 O4 -","4","1","DN6107","Dupont, Léon; Liégeois, Jean-François","8-Chloro-5-(4-methylpiperazin-1-yl)-11<i>H</i>-pyrido[2,3-<i>b</i>][1,5]benzoxazepine","Acta Crystallographica Section E","2003","59","12","o1962","o1963","10.1107/S1600536803025844","","","0.7107","MoKα","","0.0791","0.0396","","","0.1001","0.1143","","","","","","1.015","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202628","10.6696","0.0008","10.6803","0.0008","12.414","0.001","65.563","0.001","70.336","0.001","86.995","0.001","1206.57","0.16","150.2","","150.2","","","","","","","","","5","P -1","-P 1","2","","","","- C47 H86 Cl2 Mn2 O2 -","- C47 H74 Cl2 Mn2 O2 -","- C47 H74 Cl2 Mn2 O2 -","1","0.5","FL6039","Jamin L. Krinsky; Matthew N. Stavis; Marc D. Walter","Di-μ-chloro-bis[(tetrahydrofuran-κ<i>O</i>)(η^5^-1,2,4-tri-<i>tert</i>-butylcyclopentadienyl)manganese(II)] pentane solvate","Acta Crystallographica Section E","2003","59","7","m497","m499","10.1107/S1600536803012807","","","0.7107","MoKα","","0.0604","0.043","","0.0574","0.0543","0.0543","","","","","","1.663","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202629","17.884","0.001","8.9233","0.0006","22.395","0.002","90","","90","","90","","3573.9","0.4","133.2","","133.2","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C41 H47 O5 P -","- C41 H47 O5 P -","- C164 H188 O20 P4 -","4","1","FL6040","Benjamin L. Rupert; Bryan E. F. Tiedemann; Sarah M. Vespremi","(1<i>R</i>,7<i>R</i>)-4-[(1<i>R</i>,2<i>S</i>,5<i>R</i>)-2-Isopropyl-5-methylcyclohexoxy]-9,9-dimethyl-2,2,6,6-tetraphenyl-3,5,8,10-tetraoxa-4-phosphabicyclo[5.3.0]decane","Acta Crystallographica Section E","2003","59","7","o934","o935","10.1107/S1600536803012169","","","0.7107","MoKα","","0.0804","0.0378","","0.0487","0.0394","0.0394","","","","","","0.964","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202630","6.989","0.002","8.283","0.003","10.222","0.003","94.909","0.004","91.394","0.004","99.86","0.004","580.4","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis(4,5-diazafluoren-9-one-κ^2^N,N')zinc(II) dinitrate","","- C22 H16 N6 O10 Zn -","- C22 H16 N6 O10 Zn -","- C22 H16 N6 O10 Zn -","1","0.5","FL6042","Zhang, Rong Lan; Zhao, Jian She; Shi, Qi Zhen; Ng, Seik Weng","Diaquabis(4,5-diazafluoren-9-one-κ^2^<i>N,N</i>')zinc(II) dinitrate","Acta Crystallographica Section E","2003","59","7","m476","m477","10.1107/S1600536803012911","","","0.71073","MoKα","","0.08","0.047","","","0.097","0.106","","","","","","0.78","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202631","6.829","0.003","7.508","0.002","9.46","0.004","67.424","0.017","81.663","0.015","71.322","0.016","424.1","0.3","100","","100","","","","","","","","","3","P -1","-P 1","2","","","","- C20 H20 O4 -","- C20 H20 O4 -","- C20 H20 O4 -","1","0.5","FL6043","Clark, J. Caleb; Talele, Tanaji; McLaughlin, Mark L.; Fronczek, Frank R.","(<i>E</i>)-3-Hexene-1,6-diyl dibenzoate","Acta Crystallographica Section E","2003","59","7","o962","o963","10.1107/S1600536803012315","","","0.71073","MoKα","","0.056","0.042","","","0.104","0.113","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202632","9.585","0.001","10.711","0.001","12.98","0.002","72.79","0.01","73.67","0.01","62.93","0.08","1116.5","0.8","298","2","298","2","","","","","","","","4","P -1","-P 1","2","Tris(2-ammonioethyl)amine benzene-1,3,5-tricarboxylate 5.5-hydrate","2,2',2''-Nitrilotri(ethylammonium) benzene-1,3,5-tricarboxylate 5.5-hydrate","","- C15 H35 N4 O11.5 -","- C15 H34.3 N4 O11.5 -","- C30 H68.6 N8 O23 -","2","1","FL6044","Daniel E. Lynch","Tris(2-ammonioethyl)amine benzene-1,3,5-tricarboxylate 5.5-hydrate","Acta Crystallographica Section E","2003","59","7","o1076","o1078","10.1107/S1600536803014387","","","0.71073","MoKα","","0.0808","0.0632","","","0.1953","0.2078","","","","","","1.167","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202633","11.639","0.005","10.39","0.004","16.466","0.006","90","","107.297","0.007","90","","1901.2","1.3","293","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-tert-Butyl-4-methyl-6-(piperidyl-N-methyl)phenol perchlorate","","- C17 H28 Cl N O5 -","- C17 H28 Cl N O5 -","- C68 H112 Cl4 N4 O20 -","4","1","FL6045","Xiao-Jun Zhao; Miao Du","2-<i>tert</i>-Butyl-4-methyl-6-(1-piperidiniomethyl)phenol perchlorate","Acta Crystallographica Section E","2003","59","8","o1161","o1162","10.1107/S1600536803015551","","","0.71073","MoKα","","0.0948","0.05","","","0.1159","0.13","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202634","11.4692","0.001","11.8174","0.0012","17.6837","0.0014","96.925","0.009","104.907","0.006","95.201","0.008","2280.7","0.4","298","1","298","1","","","","","","","","3","P 1","P 1","1","Pregnenolone hemisuccinate","Succinic acid mono(17-acetyl-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14, 15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl) ester","","- C25 H36 O5 -","- C25 H36 O5 -","- C100 H144 O20 -","4","4","FL6046","Bernès, Sylvain; Torrens, Hugo; López-Giral, Angela; Buttenklepper, Alfredo","Pregnenolone hemisuccinate: a <i>P</i>1 structure with <i>Z</i>' = 4","Acta Crystallographica Section E","2003","59","9","o1372","o1375","10.1107/S160053680301835X","","","0.71073","MoKα","","0.094","0.0664","","","0.1727","0.191","","","","","","1.26","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202635","8.5291","0.0002","15.6301","0.0004","13.6004","0.0004","90","","97.562","0.001","90","","1797.31","0.08","120","0.2","120","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","3-Cyclopropyl-3-(cis-1-cyclopropyl-2-phenylcyclopropyl)-1-phenylcyclopropene","","- C24 H24 -","- C24 H24 -","- C96 H96 -","4","1","FL6047","Yufit, Dmitrii S.; Kozhushkov, Sergei I.; von Seebach, Malte; Howard, Judith A. K.; de Meijere, Armin","3-Cyclopropyl-3-(<i>cis</i>-1-cyclopropyl-2-phenylcyclopropyl)-1-phenylcyclopropene","Acta Crystallographica Section E","2003","59","8","o1167","o1169","10.1107/S1600536803015599","","","0.71073","MoKα","","0.082","0.0481","","","0.1025","0.1167","","","","","","1.023","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202636","12.2252","0.0001","16.3351","0.0003","15.3425","0.0003","90","","109.207","0.001","90","","2893.35","0.08","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","6a,14a-cis-6,6a,7,14a-Tetrahydrochromeno[4',3':3,4]pyrano[3,2-c]coumarin","","- C19 H14 O4 -","- C19 H14 O4 -","- C152 H112 O32 -","8","2","FL6048","R. Krishna; P. G. Aravindan; M. Yogavel; D. Velmurugan; S. Shanmuga Sundara Raj; H.-K. Fun; M. Shanmuga Sundaram; R. Raghunathan","6a,14a-<i>cis</i>-6,6a,7,14a-Tetrahydrochromeno[4',3':3,4]pyrano[3,2-<i>c</i>]coumarin","Acta Crystallographica Section E","2003","59","9","o1395","o1397","10.1107/S1600536803018075","","","0.71073","MoKα","","0.1223","0.0655","","","0.1378","0.1672","","","","","","1.069","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202637","7.3283","0.0006","7.3331","0.0006","8.9456","0.0008","80.51","0.002","81.124","0.002","75.474","0.002","455.77","0.07","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H18 O10 S2 -","- C14 H18 O10 S2 -","- C14 H18 O10 S2 -","1","0.5","FL6049","Dale, Sophie H.; Elsegood, Mark R.J.","Benzene-1,2,4,5-tetracarboxylic acid dimethyl sulfoxide disolvate: a redetermination at 150K","Acta Crystallographica Section E","2003","59","8","o1205","o1207","10.1107/S1600536803016295","","","0.71073","MoKα","","0.0311","0.0278","","","0.0731","0.0754","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202638","10.85","0.001","19.576","0.003","13.02","0.002","90","","98.52","0.01","90","","2734.9","0.6","293","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C58 H70 B2 N6 Ni2 O6 -","- C58 H70 B2 N6 Ni2 O6 -","- C116 H140 B4 N12 Ni4 O12 -","2","0.5","FL6050","Callejo, Lorena M.; Muga, Iñaki; Vitoria, Pablo; Reinoso, Santiago; Román, Pascual; Gutiérrez-Zorrilla, Juan M.","μ-Oxalato-κ^4^<i>O</i>^1^,<i>O</i>^2^:O^1'^,<i>O</i>^2'^-bis[aqua(diethylenetriamine-κ^3^<i>N</i>)nickel(II)] bis(tetraphenylborate)","Acta Crystallographica Section E","2003","59","8","m684","m686","10.1107/S1600536803016362","","","0.71073","MoKα","","0.103","0.0451","","","0.104","0.1255","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202639","13.4642","0.0003","13.4642","0.0003","31.1187","0.0015","90","","90","","120","","4885.5","0.3","170","2","170","2","","","","","","","","5","P 31 2 1","P 31 2""","152","Beclomethasone Dipropionate (BDP)","","","- C34 H51 Cl F4 O9 -","- C28 H37 Cl O7 -","- C168 H222 Cl6 O42 -","6","1","FL6051","Julie A. Harris; Carducci, Michael D.; Myrdal, Paul B.","Beclomethasone dipropionate crystallized from HFA-134a and ethanol","Acta Crystallographica Section E","2003","59","11","o1631","o1633","10.1107/S1600536803021196","","","0.71073","MoKα","","0.0519","0.0444","","","0.0963","0.0994","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202640","9.2068","0.0012","25.0492","0.0016","13.8555","0.0013","90","","109.444","0.015","90","","3013.2","0.6","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetrakis(benzimidazole-κN)(malonato-κ^2^O,O')cobalt(II)","","- C31 H26 Co N8 O4 -","- C31 H26 Co N8 O4 -","- C124 H104 Co4 N32 O16 -","4","1","FL6052","Dong-Dong Lin; Yu Liu; Duan-Jun Xu","Tetrakis(benzimidazole-κ<i>N</i>)(malonato-κ^2^<i>O,O</i>')cobalt(II)","Acta Crystallographica Section E","2003","59","9","m771","m773","10.1107/S1600536803018117","","","0.71073","MoKα","","0.065","0.045","","","0.086","0.092","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202641","18.682","0.004","14.821","0.003","14.819","0.003","90","","126.57","0.03","90","","3295.4","1.7","153","2","153","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[2,6-Bis(3,4-dihydro-2H-pyrrol-5-yl)pyridine-κ^3^N]trichlororhodium(III) monohydrate","","- C13 H17 Cl3 N3 O Rh -","- C13 H17 Cl3 N3 O Rh -","- C104 H136 Cl24 N24 O8 Rh8 -","8","1","FL6053","Therrien, Bruno; Süss-Fink, Georg","[2,6-Bis(3,4-dihydro-2<i>H</i>-pyrrol-5-yl)pyridine-κ^3^<i>N</i>]trichlororhodium(III) monohydrate","Acta Crystallographica Section E","2003","59","9","m806","m808","10.1107/S1600536803018440","","","0.71073","MoKα","","0.061","0.036","","","0.074","0.079","","","","","","0.886","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202642","11.038","0.002","11.038","0.002","11.038","0.002","90","","90","","90","","1344.8","0.4","100","","100","","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","","","","- C6 H21 Br3 N4 -","- C6 H21 Br3 N4 -","- C24 H84 Br12 N16 -","4","0.333333","FL6054","W. G. Piyal Ariyananda; Richard E. Norman","Tris(2-ammonioethyl)amine tribromide","Acta Crystallographica Section E","2003","59","11","o1601","o1603","10.1107/S1600536803019615","","","0.7107","MoKα","","0.0666","0.0626","","0.1687","","0.1447","","","1.089","","","1.018","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202643","20.144","0.004","9.774","0.002","11.586","0.001","90","","90","","90","","2281.1","0.7","296","2","296","2","","","","","","","","4","I b a 2","I 2 -2c","45","","N,N-(2-bezothiazole)(2-pyridylmethyl)amine","","- C13 H11 N3 S -","- C13 H11 N3 S -","- C104 H88 N24 S8 -","8","1","FL6055","Chen,Zhen-Feng; Tang,Yun-Zhi; Shi,Shao-Ming; Wang, Xian-Wen; Liang, Hong; Yu, Kai-Bei","<i>N,N</i>-(2-benzothiazole)(2-pyridylmethyl)amine","Acta Crystallographica Section E","2003","59","10","o1461","o1463","10.1107/S1600536803019202","","","0.71073","MoKα","","0.039","0.0306","","","0.0675","0.0697","","","","","","0.964","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202644","8.0139","0.0008","5.4828","0.0005","24.701","0.003","90","","95.446","0.002","90","","1080.4","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H11 N O5 -","- C11 H11 N O5 -","- C44 H44 N4 O20 -","4","1","FL6056","Marx, Raimund; Glaser, Steffen; Bolte, Michael","Methyl <i>N</i>-(benzyloxycarbonyl)oxamate","Acta Crystallographica Section E","2003","59","9","o1425","o1426","10.1107/S1600536803018774","","","0.71073","MoKα","","0.069","0.0422","","","0.0876","0.0977","","","","","","1.024","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202645","14.863","0.003","18.069","0.004","8.351","0.003","90","","94.49","0.01","90","","2235.9","1","153","2","153","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H28 Cl2 O7 -","- C20 H28 Cl2 O7 -","- C80 H112 Cl8 O28 -","4","2","FL6057","Gainsford, Graeme J.; Tyler, Peter C.","<i>tert</i>-Butyl 6-<i>O</i>-benzyl-2,2-dichloro-2,5-dideoxy-4-<i>O</i>-methyl-α-<small>D</small>-<i>ribo</i>-oct-3-pyranulosonate","Acta Crystallographica Section E","2003","59","10","o1514","o1516","10.1107/S1600536803019640","","","0.71069","MoKα","","0.11","0.069","","","0.146","0.169","","","","","","0.955","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202646","3.9754","0.0009","9.263","0.002","11.591","0.003","90","","91.69","0.004","90","","426.64","0.17","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","1,4-diisonitrile-2,5-dimethylbenzene","1,4-diisonitrile-2,5-dimethylbenzene","","- C10 H8 N2 -","- C10 H8 N2 -","- C20 H16 N4 -","2","0.5","FL6058","Zeller, Matthias; Hunter, Allen D.","1,4-Diisocyano-2,5-dimethylbenzene","Acta Crystallographica Section E","2003","59","11","o1653","o1654","10.1107/S1600536803020075","","","0.71073","MoKα","","0.0606","0.0483","","","0.1263","0.131","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202647","17.1518","0.0017","5.1324","0.0005","12.367","0.0012","90","","112.01","0.002","90","","1009.32","0.17","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","1,4-bisisocyano-2,3,5,6-tetramethyl benzene","1,4-bisisocyano-2,3,5,6-tetramethyl benzene","","- C12 H12 N2 -","- C12 H12 N2 -","- C48 H48 N8 -","4","0.5","FL6059","Zeller, Matthias; Hunter, Allen D.; Perrine, Cynthia L.","<i>p</i>-Diisocyanotetramethylbenzene","Acta Crystallographica Section E","2003","59","11","o1655","o1656","10.1107/S1600536803020087","","","0.71073","MoKα","","0.0475","0.0461","","","0.1297","0.1312","","","","","","1.053","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202648","7.781","0.002","10.598","0.003","12.432","0.004","95.131","0.011","107.49","0.012","97.32","0.02","960.9","0.5","100","","100","","","","","","","","","3","P 1","P 1","1","1-β-hydroxycorticosterone","4-Pregnen-1β, 11β, 21-triol-3, 20-dione","","- C21 H31 O5.5 -","- C21 H31 O5.5 -","- C42 H62 O11 -","2","2","FL6061","Gadepalli, Rama Sarma V. S.; Rimoldi, John M.; Fronczek, Frank R.","1-β-Hydroxycorticosterone hemihydrate","Acta Crystallographica Section E","2003","59","10","o1525","o1527","10.1107/S1600536803020361","","","0.71073","MoKα","","0.054","0.038","","","0.084","0.089","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202649","8.559","0.005","11.192","0.004","13.689","0.005","106.03","0.03","96.27","0.04","96.89","0.04","1237.2","1","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","Di-tert-butyl 2-(tert-butyloxycarbonylmethoxy)phenyliminodiacetate","","- C24 H37 N O7 -","- C24 H37 N O7 -","- C48 H74 N2 O14 -","2","1","FL6062","Rademeyer, Melanie; Barkhuizen, David A.; Maguire, Glenn E.M.","Di-<i>tert</i>-butyl 2-(<i>tert</i>-butyloxycarbonylmethoxy)phenyliminodiacetate","Acta Crystallographica Section E","2003","59","11","o1650","o1652","10.1107/S1600536803021652","","","0.71073","MoKα","","0.0517","0.0416","","","0.1167","0.1238","","","","","","1.13","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202650","8.227","0.001","14.098","0.001","22.178","0.001","90","","90","","90","","2572.3","0.4","299","2","299","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(P)-4-(p-chlorophenyl)-3-{2-[4-(p- toluenesulfonyl)piperazino]ethoxy}thiazole-2(3H)-thione","","- C22 H24 Cl N3 O3 S3 -","- C22 H24 Cl N3 O3 S3 -","- C88 H96 Cl4 N12 O12 S12 -","4","1","FL6063","Hartung, Jens; Špehar, Kristina; Svoboda, Ingrid; Fuess, Hartmut","The N—O bond as an element of chirality: (<i>P</i>)-4-(<i>p</i>-chlorophenyl)-3-{2-[4-(<i>p</i>-toluenesulfonyl)piperazino]ethoxy}thiazole-2(3<i>H</i>)-thione","Acta Crystallographica Section E","2003","59","12","o1894","o1895","10.1107/S1600536803024814","","","0.71073","MoKα","","0.1108","0.0621","","","0.1142","0.1353","","","","","","0.974","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202651","10.852","0.002","10.852","0.002","5.9751","0.0015","90","","90","","90","","703.7","0.3","130","2","130","2","","","","","","","","4","P -4 n 2","P -4 -2n","118","acetylacetone dioxime","pentane-2,4-dione dioxime","","- C5 H10 N2 O2 -","- C5 H10 N2 O2 -","- C20 H40 N8 O8 -","4","0.5","FL6064","Marilyn M. Olmstead; Javad J. Sahbari","Acetylacetone dioxime","Acta Crystallographica Section E","2003","59","11","o1648","o1649","10.1107/S1600536803021731","","","1.54178","CuKα","","0.0292","0.0279","","","0.0769","0.0783","","","","","","1.121","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202652","11.097","0.0007","11.6441","0.0007","13.5466","0.0008","69.279","0.001","72.818","0.001","89.604","0.001","1554.77","0.16","100","2","100","2","","","","","","","","3","P -1","-P 1","2","Bis[1,2-bis(p-ethylbenzene)phosphino]benzene","Bis[1,2-bis(p-ethylbenzene)phosphino]benzene","","- C38 H40 P2 -","- C38 H40 P2 -","- C76 H80 P4 -","2","1","FL6065","Hunter, Allen D.; Zeller, Matthias; McSparrin, Les","Bis[1,2-bis(<i>p</i>-ethylbenzene)phosphino]benzene","Acta Crystallographica Section E","2003","59","11","o1719","o1720","10.1107/S1600536803022827","","","0.71073","MoKα","","0.0392","0.037","","","0.1016","0.1038","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202653","9.5469","0.0005","11.8565","0.0006","14.3645","0.0007","90","","128.731","0.001","90","","1268.4","0.11","90","2","90","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","1,2-Bis(ditolylphosphino)ethane","1,2-Bis(ditolylphosphino)ethane","","- C30 H32 P2 -","- C30 H32 P2 -","- C60 H64 P4 -","2","0.5","FL6066","Zeller, Matthias; Evelyn Lazich; Timothy R. Wagner; Hunter, Allen D.","1,2-Bis(ditolylphosphino)ethane","Acta Crystallographica Section E","2003","59","11","o1721","o1722","10.1107/S1600536803022839","","","0.71073","MoKα","","0.0465","0.0443","","","0.1209","0.1226","","","","","","1.023","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202654","8.3029","0.0006","10.2497","0.0007","15.6829","0.0011","90","","94.47","0.002","90","","1330.59","0.16","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C7 H22 Cl2 N4 Ni O -","- C7 H22 Cl2 N4 Ni O -","- C28 H88 Cl8 N16 Ni4 O4 -","4","1","FL6067","Oblezov, Alexandr E.; Talham, Daniel R.; Abboud, Khalil A.","Aquachloro(1,4,8,11-tetraazaundecane)nickel(II) chloride","Acta Crystallographica Section E","2003","59","11","m1070","m1071","10.1107/S1600536803024486","","","0.71073","MoKα","","0.0349","0.0339","","","0.0889","0.0899","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202655","11.8517","0.0015","11.7867","0.0017","9.6046","0.0011","90","","102.929","0.008","90","","1307.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","catena-Poly[[(pyridine-κN)copper(II)]-μ-N-salicylideneglycinato- κ^4^O,N,O':O']","catena-Poly[[(pyridine-κN)copper(II)]-μ-N-salicylideneglycinato- κ^4^O,N,O':O']","","- C14 H12 Cu N2 O3 -","- C14 H12 Cu N2 O3 -","- C56 H48 Cu4 N8 O12 -","4","1","FL6068","Butcher, Ray J.; Mockler, Garry M.; McKern, Owen","<i>catena</i>-Poly[[(pyridine-κ<i>N</i>)copper(II)]-μ-<i>N</i>-salicylideneglycinato-κ^4^<i>O,N,O</i>':<i>O</i>']","Acta Crystallographica Section E","2003","59","12","m1104","m1106","10.1107/S1600536803024991","","","0.71073","MoKα","","0.0417","0.0315","","","0.0802","0.0857","","","","","","1.046","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202656","7.473","0.001","8.082","0.001","32.6","0.005","90","","90","","90","","1968.9","0.5","298","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H25 N O S -","- C23 H25 N O S -","- C92 H100 N4 O4 S4 -","4","1","FL6070","Erica Martin; A. Leigh Winfrey; Jason B. Human; C. Zachary Carlin; Daniel S. Jones; Craig A. Ogle","(<i>S</i>)-2-(Methoxydiphenylmethyl)-1-(thiophen-3-ylmethyl)pyrrolidine","Acta Crystallographica Section E","2003","59","12","o1970","o1971","10.1107/S1600536803026035","","","1.5418","CuKα","","","0.0437","","","","0.1214","","","","","","1.009","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202657","12.595","0.001","11.55","0.001","13.938","0.002","90","","116.46","0.01","90","","1815.2","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(N,N-Diacetamido)-3a,4,9,9a-tetrahydro-4,9-[1',2']benzeno-1H- benzo[f]isoindole-1,3(2H)-dione","","- C22 H18 N2 O4 -","- C22 H18 N2 O4 -","- C88 H72 N8 O16 -","4","1","FL6072","Wolska, Irena; Hejchman, Elżbieta","2-(<i>N</i>,<i>N</i>-Diacetamido)-3a,4,9,9a-tetrahydro-4,9-[1',2']benzeno-1<i>H</i>-benzo[<i>f</i>]isoindole-1,3(2<i>H</i>)-dione","Acta Crystallographica Section E","2003","59","12","o2007","o2009","10.1107/S1600536803026850","","","1.54178","CuKα","","0.0864","0.0447","","","0.1182","0.138","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202658","9.9163","0.0001","10.593","0.001","16.375","0.001","106.92","0.01","93.83","0.01","119.716","0.002","1382.3","0.2","125","1","125","2","","","","","","","","5","P -1","-P 1","2","","","","- As4 F24 O4 S2 Te6 -","- As4 F24 O4 S2 Te6 -","- As8 F48 O8 S4 Te12 -","2","1","HB6000","Beck, Johannes; Steden, Folker","Redetermination of Te~6~[AsF~6~]~4~·2SO~2~ at 125K","Acta Crystallographica Section E","2003","59","12","i158","i160","10.1107/S1600536803024887","","","0.71073","MoKα","","0.0717","0.0286","","","","0.0769","","","","","","1.142","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202659","11.282","0.002","13.033","0.002","10.162","0.001","90","","98.5","0.01","90","","1477.8","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2,4-Dinitrophenyl)(1-nitrohexyl)diazene","","- C12 H13 N5 O6 -","- C12 H13 N5 O6 -","- C48 H52 N20 O24 -","4","1","HB6002","Yang, De-Suo; Li, Yi-Zhi; Wu, Long-Min","(2,4-Dinitrophenyl)(1-nitrohexyl)diazene","Acta Crystallographica Section E","2003","59","12","o1956","o1957","10.1107/S1600536803025728","","","0.71073","MoKα","","0.0636","0.0487","","","0.1271","0.1299","","","","","","1.058","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202660","10.3019","0.0002","12.3216","0.0002","12.6131","0.0002","101.553","0.0008","113.556","0.0008","96.3429","0.0006","1405.18","0.04","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","1,4,7-tris(p-toluenesulphonyl)-1,4,7-triazacyclononane","","- C27 H33 N3 O6 S3 -","- C27 H33 N3 O6 S3 -","- C54 H66 N6 O12 S6 -","2","1","HG6000","Gott, Andrew L.; McGowan, Patrick C.","1,4,7-Tris(<i>p</i>-toluenesulfonyl)-1,4,7-triazacyclononane","Acta Crystallographica Section E","2003","59","11","o1702","o1703","10.1107/S1600536803022384","","","0.7107","MoKα","","0.0852","0.0408","","","0.1133","0.1335","","","","","","1.088","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202661","10.236","0.002","10.947","0.002","16.278","0.002","90","","90","","90","","1824","0.5","100","","100","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(+)-6-benzyl-17-oxosparteine","","- C22 H30 N2 O -","- C22 H30 N2 O -","- C88 H120 N8 O4 -","4","1","HG6002","Gadepalli, Rama Sarma V. S.; Murty, Madugula S. R.; Slauson, Stephen R.; Rimoldi, John M.; Fronczek, Frank R.","(+)-6-Benzyl-17-oxosparteine","Acta Crystallographica Section E","2003","59","11","o1832","o1834","10.1107/S1600536803023808","","","0.71073","MoKα","","0.037","0.034","","","0.087","0.089","","","","","","1.052","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202662","9.095","0.003","13.01","0.004","14.078","0.004","79.674","0.005","86.207","0.005","72.793","0.004","1565.3","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3,10-Bis(2,6-dichlorophenyl)-4,11-diphenyl-1,8-dioxa-2,9- diazadispiro[4.1.4.4]pentadeca-2,9-dien-6-one","","- C35 H26 Cl4 N2 O3 -","- C35 H26 Cl4 N2 O3 -","- C70 H52 Cl8 N4 O6 -","2","1","HG6003","Li, Xiao-Fang; Feng, Ya-Qing; Yao,Guang-Yuan; You, Xu-Dong","3,10-Bis(2,6-dichlorophenyl)-4,11-diphenyl-1,8-dioxa-2,9-diazadispiro[4.1.4.4]pentadeca-2,9-dien-6-one","Acta Crystallographica Section E","2003","59","11","o1852","o1853","10.1107/S1600536803024632","","","0.71073","MoKα","","0.097","0.048","","","","0.1354","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202663","8.589","0.002","17.585","0.002","9.479","0.002","90","","115.69","0.01","90","","1290.2","0.4","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-poly[[copper(II)-μ-2-{[(E)-(5-formyl-2-oxidophenyl)methylidene]amino}- 1-ethanesulfonato(2-)] monohydrate]","","- C10 H13 Cu N O7 S -","- C10 H13 Cu N O7 S -","- C40 H52 Cu4 N4 O28 S4 -","4","1","HG6004","Ju-Lan Zeng; Yi-Min Jiang; Kai-Bei Yu","A new one-dimensional coordination polymer: {[Cu(C~10~H~9~NO~5~S)(H~2~O)]·H~2~O}~<i>n~</i>","Acta Crystallographica Section E","2003","59","12","m1137","m1139","10.1107/S1600536803025649","","","0.71073","MoKα","","0.0395","0.0294","","","0.07","0.0726","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202664","19.049","0.005","9.758","0.008","41.95","0.01","90","0.04","99.49","0.02","90","0.04","7691","7","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H28 N4 -","- C21 H28 N4 -","- C336 H448 N64 -","16","4","HG6006","Yin-Xiang Lu; Chun-Ming Liu; Zhen-Guang Zou; Wei Xu; Jing-Mei Wang; Min-Qin Chen; Yong-Ming Huang","Bis(4-phenylpiperazin-1-yl)methane","Acta Crystallographica Section E","2003","59","12","o1960","o1961","10.1107/S1600536803026011","","","0.71073","MoKα","","0.1516","0.0596","","","0.1392","0.1812","","","","","","0.939","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202665","13.641","0.003","7.3197","0.0015","18.66","0.004","90","","104.62","0.03","90","","1802.8","0.7","183","2","183","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","3-Methoxycarbonyl-5-carboxyl-1-methyl-pyrazole monohydrate","Methyl 5-carboxyl-1-methylpyrazole-3-carboxylate monohydrate","","- C7 H10 N2 O5 -","- C7 H10 N2 O5 -","- C56 H80 N16 O40 -","8","1","HG6007","Caixia Yin; Fangjun Huo; Fei Gao; Pin Yang","Methyl 5-carboxyl-1-methylpyrazole-3-carboxylate monohydrate","Acta Crystallographica Section E","2003","59","12","o1994","o1996","10.1107/S1600536803026485","","","0.71073","MoKα","","0.0609","0.0517","","","0.1357","0.1418","","","","","","1.079","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202666","8.2118","0.0008","10.4158","0.001","21.484","0.002","90","","104.341","0.008","90","","1780.3","0.3","296","1","296","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","copper(II) aspirinate","catena(copper(II) acetylsalicylate","","- C18 H14 Cu O8 -","- C18 H14 Cu O8 -","- C72 H56 Cu4 O32 -","4","1","HG6010","Garcia, Fred; Méndez-Rojas, Miguel A.; González-Vergara, Enrique; Bernès, Sylvain; Quiroz, Marco A.","Di-μ-aspirinato-copper(II): a redetermination","Acta Crystallographica Section E","2003","59","12","m1171","m1173","10.1107/S1600536803026126","","","0.71073","MoKα","","0.0433","0.0304","","","0.0706","0.0758","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202667","12.285","0.004","13.924","0.003","11.12","0.003","101.33","0.03","92.63","0.02","84.26","0.02","1855.1","0.9","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H104 Co3 O68 V10 -","- C24 H96 Co3 O68 V10 -","- C24 H96 Co3 O68 V10 -","1","0.5","LH6059","Lee, Uk; Jung, Yeon-Hwa; Joo, Hea-Chung; Park, Ki-Min","A new decavanadate with a tricobalt(II) cation and 18-crown-6, tris{hexaaquacobalt(II)} decavanadate bis(18-crown-6) decahydrate","Acta Crystallographica Section E","2003","59","7","m421","m424","10.1107/S1600536803011747","","","0.71069","MoKα","","0.066","0.0419","","","0.0919","0.1077","","","","","","1.084","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202668","6.01","0.0012","7.8502","0.0016","25.258","0.005","90","","90","","90","","1191.7","0.4","173","","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H11 N S -","- C15 H11 N S -","- C60 H44 N4 S4 -","4","1","LH6061","Jerdioui, Badia; Jorti, Ahmed; Chami, Zoubida; Elachqar, Abdelrhani; Zenkouar, Mohammed; El Bali, Brahim; Bolte, Michael","<i>trans</i>-1-(2-Quinolyl)-2-(2-thienyl)ethylene","Acta Crystallographica Section E","2003","59","7","o924","o925","10.1107/S1600536803010572","","","0.71073","MoKα","","0.0733","0.0461","","","0.0972","0.1088","","","","","","1.064","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202669","9.0679","0.0006","10.0077","0.0006","17.8386","0.0013","90","","94.726","0.006","90","","1613.33","0.19","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H23 Cl N2 -","- C16 H23 Cl N2 -","- C64 H92 Cl4 N8 -","4","1","LH6062","Bolte, Michael; Panisch, Robin; Müller, Thomas","A cocrystal of diethylammonium chloride and diphenylamine","Acta Crystallographica Section E","2003","59","7","o929","o930","10.1107/S1600536803010778","","","0.71073","MoKα","","0.0359","0.027","","","0.0689","0.0703","","","","","","0.965","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202670","22.064","0.002","33.477","0.003","22.73","0.002","90","","93.689","0.008","90","","16754","3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C67 H75 B F16 Si4 -","- C67 H75 B F16 Si4 -","- C536 H600 B8 F128 Si32 -","8","2","LH6064","Bolte, Michael; Bauch, Christian; Müller, Thomas","Triphenylmethylium tetrakis[4-(<i>p</i>-<i>tert</i>-butyldimethylsilyl)-2,3,5,6-tetrafluorophenyl]borate","Acta Crystallographica Section E","2003","59","7","o950","o951","10.1107/S1600536803011395","","","0.71073","MoKα","","0.2929","0.0785","","","0.2081","0.2726","","","","","","0.835","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202671","10.0868","0.0011","12.9476","0.0014","16.5057","0.0019","94.085","0.002","105.321","0.002","100.954","0.002","2024.3","0.4","296","1","296","1","","","","","","","","7","P -1","-P 1","2","","[μ-2,3,5,6-Tetrakis(2-pyridyl)pyrazine]bis[chloroplatinum(II)] bis[trichloro(dimethylsulfoxide-κS)platinate(II)]","","- C28 H28 Cl8 N6 O2 Pt4 S2 -","- C28 H28 Cl8 N6 O2 Pt4 S2 -","- C56 H56 Cl16 N12 O4 Pt8 S4 -","2","1","LH6065","Sakai, Ken; Kurashima, Mai","[μ-2,3,5,6-Tetrakis(2-pyridyl)pyrazine]bis[chloroplatinum(II)] bis[trichloro(dimethyl sulfoxide-κ<i>S</i>)platinate(II)]","Acta Crystallographica Section E","2003","59","7","m411","m413","10.1107/S1600536803011541","","","0.71073","MoKα","","0.151","0.0785","","","0.0979","0.1171","","","","","","0.913","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202672","22.123","0.005","24.203","0.003","6.676","0.004","90","","90","","90","","3575","2","296","","296","","","","","","","","","3","P c c n","-P 2ab 2ac","56","","9-(meta-tert-Butylphenyl)-9-fluorenol","","- C23 H22 O -","- C23 H22 O -","- C184 H176 O8 -","8","1","LH6066","Meyers, Cal Y.; McLean, Aaron W.; Robinson, Paul D.","9-(<i>meta</i>-<i>tert</i>-Butylphenyl)-9-fluorenol","Acta Crystallographica Section E","2003","59","7","o978","o980","10.1107/S1600536803011954","","","0.71069","MoKα","","0.152","0.046","","","0.125","0.167","","","","","","1.002","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202673","9.081","0.002","9.48","0.002","10.834","0.002","90","","91.99","0.03","90","","932.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[N-(2-pyridylmethyl)glycinato]zinc(II) dihydrate","","- C16 H22 N4 O6 Zn -","- C16 H22 N4 O6 Zn -","- C32 H44 N8 O12 Zn2 -","2","0.5","LH6069","Correia, Valdir R.; Bortoluzzi, Adailton J.; Neves, Ademir; Joussef, Antônio C.; Vieira, Marcia G. M.; Batista, Suzana C","Bis[<i>N</i>-(2-pyridylmethyl)glycinato]zinc(II) dihydrate","Acta Crystallographica Section E","2003","59","7","m464","m466","10.1107/S1600536803012364","","","0.71073","MoKα","","0.0451","0.0251","","","0.0653","0.0714","","","","","","1.034","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202674","20.966","0.007","5.8928","0.0018","11.871","0.004","90","","90","","90","","1466.6","0.8","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","Ethylenediammonium disodium (1-hydroxyethylidene)diphosphonate tetrahydrate","","- C4 H22 N2 Na2 O11 P2 -","- C4 H22 N2 Na2 O11 P2 -","- C16 H88 N8 Na8 O44 P8 -","4","1","LH6070","Zongbin, Wu; Zhongmin, Liu; Peng, Tian; Lei, Xu; Yanli, He; Shiyun, Sang; Yue, Yang; Xiumei, Liu; Xianchun, Liu; Xinhe, Bao","Ethylenediammonium disodium (1-hydroxyethylidene)diphosphonate tetrahydrate, [NH~3~(CH~2~)~2~NH~3~]Na~2~(hedp)·4H~2~O","Acta Crystallographica Section E","2003","59","7","m521","m523","10.1107/S1600536803013278","","","0.71073","MoKα","","0.0302","0.0258","","","0.0614","0.0638","","","","","","1.061","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2202675","49.23","0.013","10.955","0.002","17.937","0.004","90","","99.49","0.03","90","","9541","4","180","2","180","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","trans-Dichlorobis[ethane-1,2-diylbis(diphenylphophine)-κ2P,P']tungsten(II) hemipentane solvate","","- C54.5 H54 Cl2 P4 W -","- C54.5 H54 Cl2 P4 W -","- C436 H432 Cl16 P32 W8 -","8","1","LH6071","Filippou, Alexander C.; Schnakenburg, Gregor; Philippopoulos, Athanassios I.","<i>trans</i>-Dichlorobis[ethane-1,2-diylbis(diphenylphophine)-κ^2^<i>P,P</i>']tungsten(II) pentane hemisolvate","Acta Crystallographica Section E","2003","59","8","m602","m604","10.1107/S1600536803014193","","","0.71073","MoKα","","0.0473","0.0357","","","0.0806","0.0837","","","","","","0.954","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2202676","13.1677","0.0018","8.5716","0.0012","13.8499","0.0019","90","","117.024","0.002","90","","1392.5","0.3","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Tetra-μ-nitroamine-bis[aquacopper(II)]","","- Cu2 H12 N8 O10 -","- Cu2 H12 N8 O10 -","- Cu8 H48 N32 O40 -","4","0.5","LH6072","Sema Öztürk; Mehmet Akkurt; Nebahat Demirhan; Bahattin Kahveci; Hoong-Kun Fun; Nüket Öcal","Tetra-μ-nitroaminato-bis[aquacopper(II)]","Acta Crystallographica Section E","2003","59","8","i107","i109","10.1107/S1600536803013217","","","0.71073","MoKα","","0.061","0.0509","","","0.1068","0.1099","","","","","","1.291","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202677","12.958","0.003","24.556","0.005","25.753","0.006","90","","90","","90","","8195","3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C47 H44.5 N3 O2.75 -","- C47 H44.5 N3 O2.75 -","- C376 H356 N24 O22 -","8","1","LH6073","Li, Xiao-Fang; Feng, Ya-Qing; Hu,Xiao-Fen; Wang, Guan","1-Benzyl-5-(1-naphthylmethylene)piperidinespiro-3,3'-1'-methyl-4'-(1-naphthyl)pyrrolidinespiro-2',3''-indole-2'',4-dione‒diethyl ether (1/0.75)","Acta Crystallographica Section E","2003","59","7","o1025","o1027","10.1107/S1600536803013825","","","0.71073","MoKα","","0.1289","0.0618","","","","0.188","","","","","","1.017","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2202678","5.061","0.002","11.803","0.004","14.186","0.005","112.607","0.006","94.05","0.006","95.755","0.006","772.8","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-Benzyl-5-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-2,3-dihydro- 1H-isoindole-1,3-dione","","- C19 H12 N2 O4 -","- C19 H12 N2 O4 -","- C38 H24 N4 O8 -","2","1","LH6074","Shi, Da-Xin; Feng, Ya-Qing; Li, Xiao-Fang; Zhou, Li-shan","2-Benzyl-5-(2,5-dioxo-2,5-dihydro-1<i>H</i>-pyrrol-1-yl)-2,3-dihydro-1<i>H</i>-isoindole-1,3-dione","Acta Crystallographica Section E","2003","59","7","o1068","o1069","10.1107/S1600536803014181","","","0.71073","MoKα","","0.0549","0.0377","","","","0.1149","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202679","9.9969","0.0003","9.3366","0.0003","18.672","0.0006","90","","90.758","0.002","90","","1742.64","0.09","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","none","1,4,8,11-Tetrabenzyl-6,13-dimethylene-1,4,8,11-tetraazacyclotetradecane- 2,3,9,10-tetraone","","- C40 H40 N4 O4 -","- C40 H40 N4 O4 -","- C80 H80 N8 O8 -","2","0.5","LH6076","Gilardi, Richard; Evans, Robin N.; Dave, Paritosh R.","1,4,8,11-Tetrabenzyl-6,13-dimethylene-1,4,8,11-tetraazacyclotetradecane-2,3,9,10-tetraone","Acta Crystallographica Section E","2003","59","8","o1126","o1127","10.1107/S1600536803014843","","","1.54178","CuKα","","0.0744","0.0483","","","0.1268","0.1394","","","","","","0.906","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202680","7.5737","0.0001","10.6393","0.0001","12.4602","0.0001","79.524","0.001","74.738","0.001","73.828","0.001","923.889","0.018","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H16 Cl N3 S Sn -","- C17 H16 Cl N3 S Sn -","- C34 H32 Cl2 N6 S2 Sn2 -","2","1","LH6077","Elena López-Torres; María Antonia Mendiola; César J. Pastor","Chloro[5,6-diphenyl-1,2,4-triazine-3(2<i>H</i>)-thionato]dimethyltin(IV)","Acta Crystallographica Section E","2003","59","9","m713","m714","10.1107/S1600536803015356","","","1.54178","CuKα","","0.0279","0.0276","","","0.0705","0.0709","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202681","8.9936","0.0004","16.2164","0.0007","12.4217","0.0005","90","","101.999","0.001","90","","1772.05","0.13","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Disodium poly-μ-4,4-trans-dipyridylethylenebis[5-sulfoisophthalato(3-)cadmate(II)] hexahydrate","","- C28 H28 Cd2 N2 Na2 O20 S2 -","- C28 H28 Cd2 N2 Na2 O20 S2 -","- C56 H56 Cd4 N4 Na4 O40 S4 -","2","0.5","LH6078","Tao, Jun; Yin, Xin; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","Polymeric disodium (μ-<i>trans</i>-4,4'-ethylenedipyridyl)bis[μ-5-sulfoisophthalato(3‒)]dicadmate(II) hexahydrate","Acta Crystallographica Section E","2003","59","8","m611","m613","10.1107/S1600536803015289","","","0.71073","MoKα","","0.033","0.027","","","0.061","0.063","","","","","","0.948","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202682","7.4063","0.0005","18.157","0.001","23.801","0.002","90","","90","","90","","3200.7","0.4","298","2","298","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","Triaquabis(4,4'-bipyridine)copper(II) 2,6-naphthalenedicarboxylate tetrahydrate'","","- C32 H36 Cu N4 O11 -","- C32 H36 Cu N4 O11 -","- C128 H144 Cu4 N16 O44 -","4","0.5","LH6079","Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","Tetraaquabis(4,4'-bipyridine)copper(II) 2,6-naphthalenedicarboxylate trihydrate","Acta Crystallographica Section E","2003","59","8","m614","m615","10.1107/S1600536803015290","","","0.71073","MoKα","","0.077","0.042","","","0.109","0.12","","","","","","0.91","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202683","10.131","0.005","9.94","0.005","16.784","0.008","90","","97.33","0.03","90","","1676.4","1.4","173.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","tert-butoxycarbonyl-L-alanyl-L-proline methyl ester","","- C14 H24 N2 O5 -","- C14 H24 N2 O5 -","- C56 H96 N8 O20 -","4","2","LH6080","Oku, Hiroyuki; Yamada, Keiichi; Katakai, Ryoichi","<i>cis</i>- and <i>trans</i>-Conformers at the urethane linkage: <i>tert</i>-butoxycarbonyl-<small>L</small>-alanyl-<small>L</small>-proline methyl ester (Boc-<small>L</small>-Ala-<small>L</small>-Pro-OMe)","Acta Crystallographica Section E","2003","59","8","o1130","o1132","10.1107/S1600536803014831","","","1.54184","CuKα","","","0.089","","","","0.193","","","","","","1.759","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202684","9.9954","0.0001","16.463","0.001","14.095","0.001","90","","95.657","0.001","90","","2308.1","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H72 Cl4 P2 Pd2 -","- C42 H72 Cl4 P2 Pd2 -","- C84 H144 Cl8 P4 Pd4 -","2","0.5","LH6081","Sui-Seng, Christine; Bélanger-Gariépy, Francine; Zargarian, Davit","<i>trans</i>-Di-μ-chloro-bis[chloro(tricyclohexylphosphine)palladium] benzene solvate","Acta Crystallographica Section E","2003","59","8","m620","m621","10.1107/S1600536803015307","","","1.54178","CuKα","","0.0385","0.0328","","0.0847","","0.0826","","","0.981","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202685","7.018","0.006","8.818","0.007","18.76","0.016","90","","90","","90","","1161","1.7","273","2","273","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C9 H16 N2 O2 S -","- C9 H16 N2 O2 S -","- C36 H64 N8 O8 S4 -","4","1","LH6082","Song, Jian; Li, Xiao-Jun; Wu, Xiao-Ping; Lou, Ke-Xia; Feng, Rong-Xiu","(2<i>S</i>)-4-(Methylsulfanyl)-2-(pyrrolidin-1-yl)butanamide","Acta Crystallographica Section E","2003","59","9","o1290","o1292","10.1107/S1600536803016374","","","0.71073","MoKα","","0.0884","0.0621","","","","0.1197","","","","","","1.079","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202686","16.5321","0.0002","17.3265","0.0002","17.9862","0.0002","88.5668","0.0007","74.5401","0.0007","87.3795","0.0005","4959.98","0.1","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","Bis(tetraphenylphosphonium) bis(2-oxo-1,3-dithiole-4,5-dithiolato)zincate(II)","","- C54 H40 O2 P2 S8 Zn -","- C54 H40 O2 P2 S8 Zn -","- C216 H160 O8 P8 S32 Zn4 -","4","2","LH6083","Candiota, Rafeal O.; Comerlato, Nadia M.; Howie, R. Alan; Wardell, James L.","Bis(tetraphenylphosphonium) bis(2-oxo-1,3-dithiole-4,5-dithiolato)zincate(II)","Acta Crystallographica Section E","2003","59","8","m599","m601","10.1107/S1600536803015368","","","0.71073","MoKα","","0.0729","0.0509","","","0.1431","0.1682","","","","","","1.099","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202687","10.7987","0.0009","5.3744","0.0004","11.1259","0.0011","90","","105.781","0.007","90","","621.37","0.1","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H18 O6 Zn -","- C10 H18 O6 Zn -","- C20 H36 O12 Zn2 -","2","0.5","LH6084","Harbach, Philipp; Lerner, Hans-Wolfram; Bolte, Michael","Diaquadiacetylacetonatozinc(II)","Acta Crystallographica Section E","2003","59","9","m724","m725","10.1107/S1600536803015848","","","0.71073","MoKα","","0.023","0.0204","","","0.0547","0.0558","","","","","","1.062","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202688","13.0623","0.0009","10.9266","0.0005","11.6561","0.0008","90","","111.958","0.005","90","","1542.95","0.17","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H24 Br N -","- C15 H24 Br N -","- C60 H96 Br4 N4 -","4","1","LH6085","Zhang, Fan; Lerner, Hans-Wolfram; Bolte, Michael","2-[(2,6-Diisopropylphenyl)iminio]propyl bromide","Acta Crystallographica Section E","2003","59","8","o1181","o1182","10.1107/S1600536803015642","","","0.71073","MoKα","","0.0324","0.0229","","","0.0474","0.0494","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202689","6.7001","0.0003","11.3354","0.0006","12.874","0.0006","86.319","0.002","87.29","0.002","79.486","0.002","958.73","0.08","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H46 N6 Ni O10 -","- C38 H46 N6 Ni O10 -","- C38 H46 N6 Ni O10 -","1","0.5","LH6086","Qihua Zhao; Xiaofeng Wang; Ruibin Fang; Tiekink, Edward R. T.","Diaquadibenzoatobis[2-(4-pyridyl-κ<i>N</i>)-4,4,5,5-tetramethylimidazoline-1-oxyl 3-oxide]nickel(II)","Acta Crystallographica Section E","2003","59","9","m719","m721","10.1107/S160053680301585X","","","0.71069","MoKα","","0.062","0.049","","","0.116","0.123","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202690","13.3691","0.0005","11.2648","0.0005","19.5792","0.0009","90","","95.565","0.002","90","","2934.7","0.2","223","2","223","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C28 H24 Cu2 N16 -","- C28 H24 Cu2 N16 -","- C112 H96 Cu8 N64 -","4","0.5","LH6087","Qihua Zhao; Xiaofeng Wang; Ruibin Fang; Tiekink, Edward R. T.","Di-μ-azido-bis[azido(4,7-dimethyl-1,10-phenanthroline)copper(II)]","Acta Crystallographica Section E","2003","59","9","m722","m723","10.1107/S1600536803015861","","","0.71069","MoKα","","0.048","0.037","","","0.095","0.101","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202691","11.0922","0.0005","10.3891","0.0005","10.8714","0.0006","90","","107.632","0.002","90","","1193.94","0.1","223","2","223","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H16 N3 O2 -","- C12 H16 N3 O2 -","- C48 H64 N12 O8 -","4","0.5","LH6088","Qihua Zhao; Xiaofeng Wang; Ruibin Fang; Tiekink, Edward R. T.","4,4,5,5-Tetramethyl-2-(<i>p</i>-pyridyl)imidazoline-1-oxyl 3-oxide","Acta Crystallographica Section E","2003","59","8","o1231","o1232","10.1107/S1600536803015952","","","0.71069","MoKα","","0.062","0.054","","","0.146","0.152","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202692","12.055","0.0018","13.36","0.002","16.774","0.003","90","","104.46","0.03","90","","2616","0.8","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","triphenylarsine sulfadiazine gold(I)","triphenylarsine sulfadiazine gold(I)","","- C28 H24 As Au N4 O2 S -","- C28 H24 As Au N4 O2 S -","- C112 H96 As4 Au4 N16 O8 S4 -","4","1","LH6090","Marques, Lenice de Lourenço; Schulz Lang, Ernesto; Burrow, Robert Alan","[4-Amino-<i>N</i>-(pyrimidin-2-yl)benzenesulfonamido-κ<i>N</i>](triphenylarsine-κAs)gold(I)","Acta Crystallographica Section E","2003","59","9","m707","m709","10.1107/S1600536803017008","","","0.71073","MoKα","","0.0248","0.018","","","0.0421","0.0434","","","","","","0.999","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202693","9.1443","0.0012","19.4498","0.0014","8.6651","0.001","90","","106.989","0.009","90","","1473.9","0.3","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","sp-9-(meta-Methylphenyl)-9-fluorenol","","- C20 H16 O -","- C20 H16 O -","- C80 H64 O4 -","4","1","LH6091","McLean, Aaron W.; Meyers, Cal Y.; Robinson, Paul D.","<i>sp</i>-9-(<i>meta</i>-Methylphenyl)-9-fluorenol","Acta Crystallographica Section E","2003","59","8","o1228","o1230","10.1107/S1600536803016465","","","0.71069","MoKα","","0.106","0.045","","","0.117","0.142","","","","","","1.032","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202694","6.7654","0.001","21.9841","0.0018","7.4945","0.0014","90","","91.944","0.002","90","","1114","0.3","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H10 Co N2 O5 -","- C10 H10 Co N2 O5 -","- C40 H40 Co4 N8 O20 -","4","1","LH6092","Yu-Hong Xue; Dong-Dong Lin; Duan-Jun Xu","Polymeric aqua(benzimidazole-κ<i>N</i>)(μ-malonato)cobalt(II)","Acta Crystallographica Section E","2003","59","9","m750","m752","10.1107/S1600536803017574","","","0.71073","MoKα","","0.043","0.039","","","0.097","0.101","","","","","","1.12","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202695","9.1926","0.0008","9.1926","0.0008","22.724","0.002","90","","90","","90","","1920.3","0.3","297","","","","","","","","","","","5","P 41","P 4w","76","","","","- C14 H20 Cl3 N O6 -","- C14 H20 Cl3 N O6 -","- C56 H80 Cl12 N4 O24 -","4","1","LH6093","Ohba, Shigeru; Sato, Hideyuki; Iida, Masatoshi; Chida, Noritaka","(+)-Methyl (4<i>R</i>,5<i>S</i>)-4-[(<i>R</i>)-1-hydroxybut-3-enyl]-5-2,2-dimethyl-trichloroacetamido-1,3-dioxane-5-carboxylate","Acta Crystallographica Section E","2003","59","9","o1259","o1260","10.1107/S160053680301691X","","","0.7107","MoKα","","","0.0557","","","","0.1708","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202696","8.303","0.002","12.011","0.003","22.868","0.006","90","","90","","90","","2280.6","1","298","","","","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C30 H20 F2 O4 -","- C30 H20 F2 O4 -","- C120 H80 F8 O16 -","4","0.5","LH6094","Ohba, Shigeru; Yamamoto, Yohei; Tanaka, Koichi","<i>rac</i>-3,3'-Bis(4-fluorophenyl)-3,3'-dihydroxy-2,3,2',3'-tetrahydro-[2,2']biindenyl-1,1'-dione","Acta Crystallographica Section E","2003","59","9","o1261","o1262","10.1107/S1600536803016994","","","0.7107","MoKα","","","0.0542","","","","0.19","","","","","","1.029","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202697","6.8084","0.0013","12.071","0.002","6.4224","0.0015","90","","90","","90","","527.82","0.18","293","","293","","","","","","","","","5","P m m n :2","-P 2ab 2a","59","","catena-Poly[[aqua(diformato-κO)copper(II)]-μ-1,4-diazabicyclo[2.2.2]octane- κ^2^N:N']","","- C8 H16 Cu N2 O5 -","- C8 H16 Cu N2 O5 -","- C16 H32 Cu2 N4 O10 -","2","0.25","LH6095","Sieroń, Lesław","<i>catena</i>-Poly[[aqua(diformato-κ<i>O</i>)copper(II)]-μ-1,4-diazabicyclo[2.2.2]octane-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2003","59","9","m803","m805","10.1107/S1600536803017434","","","0.71073","MoKα","","0.0236","0.0232","","","0.0615","0.0618","","","","","","1.227","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202698","6.282","0.0009","28.836","0.004","8.4583","0.0013","90","","97.56","0.01","90","","1518.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(5-Methyl-4-phenyl-1,3-thiazol-2-yl)-1-phenylethanol","","- C18 H17 N O S -","- C18 H17 N O S -","- C72 H68 N4 O4 S4 -","4","1","LH6096","Rybakov, Victor B.; Liakina, Antonina Yu.; Popova, Inna S.; Formanovsky, Andrey A.; Aslanov, Leonid A.","2-(5-Methyl-4-phenyl-1,3-thiazol-2-yl)-1-phenylethanol","Acta Crystallographica Section E","2003","59","9","o1293","o1295","10.1107/S1600536803017446","","","1.5418","CuKα","","0.0487","0.0397","","","0.1069","0.1155","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202699","12.751","0.0011","14.7398","0.0012","15.0377","0.0013","90","","110.324","0.001","90","","2650.3","0.4","150","1","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(8-Quinolinoxy)phthalonitrile","","- C17 H9 N3 O -","- C17 H9 N3 O -","- C136 H72 N24 O8 -","8","2","LH6097","Köysal, Yavuz; Şamil, Işık; Akdemir, Nesuhi; Erbil, Ag̃ar; Mckee, Vickee","4-(8-Quinolinoxy)phthalonitrile","Acta Crystallographica Section E","2003","59","9","o1423","o1424","10.1107/S1600536803018841","","","0.71073","MoKα","","0.0746","0.0446","","","0.1026","0.1153","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202700","11.6252","0.0016","11.3317","0.0018","6.0403","0.001","90","","90","","90","","795.7","0.2","100","2","100","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Bromopentacarbonylmanganese","","- C5 Br Mn O5 -","- C5 Br Mn O5 -","- C20 Br4 Mn4 O20 -","4","0.5","LH6098","Haghiri, Alireza; Wagner, Matthias; Bolte, Michael","Bromopentacarbonylmanganese","Acta Crystallographica Section E","2003","59","9","i129","i130","10.1107/S1600536803017197","","","0.71073","MoKα","","0.0458","0.0323","","","0.0719","0.0756","","","","","","0.995","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202701","7.0668","0.001","8.515","0.0012","8.7929","0.0013","99.358","0.011","113.322","0.013","102.787","0.012","454.95","0.13","150","1","150","1","","","","","","","","5","P -1","-P 1","2","","","","- C18 H18 Co N4 O6 -","- C18 H18 Co N4 O6 -","- C18 H18 Co N4 O6 -","1","0.5","LH6099","Yu Liu; Duan-Jun Xu; Dong-Dong Lin; Kai-Liang Yin","<i>catena</i>-Poly[[diaquabis(benzimidazole-κ<i>N</i>)cobalt(II)]-μ-fumarato-κ^2^<i>O</i>^1^:<i>O</i>^4^]","Acta Crystallographica Section E","2003","59","9","m753","m755","10.1107/S1600536803017586","","","0.71073","MoKα","","0.08","0.045","","","0.081","0.113","","","","","","0.91","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202702","25.097","0.005","10.991","0.002","17.499","0.003","90","","101.28","0.03","90","","4733.7","1.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","dibenzoato-di(2-aminopyridine)nickel(II)","","- C24 H22 N4 Ni O4 -","- C24 H22 N4 Ni O4 -","- C192 H176 N32 Ni8 O32 -","8","1","LH6101","Zhu, Hai-Liang; Shao, Si-Chang; Ma, Ji-Long; Qiu, Xiao-Yang; Sun, Lin; Yang, Song","Dibenzoato-di(2-aminopyridine)nickel(II)","Acta Crystallographica Section E","2003","59","10","m843","m844","10.1107/S1600536803019329","","","0.71073","MoKα","","0.0362","0.0328","","","0.0921","0.0954","","","","","","1.034","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202703","11.492","0.002","11.806","0.002","12.511","0.003","109.01","0.03","93.9","0.03","99.56","0.03","1568.9","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(2RS,5SR)-2,5-Diferrocenyl-1,6-dibenzoyl-3,4-dithiahexane","","- C38 H34 Fe2 O2 S2 -","- C38 H34 Fe2 O2 S2 -","- C76 H68 Fe4 O4 S4 -","2","1","LH6103","Song, Qing-Bao; Li, Yi-Zhi; Liang, Yong-Min; Ma, Yong-Xiang","(2<i>RS</i>,5<i>SR</i>)-2,5-Diferrocenyl-1,6-dibenzoyl-3,4-dithiahexane","Acta Crystallographica Section E","2003","59","10","m861","m863","10.1107/S1600536803019159","","","0.71073","MoKα","","0.0415","0.0413","","","0.0958","0.0988","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202704","10.0177","0.0006","10.8091","0.0006","21.8916","0.0012","76.104","0.001","85.504","0.001","63.301","0.001","2054.6","0.2","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","catena-(bis(μ~2~-1,3-bis(4-pyridyl)propane-N,N')-diaqua-cobalt(II)) 1,3-bis(4-pyridyl)propane monohydrate dinitrate","","- C39 H48 Co N8 O9 -","- C39 H46 Co N8 O9 -","- C78 H92 Co2 N16 O18 -","2","1","LH6105","Nordell, Karen J.; Hammond, Jojo D.; Smith, Mark D.","<i>catena</i>-(Bis(μ~2~-1,3-bis(4-pyridyl)propane-<i>N,N</i>')-diaqua-cobalt(II)) dinitrate 1,3-bis(4-pyridyl)propane monohydrate","Acta Crystallographica Section E","2003","59","10","m852","m854","10.1107/S1600536803019330","","","0.71073","MoKα","","0.0682","0.0469","","","0.1175","0.1235","","","","","","0.956","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2202705","8.025","0.0005","8.231","0.0005","18.7105","0.0011","79.067","0.001","80.884","0.001","83.636","0.001","1193.97","0.13","103","2","103","2","","","","","","","","7","P -1","-P 1","2","","","","- C18 H31 Cl2 Co N4 O6 S -","- C18 H31 Cl2 Co N4 O6 S -","- C36 H62 Cl4 Co2 N8 O12 S2 -","2","1","LH6106","Deschamps, Jeffrey R.; Knight, D. Andrew; Goldman, Ellen R.; Delehanty, James B.; Chang, Eddie L.","Dichloro{methyl 4-[(1,4,7,10-tetraazacyclododec-1-yl)methyl]benzoate}cobalt(III) methylsulfate","Acta Crystallographica Section E","2003","59","10","m916","m918","10.1107/S1600536803020099","","","0.71073","MoKα","","0.0405","0.0343","","","0.0936","0.0983","","","","","","0.962","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202706","9.33","0.006","9.411","0.006","9.446","0.006","119.551","0.007","94.192","0.008","100.99","0.008","694.6","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H44 Cl2 N8 Ni O10 -","- C12 H44 Cl2 N8 Ni O10 -","- C12 H44 Cl2 N8 Ni O10 -","1","0.5","LH6108","Zhu, Hai-Liang; You, Zhong-Lu; Qu, Yang; Liu, Wei-Sheng; Tan, Min-Yu; Ma, Ji-Long","Hexaaquanickel(II) dichloride bis(hexamethylenetetramine) tetrahydrate","Acta Crystallographica Section E","2003","59","10","m924","m925","10.1107/S1600536803020269","","","0.71073","MoKα","","0.0338","0.0308","","","0.086","0.0887","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202707","8.4711","0.0008","13.4082","0.0008","11.8736","0.0011","90","","99.056","0.008","90","","1331.8","0.2","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","4-(2-indanoxy)phthalonitrile","","- C17 H12 N2 O -","- C17 H12 N2 O -","- C68 H48 N8 O4 -","4","1","LH6110","Işık, Şamil; Köysal, Yavuz; Akdemir, Nesuhi; Cihan, Kantar; Ag̃ar, Erbil","4-(2-Indanoxy)phthalonitrile","Acta Crystallographica Section E","2003","59","10","o1481","o1482","10.1107/S1600536803019755","","","0.71073","MoKα","","0.0932","0.0491","","","0.1199","0.1283","","","","","","0.639","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202708","8.5614","0.0001","16.0701","0.0002","10.2978","0.0002","90","","110.467","0.0007","90","","1327.36","0.03","293","1","293","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H12 Br2 N4 Pd -","- C9 H12 Br2 N4 Pd -","- C36 H48 Br8 N16 Pd4 -","4","1","LH6111","Herdtweck, E.; Muehlhofer, M.; Strassner, T.","Dibromo(1,1'-dimethyl-3,3'-methylenediimidazoline-2,2'-diylidene)palladium(II)","Acta Crystallographica Section E","2003","59","11","m970","m971","10.1107/S1600536803021251","","","0.71073","MoKα","","0.0401","0.0337","","","0.0909","0.095","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202709","29.54","0.02","4.613","0.005","26.89","0.02","90","","109.34","0.07","90","","3457","5","150","","150","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,4-Di(butylureido)-6-methyl-s-triazine","","- C14 H25 N7 O2 -","- C14 H25 N7 O2 -","- C112 H200 N56 O16 -","8","1","LH6112","Kooijman, Huub; Spek, Anthony L.; Beijer, Felix H.; Sijbesma, Rint P.; Meijer, E.W.","2,4-Di(butylureido)-6-methyl-<i>s</i>-triazine","Acta Crystallographica Section E","2003","59","10","o1546","o1548","10.1107/S160053680302018X","","","0.71073","MoKα","","0.2296","0.0766","","","0.1333","0.1869","","","","","","1.113","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202710","15.285","0.009","15.285","","6.732","0.005","90","","90","","90","","1572.8","1.5","293","2","293","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","trans-Bis(benzylamine)dichloropalladium(II)","","- C14 H18 Cl2 N2 Pd -","- C14 H18 Cl2 N2 Pd -","- C56 H72 Cl8 N8 Pd4 -","4","0.5","LH6113","Sui-Seng, Christine; Zargarian, Davit","<i>trans</i>-Bis(benzylamine)dichloropalladium(II)","Acta Crystallographica Section E","2003","59","10","m957","m958","10.1107/S1600536803020919","","","1.54178","CuKα","","0.052","0.037","","","0.117","0.137","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202711","13.2668","0.0006","9.184","0.0005","24.471","0.001","90","","90","","90","","2981.6","0.2","173.2","","173.2","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C9 H24 Cl2 N2 O2 -","- C9 H24 Cl2 N2 O2 -","- C72 H192 Cl16 N16 O16 -","8","1","LH6115","Thomas Q. Hu; Brian O. Patrick; David A. Osmond; Brian R. James","4-Ammonio-1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium dichloride monohydrate","Acta Crystallographica Section E","2003","59","10","o1584","o1585","10.1107/S160053680302097X","","","0.7107","MoKα","","0.0546","0.033","","0.0812","","0.0812","","","1.104","","","1.104","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202712","9.4185","0.0011","10.203","0.0012","12.3617","0.0015","106.223","0.002","93.856","0.002","116.698","0.002","993","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[[di-μ-chloro-bis[(5-nitro-1,10-phenanthroline)copper(II)]]- μ-terephthalato] bis(N,N'-dimethylformamide)]","","- C36 H32 Cl2 Cu2 N8 O10 -","- C38 H32 Cl2 Cu2 N8 O10 -","- C38 H32 Cl2 Cu2 N8 O10 -","1","0.5","LH6116","Xiao, Hong-Ping; Zhu, Long-Guan","<i>catena</i>-Poly[[[di-μ-chloro-bis[(5-nitro-1,10-phenanthroline)copper(II)]]-μ-terephthalato] bis(<i>N,N</i>'-dimethylformamide)]","Acta Crystallographica Section E","2003","59","11","m964","m966","10.1107/S1600536803021445","","","0.71073","MoKα","","0.062","0.0493","","","0.1187","0.1244","","","","","","0.961","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202713","9.129","0.0002","8.7002","0.0002","11.6958","0.0003","90","","109.28","0.01","90","","876.83","0.06","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Methyl exo-bicyclo[3.1.0]hexane-6,6-dicarboxylate","","- C9 H12 O4 -","- C9 H12 O4 -","- C36 H48 O16 -","4","1","LH6117","Yufit, Dmitrii S.; Bagutskii, Viktor; Howard, Judith A. K.; de Meijere, Armin","Methyl <i>exo</i>-bicyclo[3.1.0]hexane-6,6-dicarboxylate","Acta Crystallographica Section E","2003","59","11","o1610","o1612","10.1107/S1600536803021433","","","0.71073","MoKα","","0.0414","0.0357","","","0.093","0.0961","","","","","","1.057","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202714","8.694","0.0003","12.3225","0.0004","13.6724","0.0005","67.228","0.001","75.138","0.001","85.917","0.001","1304.75","0.08","198","2","198","2","","","","","","","","5","P -1","-P 1","2","","Bis(μ-2,2'-4,4'-6,6'-hexamethyl-μ-terphenyl-2'- phosphanido)bis[(N-methylimidazole)rubidium(I)]","","- C56 H64 N4 P2 Rb2 -","- C56 H64 N4 P2 Rb2 -","- C56 H64 N4 P2 Rb2 -","1","0.5","LH6118","Rabe, Gerd W.; Liable-Sands, Louise M.; Golen, James A.; Rheingold, Arnold L.","Bis(μ-2,2'-4,4'-6,6'-hexamethyl-μ-terphenyl-2'-phosphanido)bis[(<i>N</i>-methylimidazole)rubidium(I)]","Acta Crystallographica Section E","2003","59","11","m1056","m1058","10.1107/S1600536803023353","","","0.71073","MoKα","","0.0437","0.0385","","","0.1062","0.1095","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202715","20.13","0.006","6.357","0.002","17.394","0.005","90","","108.369","0.005","90","","2112.4","1.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1'-Methyl-4'-(2,4-dichlorophenyl)-1H-indole-3-spiro-2'-pyrrolidine-3'-spiro- 5''-(thiazolo[3,2-b][1,2,4]triazole)-2,6''(3H,5''H)-dione","","- C21 H15 Cl2 N5 O2 S -","- C21 H15 Cl2 N5 O2 S -","- C84 H60 Cl8 N20 O8 S4 -","4","1","LH6119","Li, Xiao-Fang; Feng, Ya-Qing; Gao, Bo; You, Xu-Dong","1'-Methyl-4'-(2,4-dichlorophenyl)-1<i>H</i>-indole-3-spiro-2'-pyrrolidine-3'-spiro-5''-(thiazolo[3,2-<i>b</i>][1,2,4]triazole)-2,6''(3<i>H</i>,5''<i>H</i>)-dione","Acta Crystallographica Section E","2003","59","11","o1810","o1811","10.1107/S1600536803023687","","","0.71073","MoKα","","0.0779","0.0466","","","","0.1193","","","","","","1.032","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202716","7.8972","0.0006","12.4909","0.0007","13.8701","0.0011","90","","92.325","0.006","90","","1367.06","0.17","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(η^5^-Cyclopentadienyl)(η^6^-1,2-dichlorobenzene)iron(II) hexafluorophosphate","","- C11 H9 Cl2 F6 Fe P -","- C11 H9 Cl2 F6 Fe P -","- C44 H36 Cl8 F24 Fe4 P4 -","4","1","LH6120","Jonathan D. Crane","(η^5^-Cyclopentadienyl)(η^6^-1,2-dichlorobenzene)iron(II) hexafluorophosphate","Acta Crystallographica Section E","2003","59","11","m1004","m1005","10.1107/S1600536803022116","","","0.71073","MoKα","","0.0557","0.0408","","","0.1043","0.1085","","","","","","1.026","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202717","9.0636","0.0007","26.2897","0.0015","15.1205","0.0011","90","","93.287","0.006","90","","3597","0.4","293","2","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C72 H72 Br8 O10 -","- C72 H72 Br8 O10 -","- C144 H144 Br16 O20 -","2","0.5","LH6121","Bolte, Michael; .; Brusko, Vasiliy; Böhmer, Volker; .","A new pseudopolymorph of 5,11,17,23,29,35,41,47-octabromo-49,50,51,52,53,54,55,56-octamethoxycalix[8]arene","Acta Crystallographica Section E","2003","59","11","o1691","o1693","10.1107/S1600536803022475","","","0.71073","MoKα","","0.0696","0.0433","","","0.1008","0.1112","","","","","","0.961","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202718","8.2331","0.0009","7.091","0.0005","13.5417","0.0013","90","","99.338","0.008","90","","780.1","0.13","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","trans-Dichlorobis(3,4-lutidine-κN)palladium(II)","","- C14 H18 Cl2 N2 Pd -","- C14 H18 Cl2 N2 Pd -","- C28 H36 Cl4 N4 Pd2 -","2","0.5","LH6122","Sui-Seng, Christine; Rochon, Fernande D.; Zargarian, Davit","<i>trans</i>-Dichlorobis(3,4-lutidine-κ<i>N</i>)palladium(II)","Acta Crystallographica Section E","2003","59","11","m1065","m1066","10.1107/S1600536803022840","","","0.71073","MoKα","","0.034","0.032","","","0.082","0.084","","","","","","1.18","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202719","14.505","0.002","9.037","0.001","14.913","0.002","90","","101.21","0.01","90","","1917.5","0.4","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ethyl 2-amino-4-(2,4-dichlorophenyl)-4H-benzo[f]chromene-3-carboxylate","","- C22 H17 Cl2 N O3 -","- C22 H17 Cl2 N O3 -","- C88 H68 Cl8 N4 O12 -","4","1","LH6123","Daqing Shi; Juxian Wang; Xiangshan Wang; Qiya Zhuang","Ethyl 2-amino-4-(2,4-dichlorophenyl)-4<i>H</i>-benzo[<i>f</i>]chromene-3-carboxylate","Acta Crystallographica Section E","2003","59","11","o1733","o1734","10.1107/S1600536803022852","","","0.71073","MoKα","","0.0699","0.0444","","","0.1177","0.1272","","","","","","1.085","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202720","14.5489","0.0008","5.4293","0.0003","17.2806","0.0013","90","","105.955","0.002","90","","1312.42","0.14","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-(2-Acetyloxyphenyl)-3-phenyl-1,2,4-oxadiazole","","- C16 H12 N2 O3 -","- C16 H12 N2 O3 -","- C64 H48 N8 O12 -","4","1","LH6125","Wardell, Solange M. S. V.; Carvalho, Carlos E. M.; Low, John N.; Glidewell, Christopher","Centrosymmetric π-stacked dimers in 5-(2-acetyloxyphenyl)-3-phenyl-1,2,4-oxadiazole","Acta Crystallographica Section E","2003","59","11","o1729","o1730","10.1107/S1600536803022864","","","0.71073","MoKα","","0.1215","0.0552","","","0.1052","0.1263","","","","","","0.968","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202721","17.263","0.005","6.8","0.004","22.832","0.008","90","","110.8","0.02","90","","2505.5","1.9","299","","299","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C11 H13 Cl2 N O4 -","- C11 H13 Cl2 N O4 -","- C88 H104 Cl16 N8 O32 -","8","1","LH6126","Takeo Fukunaga; Hiroyuki Ishida","Piperidinium hydrogen chloranilate","Acta Crystallographica Section E","2003","59","11","o1793","o1795","10.1107/S1600536803023365","","","0.71073","MoKα","","0.074","0.035","","","0.078","0.093","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202722","7.0596","0.0003","9.1575","0.0004","22.631","0.001","90","","90","","90","","1463.06","0.11","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Hexaamminechromium(III) diaquatetrachlorosodium(I)","","- Cl4 Cr H22 N6 Na O2 -","- Cl4 Cr H22 N6 Na O2 -","- Cl16 Cr4 H88 N24 Na4 O8 -","4","1","LH6127","Alig, Edith; Fink, Lothar; Bolte, Michael","Hexaamminechromium(III) diaquatetrachlorosodium(I)","Acta Crystallographica Section E","2003","59","11","i154","i155","10.1107/S160053680302378X","","","0.71073","MoKα","","0.0606","0.0374","","","0.065","0.0726","","","","","","1.057","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202723","13.486","0.001","4.403","0.001","15.435","0.001","90","","108.65","0.01","90","","868.4","0.2","173","","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H24 N2 -","- C20 H24 N2 -","- C40 H48 N4 -","2","0.5","LH6130","Müller, Thomas; Schrecke, Britta; Bolte, Michael","1,4-Bis(2,4,6-trimethylphenyl)-1,4-diazabuta-1,3-diene","Acta Crystallographica Section E","2003","59","11","o1820","o1821","10.1107/S1600536803024085","","","0.71073","MoKα","","0.0709","0.0473","","","0.1096","0.1249","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202724","18.716","0.004","15.533","0.003","17.685","0.004","90","","96.67","0.02","90","","5106.5","1.9","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2-Dimethyl-1,2-bis(2,3,4-triphenyl-1-naphthyl)disiloxane hexane solvate","","- C64 H60 O Si2 -","- C58 H46 O Si2 -","- C232 H184 O4 Si8 -","4","1","LH6131","Müller, Thomas; Meyer, Rita; Bolte, Michael","1,3-Dimethyl-1,3-bis(2,3,4-triphenyl-1-naphthyl)disiloxane hexane solvate","Acta Crystallographica Section E","2003","59","11","o1838","o1839","10.1107/S1600536803024255","","","0.71073","MoKα","","0.3488","0.1341","","","0.2808","0.3625","","","","","","0.967","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202725","13.262","0.002","10.814","0.001","23.462","0.004","90","","98.4","0.01","90","","3328.7","0.8","291","2","291","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","8,9-diphenylimidazo[1,2-c]quinazoline","","- C22 H15 N3 -","- C22 H15 N3 -","- C176 H120 N24 -","8","2","LH6132","Daqing Shi; Juxian Wang; Chunling Shi; Liangce Rong; Xiangshan Wang; Hongwen Hu","8,9-Diphenylimidazo[1,2-<i>c</i>]quinazoline","Acta Crystallographica Section E","2003","59","11","o1846","o1848","10.1107/S1600536803024267","","","0.71073","MoKα","","0.1023","0.0423","","","0.0805","0.0935","","","","","","0.8","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202726","9.594","0.002","16.928","0.004","12.865","0.003","90","","95.73","0.02","90","","2078.9","0.8","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5,5-dimethyl-8,9-methylenedioxyl-2,3-diphenyl- 5,6-dihydroimidazo-[1,2-c]quinazoline","","- C25 H21 N3 O2 -","- C25 H21 N3 O2 -","- C100 H84 N12 O8 -","4","1","LH6133","Daqing Shi; Juxian Wang; Chunling Shi; Liangce Rong; Xiangshan Wang; Hongwen Hu","5,5-Dimethyl-8,9-methylenedioxy-2,3-diphenyl-5,6-dihydroimidazo[1,2-<i>c</i>]quinazoline","Acta Crystallographica Section E","2003","59","11","o1843","o1845","10.1107/S1600536803024358","","","0.71073","MoKα","","0.1065","0.0482","","","0.1134","0.1274","","","","","","0.817","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202727","12.7421","0.0002","7.1908","0.0001","12.9536","0.0003","90","","111.9","0.001","90","","1101.24","0.04","123","2","123","2","","","","","","","","4","P 1 21 1","P 2yb","4","morphine 3-(1-naphthoate)","7,8-didehydro-4,5-epoxy-17-methylmorphinan-6-(naphthalene-1-carboxylate)","","- C28 H25 N O4 -","- C28 H25 N O4 -","- C56 H50 N2 O8 -","2","1","LH6134","Gathergood, Nicholas; Scammells, Peter J.; Fallon, Gary D.; 7,8-didehydro-4,5-epoxy-17-methylmorphinan-6-(naphthalene-1-carboxylate)","7,8-Didehydro-4,5-epoxy-17-methylmorphinan-6-yl naphthalene-1-carboxylate","Acta Crystallographica Section E","2003","59","12","o1918","o1919","10.1107/S1600536803025121","","","0.71073","MoKα","","0.0521","0.0356","","","0.075","0.0822","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202728","11.414","0.0003","11.414","0.0003","26.7688","0.0017","90","","90","","120","","3020.2","0.2","193","2","193","2","","","","","","","","5","P 31","P 31","144","N-Ferrocenoyl-Glutamate-(OEt)2","","","- C20 H25 Fe N O5 -","- C20 H25 Fe N O5 -","- C120 H150 Fe6 N6 O30 -","6","2","LH6135","Kraatz, Heinz-Bernhard; Sutherland, Todd C.; Appoh, Francis E.","<i>N</i>-Ferrocenoyl-labelled glutamate diethyl ester","Acta Crystallographica Section E","2003","59","12","m1174","m1175","10.1107/S1600536803026187","","","0.71073","MoKα","","0.0427","0.0376","","","0.0911","0.0952","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202729","13.1317","0.0009","15.709","0.001","28.594","0.002","90","","90","","90","","5898.5","0.7","218","2","218","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(η^8^-Cyclooctatetraenyl)(2,2'',4,4'',6,6''-hexamethyl-μ- terphenyl-κC^2'^)(tetrahydrofuran-κO)thulium(III)","","- C36 H41 O Tm -","- C36 H41 O Tm -","- C288 H328 O8 Tm8 -","8","1","LH6136","Rabe, Gerd W.; Zhang-Preße, Mei; Golen, James A.; Rheingold, Arnold L.","(η^8^-Cyclooctatetraene)(2,2'',4,4'',6,6''-hexamethyl-<i>m</i>-terphenyl-κ<i>C</i>^2'^)(tetrahydrofuran-κ<i>O</i>)thulium(III)","Acta Crystallographica Section E","2003","59","12","m1102","m1103","10.1107/S1600536803025005","","","0.71073","MoKα","","0.0468","0.0286","","","0.0641","0.072","","","","","","1.013","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202730","24.959","0.002","11.951","0.001","9.192","0.002","90","","90","","90","","2741.8","0.7","110","2","110","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","catena-Poly[benzylmethylammonium [[diaquadichloromanganese(II)]-μ-chloro]]]","catena-Poly[benzylmethylammonium [[diaquadichloromanganese(II)]-μ-chloro]]]","","- C8 H16 Cl3 Mn N O2 -","- C8 H16 Cl3 Mn N O2 -","- C64 H128 Cl24 Mn8 N8 O16 -","8","1","LH6138","Maris, Thierry; Zouari, Ridha","<i>catena</i>-Poly[benzylmethylammonium [[diaquadichloromanganate(II)]-μ-chloro]]","Acta Crystallographica Section E","2003","59","12","m1201","m1203","10.1107/S160053680302659X","","","0.71069","MoKα","","0.0705","0.0473","","","0.1161","0.1269","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202731","16.963","0.005","8.108","0.002","11.752","0.003","90","","104.836","0.011","90","","1562.4","0.7","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,4,6-triisopropylbenzenesulfonamide","","- C15 H25 N O2 S -","- C15 H25 N O2 S -","- C60 H100 N4 O8 S4 -","4","1","LH6141","Clark, J. Caleb; McLaughlin, Mark L.; Fronczek, Frank R.","2,4,6-Triisopropylbenzenesulfonamide from single-crystal data","Acta Crystallographica Section E","2003","59","12","o2005","o2006","10.1107/S1600536803026382","","","0.71073","MoKα","","0.073","0.053","","","0.125","0.136","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202732","7.404","0.003","5.6695","0.0009","19.144","0.003","90","","100.42","0.02","90","","790.4","0.4","297","","297","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H4 Cl N O4 -","- C7 H4 Cl N O4 -","- C28 H16 Cl4 N4 O16 -","4","1","LH6142","Hiroyuki Ishida; Takeo Fukunaga","A redetermination of 4-chloro-3-nitrobenzoic acid","Acta Crystallographica Section E","2003","59","12","o1984","o1986","10.1107/S1600536803026394","","","0.71073","MoKα","","0.049","0.033","","","0.079","0.087","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202733","12.2645","0.0015","12.2645","0.0015","34.372","0.006","90","","90","","90","","5170.2","1.3","160","2","160","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","(18-Crown-6)-bis(tetrahydrofuran)potassium iodide","","- C20 H40 I K O8 -","- C20 H40 I K O8 -","- C160 H320 I8 K8 O64 -","8","1","LH6144","Liddle, Stephen T.; Clegg, William","(18-Crown-6)-bis(tetrahydrofuran)potassium iodide","Acta Crystallographica Section E","2003","59","12","m1184","m1186","10.1107/S160053680302676X","","","0.71073","MoKα","","0.0443","0.0371","","","0.0785","0.0809","","","","","","1.104","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202734","11.1047","0.0016","11.1047","0.0016","17.885","0.004","90","","90","","120","","1910","0.6","293","2","293","2","","","","","","","","3","P 63/m c m","-P 6c 2","193","gadolinium tantalum aluminum","gadolinium tantalum aluminum","","- Al43 Gd6 Ta4 -","- Al43 Gd6 Ta4 -","- Al86 Gd12 Ta8 -","2","0.0833333","MG6025","Condron, Cathie L.; Strand, Joel D.; Miller, Gordon J.; Canfield, Paul C.","The intermetallic compound Gd~6~Ta~4~Al~43~","Acta Crystallographica Section E","2003","59","11","i147","i148","10.1107/S1600536803021640","","","0.71073","MoKα","","0.0195","0.0189","","","0.043","0.0431","","","","","","1.34","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202735","9.2117","0.0002","16.3725","0.0004","7.7207","0.0002","90","","111.059","0.001","90","","1086.65","0.05","173","2","173","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","pentapotassium sodium hexasulphatodicerate(III)","","- Ce2 K5 Na O24 S6 -","- Ce2 K5 Na O24 S6 -","- Ce4 K10 Na2 O48 S12 -","2","0.25","MG6026","Annika K. Eriksson; Barbara M. Casari; Langer, Vratislav","Pentapotassium sodium hexasulfatodicerate(III)","Acta Crystallographica Section E","2003","59","11","i149","i150","10.1107/S1600536803023183","","","0.71073","MoKα","","0.0237","0.02","","","0.0494","0.0512","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202736","6.0073","0.0004","16.5286","0.001","8.3057","0.0005","90","","100.56","0.01","90","","810.72","0.09","82","2","82","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Lead(II) bromide β-alanine","","- C3 H7 Br2 N O2 Pb -","- C3 H7 Br2 N O2 Pb -","- C12 H28 Br8 N4 O8 Pb4 -","4","1","NA6234","Kathleen Reynolds; Roger D. Willett; Brendan Twamley","(β-Alanine)dibromolead(II)","Acta Crystallographica Section E","2003","59","7","m402","m404","10.1107/S1600536803011619","","","0.71073","MoKα","","0.0201","0.0184","","","0.0414","0.042","","","","","","1.198","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202737","9.4045","0.001","10.9423","0.0011","23.426","0.0019","90","","104.187","0.004","90","","2337.2","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C56 H46 N4 O8 -","- C56 H46 N4 O8 -","- C112 H92 N8 O16 -","2","0.5","NA6237","Yung-Chan Lin; Jian-Cheng Liou; Tian-Huey Lu; Fen-Ling Liao; Chung-Sun Chung","5,10,15,20-Tetrakis[(4-ethylcarbonyl)oxy]phenylporphyrin","Acta Crystallographica Section E","2003","59","7","o969","o971","10.1107/S1600536803011978","","","0.71073","MoKα","","0.2557","0.0649","","","0.1526","0.1608","","","","","","0.801","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202738","14.601","0.0005","16.963","0.0007","14.743","0.0007","90","","90.857","0.0014","90","","3651.1","0.3","150","1","150","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Dichloro [κ^2^-P,N-(R,R)-(N-benzylidene)-1-amino-2- diphenylphosphinocyclohexane]triphenylphosphine ruthenium(II)","","- C43 H41 Cl2 N P2 Ru -","- C43 H41 Cl2 N P2 Ru -","- C172 H164 Cl8 N4 P8 Ru4 -","4","2","NA6240","Caiazzo, Aldo; Lough, Alan J.; Yudin, Andrei K.","[(<i>R,R</i>)-1-(<i>N</i>-Benzylideneamino)-2-(diphenylphosphino)cyclohexane-κ^2^<i>N,P</i>]dichloro(triphenylphosphine-κ<i>P</i>)ruthenium(II)","Acta Crystallographica Section E","2003","59","7","m399","m401","10.1107/S1600536803011772","","","0.71073","MoKα","","0.0791","0.0514","","","0.1048","0.1183","","","","","","0.978","","","","has coordinates,has Fobs","194596","2020-10-21","18:00:00",""
"2202739","8.0031","0.0002","8.1873","0.0002","10.8911","0.0003","72.704","0.001","81.7766","0.0011","78.7917","0.0009","665.59","0.03","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C5 H16 N2 O11 S2 U -","- C5 H16 N2 O11 S2 U -","- C10 H32 N4 O22 S4 U2 -","2","1","NA6241","Stuart, Clair L.; Doran, Michael B.; Norquist, Alexander J.; O'Hare, Dermot","<i>catena</i>-Poly[1-methylpiperazinium [[aquadioxouranium(VI)]-di-μ-sulfato-κ^4^<i>O</i>:<i>O</i>']]","Acta Crystallographica Section E","2003","59","7","m446","m448","10.1107/S1600536803011966","","","0.71073","MoKα","","","0.0212","","","","0.0535","","","","","","1.0143","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2202740","17.7196","0.0013","12.0092","0.0011","13.28","0.0019","90","","97.976","0.008","90","","2798.6","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(1-Naphthoxy)phthalonitrile","","- C18 H10 N2 O -","- C18 H10 N2 O -","- C144 H80 N16 O8 -","8","2","NA6242","Karadayı, Nevzat; Akdemir, Nesuhi; Ag̃ar, Erbil; Gümrükçüoǧlu, I.E.; Büyükgüngör, Orhan","4-(1-Naphthoxy)phthalonitrile","Acta Crystallographica Section E","2003","59","7","o945","o946","10.1107/S160053680301225X","","","0.71073","MoKα","","0.0808","0.0319","","","0.0673","0.0744","","","","","","0.725","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202741","13.922","0.003","14.841","0.004","15.024","0.004","65.547","0.005","70.265","0.005","67.182","0.004","2545.9","1.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","diaquabis[dimethylglyoximato(2-)]bis[dimethylglyoximato(1-)] bis(phenanthroline)tetracopper(II) bis[dimethylglyoximato(2-)]bis[dimethylglyoximato(1-)] bis(phenanthroline)tetracopper(II) tetraperchlorate methanol disolvate","","- C82 H96 Cl4 Cu8 N24 O36 -","- C82 H88 Cl4 Cu8 N24 O36 -","- C82 H88 Cl4 Cu8 N24 O36 -","1","0.5","NA6243","Zhang, Baofeng; Chu, Sheng; Wang, Xiaoqing; Shen, Guangqiu; Wang, Ru-Ji","A new tetranuclear copper(II) complex bridged by dimethylglyoxime","Acta Crystallographica Section E","2003","59","7","m504","m506","10.1107/S1600536803013382","","","0.71073","MoKα","","0.1123","0.0563","","","0.1328","0.1593","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202742","6.003","0.005","15.175","0.005","19.237","0.005","90","","91.794","0.005","90","","1751.5","1.6","120","2","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C21 H22 N4 -","- C21 H22 N4 -","- C84 H88 N16 -","4","1","NA6244","Bjernemose, Jens K.; McKenzie, Christine J.; Mortensen, Martin N.","2-Phenyl-1,3-bis(2-pyridylmethyl)imidazolidine","Acta Crystallographica Section E","2003","59","7","o1017","o1018","10.1107/S1600536803013394","","","0.71069","MoKα","","","0.0493","","","","0.1106","","","","","","1.016","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202743","6.043","0.001","20.996","0.001","9.372","0.001","90","","91.912","0.001","90","","1188.4","0.2","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-(2-furylmethyl)-1-methyl-3-oxocyclohexanecarboxylic acid","","- C13 H16 O4 -","- C13 H16 O4 -","- C52 H64 O16 -","4","1","NA6245","Ray, Jayanta Kumar; Kanti Mal, Sajal; Canle L., M.; Santaballa, J. A.; Mahía, Jose","2-(2-Furylmethyl)-1-methyl-3-oxocyclohexanecarboxylic acid","Acta Crystallographica Section E","2003","59","7","o1050","o1052","10.1107/S1600536803012492","","","0.71073","MoKα","","0.0478","0.0391","","","0.1066","0.1131","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202744","14.618","0.003","3.9575","0.0008","21.643","0.004","90","","91.887","0.003","90","","1251.4","0.4","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","4-Chloro-2',6'-dimethyl-4'-hydroxyazobenzene","2,6-dimethyl-4-(4-chlorophenyldiazenyl)phenol","","- C14 H13 Cl N2 O -","- C14 H13 Cl N2 O -","- C56 H52 Cl4 N8 O4 -","4","1","NA6246","Kocaokutgen, Hasan; Gür, Mahmut; Soylu, M. Serkan; Lörnnecke, Peter","2,6-Dimethyl-4-(4-chlorophenyldiazenyl)phenol","Acta Crystallographica Section E","2003","59","11","o1613","o1615","10.1107/S1600536803021172","","","0.71073","MoKα","","0.0509","0.0392","","","0.1017","0.1093","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202745","9.784","0.003","23.62","0.007","11.752","0.004","90","","105.228","0.005","90","","2620.5","1.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(4-chlorophenyl)[4-(2,2-diphenylvinyl)phenyl]amine","","- C32 H23 Cl2 N -","- C32 H23 Cl2 N -","- C128 H92 Cl8 N4 -","4","1","NA6247","Cao, Xiao-Dan; Liu, Dong-Zhi; Zhou, Xue-Qin","Bis(4-chlorophenyl)[4-(2,2-diphenylvinyl)phenyl]amine","Acta Crystallographica Section E","2003","59","11","o1592","o1593","10.1107/S1600536803021494","","","0.71073","MoKα","","0.1579","0.062","","","","0.1227","","","","","","0.992","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202746","8.0158","0.0016","12.462","0.003","17.824","0.004","90","","99.89","0.03","90","","1754","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H17 N5 O2 S -","- C17 H17 N5 O2 S -","- C68 H68 N20 O8 S4 -","4","1","NA6249","Fangfang Jian; Hailian Xiao; Liangzhong Xu","2-[(ρ-Methoxyphenylcarbonyl)(1,2,4-triazol-1-yl)methyl]sulfanyl-4,6-dimethylpyrimidine","Acta Crystallographica Section E","2003","59","11","o1663","o1665","10.1107/S160053680302172X","","","0.71073","MoKα","","0.0827","0.0452","","","0.1152","0.1251","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202747","6.751","0.001","11.99","0.001","13.061","0.001","90","","90","","90","","1057.2","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","5-Amino-8-(1-aminoethylidene)-8H-tetrazolo[1,5-a]pyridin-7-one dihydrate","","- C7 H12 N6 O3 -","- C7 H12 N6 O3 -","- C28 H48 N24 O12 -","4","1","NA6250","Stefania Fusi; Donato Donati; Fabio Ponticelli","5-Amino-8-(1-aminoethylidene)-8<i>H</i>-tetrazolo[1,5-<i>a</i>]pyridin-7-one dihydrate","Acta Crystallographica Section E","2003","59","11","o1589","o1591","10.1107/S1600536803021366","","","0.71073","MoKα","","0.099","0.0511","","","0.1064","0.1239","","","","","","0.99","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202748","8.4865","0.0005","8.8025","0.0002","12.2034","0.0002","89.9661","0.0007","87.4671","0.0008","75.2109","0.0007","880.51","0.06","291","1","291","1","","","","","","","","3","P -1","-P 1","2","","Methyl rac-(1S*,11R*,12S*,14S*)-12-hydroxy-14-methyl-15- oxobicyclo[9.3.1]pentadecane-1-carboxylate","","- C18 H30 O4 -","- C18 H30 O4 -","- C36 H60 O8 -","2","1","NA6251","Fresu, Sonia; Schürmann, Markus; Preut, Hans; Eilbracht, Peter","Methyl <i>rac</i>-(1<i>S</i>*,11<i>R</i>*,12<i>S</i>*,14<i>S</i>*)-12-hydroxy-14-methyl-15-oxobicyclo[9.3.1]pentadecane-1-carboxylate","Acta Crystallographica Section E","2003","59","11","o1786","o1787","10.1107/S1600536803023420","","","0.71073","MoKα","","0.0573","0.0417","","","0.1249","0.1307","","","","","","1.139","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202749","6.5585","0.0005","25.1747","0.0019","14.6163","0.0011","90","","93.259","0.001","90","","2409.4","0.3","297","2","297","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Tris(hydrogen oxydiacetato)dysprosium(III) oxydiacetic acid monohydrate","","- C16 H23 Dy O21 -","- C16 H23 Dy O21 -","- C64 H92 Dy4 O84 -","4","1","NA6253","Ricardo Baggio; Perec, Mireille; Garland, Maria Teresa","Tris(hydrogen oxydiacetato)dysprosium(III) oxydiacetic acid monohydrate","Acta Crystallographica Section E","2003","59","11","m994","m996","10.1107/S1600536803022189","","","0.71073","MoKα","","0.0341","0.0276","","","0.0679","0.0715","","","","","","0.894","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202750","12.6914","0.0002","11.7483","0.0002","17.4988","0.0002","90","","90","","90","","2609.11","0.07","123","2","123","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","1-butylimidazolium-3-(n-butanesulfonate)","","- C11 H20 N2 O3 S -","- C11 H20 N2 O3 S -","- C88 H160 N16 O24 S8 -","8","1","NA6254","Pringle, Jennifer M.; Forsyth, Craig. M.; Forsyth, Maria; MacFarlane, Douglas R.","The zwitterion 1-butylimidazolium-3-(<i>n</i>-butanesulfonate)","Acta Crystallographica Section E","2003","59","11","o1759","o1761","10.1107/S1600536803023043","","","0.71073","MoKα","","0.083","0.0528","","","0.1287","0.1453","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202751","12.296","0.0008","9.7463","0.0007","9.9583","0.0007","90","","90","","90","","1193.41","0.14","293","","293","2","","","","","","","","6","P n n m","-P 2 2n","58","","2,2-Dimethoxy-1,3,2-dithiagermole-4,5-dicarbonitrile","","- C6 H4 Ge N2 O2 S2 -","- C6 H4 Ge N2 O2 S2 -","- C24 H16 Ge4 N8 O8 S8 -","4","0.5","NA6255","Sema Öztürk; Mehmet Akkurt; Tevfik Rıza Kök; Hoong-Kun Fun","2,2-Dimethoxy-1,3,2-dithiagermole-4,5-dicarbonitrile","Acta Crystallographica Section E","2003","59","11","m1018","m1019","10.1107/S1600536803022682","","","0.71073","MoKα","","0.0457","0.0373","","","0.0955","0.1012","","","","","","1.034","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202752","3.7925","0.0014","13.916","0.005","12.141","0.004","90","","90.862","0.005","90","","640.7","0.4","293","2","","","","","","","","","","4","P 1 21 1","P 2yb","4","","4-hydroxymethylimidazolium picrate","","- C10 H9 N5 O8 -","- C10 H9 N5 O8 -","- C20 H18 N10 O16 -","2","1","NA6256","Miao Du; Xiao-Jun Zhao","Hydrogen-bonding in 4-(hydroxymethyl)imidazolium picrate","Acta Crystallographica Section E","2003","59","12","o1898","o1900","10.1107/S160053680302381X","","","0.71073","MoKα","","0.0437","0.0333","","","0.0845","0.1113","","","","","","1.152","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202753","7.651","0.0003","8.618","0.0003","24.5243","0.001","90","","89.4079","0.0015","90","","1616.96","0.11","291","1","291","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-Butyl-4-[2-(3,4-dihydroxyphenyl)vinyl]pyridinium chloride","","- C17 H20 Cl N O2 -","- C17 H20 Cl N O2 -","- C68 H80 Cl4 N4 O8 -","4","1","NA6257","Kolev, Tsonko; Berends, Thorsten; Kleb, Dirk-Christian; Preut, Hans; Spiteller, Michael","<i>N</i>-Butyl-4-[2-(3,4-dihydroxyphenyl)vinyl]pyridinium chloride","Acta Crystallographica Section E","2003","59","11","o1788","o1789","10.1107/S1600536803023390","","","0.71073","MoKα","","0.1383","0.0397","","","0.0579","0.0618","","","","","","0.807","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202754","12.315","0.003","12.057","0.002","12.532","0.003","90","0.03","118.55","0.03","90","0.03","1634.5","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,4-Dimethyl-3-oxo-1-(1,2,4-triazol-1-yl)pentan-2-yl N,N-dimethyldithiocarbamate","","- C12 H20 N4 O S2 -","- C12 H20 N4 O S2 -","- C48 H80 N16 O4 S8 -","4","1","NA6258","Fangfang Jian; Hailian Xiao; Liangzhong Xu","4,4-Dimethyl-3-oxo-1-(1,2,4-triazol-1-yl)pentan-2-yl <i>N,N</i>-dimethyldithiocarbamate","Acta Crystallographica Section E","2003","59","11","o1754","o1756","10.1107/S1600536803023055","","","0.71073","MoKα","","0.0908","0.0449","","","0.1043","0.1141","","","","","","1.017","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202755","8.482","0.001","8.597","0.001","22.489","0.004","90","","90.71","0.01","90","","1639.8","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tris(1H-imidazole-κN^3^)(dl-malate-κ^3^O,O',O'')cobalt(II)","","- C13 H16 Co N6 O5 -","- C13 H16 Co N6 O5 -","- C52 H64 Co4 N24 O20 -","4","1","NA6259","Zhi Min Jin; Lin He; Liang Shen; Mei Chao Li; Mao Lin Hu","Tris(1<i>H</i>-imidazole-κ<i>N</i>^3^)(<small>DL</small>-malato-κ^3^<i>O,O</i>',<i>O</i>'')cobalt(II)","Acta Crystallographica Section E","2003","59","11","m1053","m1055","10.1107/S1600536803023407","","","0.71073","MoKα","","0.045","0.0356","","","0.0919","0.0953","","","","","","1.081","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202756","9.817","0.002","11.043","0.003","15.819","0.004","90","","90","","90","","1714.9","0.7","120","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Benzylammonium nitrate","","- C7 H10 N2 O3 -","- C7 H10 N2 O3 -","- C56 H80 N16 O24 -","8","1","NA6260","Rademeyer, Melanie","Benzylammonium nitrate","Acta Crystallographica Section E","2003","59","11","o1860","o1861","10.1107/S1600536803024243","","","0.71073","MoKα","","0.0876","0.0685","","","0.1604","0.1716","","","","","","1.293","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202757","9.4199","0.0005","8.6557","0.0005","10.1261","0.0007","90","","99.872","0.004","90","","813.41","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H20 Cu N2 O6 -","- C16 H20 Cu N2 O6 -","- C32 H40 Cu2 N4 O12 -","2","0.5","NA6261","Borkowski, Lauren A.; Cahill, Christopher L.","Poly[diaquabis(3-pyridylpropionato)copper(II)]","Acta Crystallographica Section E","2003","59","12","m1127","m1128","10.1107/S160053680302484X","","","0.71069","MoKα","","0.0455","0.0323","","","0.0667","0.0719","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202758","16.5752","0.0017","10.4233","0.0013","6.4744","0.0014","90","","90","","90","","1118.6","0.3","295","2","295","2","","","","","","","","5","I b a m","-I 2 2c","72","","","","- C8 H14 N4 Ni O4 -","- C8 H14 N4 Ni O4 -","- C32 H56 N16 Ni4 O16 -","4","0.25","NA6262","Dai-Xi Li; Duan-Jun Xu; Yuan-Zhi Xu","Redetermination of bis(dimethylglyoximato-κ^2^<i>N,N</i>')nickel(II)","Acta Crystallographica Section E","2003","59","12","m1094","m1095","10.1107/S1600536803024656","","","0.71073","MoKα","","0.038","0.034","","","0.1","0.103","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202759","9.967","0.003","15.042","0.004","10.271","0.003","90","","117.121","0.004","90","","1370.6","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(2,4-Dichlorophenyl)-3-hydroxy-1-phenylpropan-1-one","","- C15 H12 Cl2 O2 -","- C15 H12 Cl2 O2 -","- C60 H48 Cl8 O8 -","4","1","NA6263","Zhifang Yu; Bing Zhao; Zhongzhen Tian; Xiuyan Gu","3-(2,4-Dichlorophenyl)-3-hydroxy-1-phenylpropan-1-one","Acta Crystallographica Section E","2003","59","12","o2020","o2021","10.1107/S1600536803025248","","","0.71073","MoKα","","0.0722","0.0421","","","0.0971","0.1109","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202760","10.226","0.002","11.207","0.002","11.778","0.002","80.75","0.03","85.32","0.03","88.7","0.03","1327.7","0.5","183","2","183","2","","","","","","","","5","P -1","-P 1","2","4-Bromo-1,3-dimethylpyrazole-5-carboxylic acid methyl ester","","","- C7 H9 Br N2 O2 -","- C7 H9 Br N2 O2 -","- C42 H54 Br6 N12 O12 -","6","3","","Fangjun Huo; Caixia Yin; Wei Guo; Chizhong Xia; Pin Yang","Methyl 4-bromo-1,3-dimethylpyrazole-5-carboxylate","Acta Crystallographica, Section E","2003","59","","o2013","o2104","10.1107/S160053680302525X","","","","","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2202761","8.872","0.0007","10.81","0.0011","21.9284","0.0019","90","","90","","90","","2103.1","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","1-{(2E)-2-[(Aminocarbonothioyl)hydrazono]-2-(3-mesityl-3- methylcyclobutyl)ethyl}pyrrolidine-2,5-dione","","- C21 H28 N4 O2 S -","- C21 H28 N4 O2 S -","- C84 H112 N16 O8 S4 -","4","1","NA6266","Karakurt, Tuncay; Dinçer, Muharrem; Yılmaz, İbrahim; Çukurovalı, Alaaddın","1-{(2<i>E</i>)-2-[(Aminocarbonothioyl)hydrazono]-2-(3-mesityl-3-methylcyclobutyl)ethyl}pyrrolidine-2,5-dione","Acta Crystallographica Section E","2003","59","12","o1997","o1999","10.1107/S1600536803026096","","","0.71073","MoKα","","0.075","0.043","","","0.101","0.11","","","","","","0.88","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202762","9.8318","0.0016","6.066","0.003","18.493","0.002","90","","92.891","0.013","90","","1101.5","0.6","153","1","153","1","","","","","","","","3","P 1 21 1","P 2yb","4","","(+)-pinoresinol‒dioxane (1/1)","","- C24 H30 O8 -","- C24 H30 O8 -","- C48 H60 O16 -","2","1","NA6268","Stomberg, Rolf; Ibrahim, Wilson; Langer, Vratislav; Lundquist, Knut","(+)-Pinoresinol‒dioxane (1/1)","Acta Crystallographica Section E","2003","59","12","o1972","o1974","10.1107/S1600536803026114","","","0.71069","MoKα","","0.0601","0.0412","","","0.1107","0.1211","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202763","16.947","0.001","5.5645","0.0004","19.462","0.002","90","","95.803","0.001","90","","1825.9","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Aqua{1-[(2-oxidophenyl)iminomethyl]naphthalen-2-olato}pyridinecopper(II)","","- C22 H18 Cu N2 O3 -","- C22 H18 Cu N2 O3 -","- C88 H72 Cu4 N8 O12 -","4","1","NA6270","Zhang, Xiu-Lian; Ren, Chun-Xia; Chen, Xiao-Ming; Ng, Seik Weng","Aqua{1-[(2-oxidophenyl)iminomethyl]naphthalen-2-olato}pyridinecopper(II)","Acta Crystallographica Section E","2003","59","12","m1176","m1177","10.1107/S160053680302631X","","","0.71073","MoKα","","0.067","0.041","","","0.097","0.117","","","","","","0.9","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202764","6.8892","0.0006","7.7255","0.0006","26.895","0.002","90","","97.024","0.011","90","","1420.7","0.2","223","2","223","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,3,2',3'-tetrakis(2-pyridyl)-6,6'-biquinoxalinyl","","- C36 H22 N8 -","- C36 H22 N8 -","- C72 H44 N16 -","2","0.5","NA6273","Antonia Neels; Helen Stoeckli-Evans","A monoclinic polymorph of 2,3,2',3'-tetrakis(2-pyridyl)-6,6'-biquinoxalinyl","Acta Crystallographica Section E","2003","59","12","o2028","o2029","10.1107/S1600536803026977","","","0.71073","MoKα","","0.1419","0.0418","","","0.076","0.0961","","","","","","0.725","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202765","21.0806","0.0019","20.338","0.002","12.8637","0.0013","90","","90","","90","","5515.1","0.9","223","2","223","2","","","","","","","","3","F d d 2","F 2 -2d","43","","2,3,2',3'-tetrakis(2-pyridyl)-6,6'-biquinoxalinyl","","- C36 H22 N8 -","- C36 H22 N8 -","- C288 H176 N64 -","8","0.5","NA6274","Antonia Neels; Helen Stoeckli-Evans","An orthorhombic polymorph of 2,3,2',3'-tetrakis(2-pyridyl)-6,6'-biquinoxalinyl","Acta Crystallographica Section E","2003","59","12","o2030","o2031","10.1107/S1600536803027004","","","0.71073","MoKα","","0.0861","0.0363","","","0.0735","0.0866","","","","","","0.7","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202766","8.6593","0.0004","6.3233","0.0003","8.909","0.0004","90","","112.676","0.001","90","","450.11","0.04","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C5 H14 As N O4 -","- C5 H14 As N O4 -","- C10 H28 As2 N2 O8 -","2","1","NG6000","Lee, Clare; Harrison, William T. A.","Piperidinium dihydrogenarsenate","Acta Crystallographica Section E","2003","59","11","m959","m960","10.1107/S1600536803021457","","","0.71073","MoKα","","0.0204","0.0176","","","0.0414","0.0419","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202767","9.073","0.001","9.141","0.001","11.513","0.001","110.555","0.002","99.252","0.002","100.637","0.002","851.88","0.15","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-acetylacetonato-bis[diacetylacetonato(tert-butylamine)nickel(II)]","","- C28 H50 N2 Ni2 O8 -","- C28 H50 N2 Ni2 O8 -","- C28 H50 N2 Ni2 O8 -","1","0.5","NG6002","He, Xiao-Hui; Yao, Ying-Zheng; Luo, Xiang; Zhang, Ling; Wu, Qing","Di-μ-acetylacetonato-bis[diacetylacetonato(<i>tert</i>-butylamine)nickel(II)]","Acta Crystallographica Section E","2003","59","12","m1196","m1197","10.1107/S1600536803026606","","","0.71073","MoKα","","0.078","0.062","","","0.176","0.193","","","","","","1.08","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202768","9.506","0.001","9.738","0.002","12.572","0.002","109.65","0.01","94.14","0.01","106.24","0.01","1034.3","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","3-[(2-Chlorophenyl)sulfonylamino]-2-cyano-N-(3,5-dimethoxyphenyl)- 3-methylsulfanyl-2-propenamide","","- C19 H18 Cl N3 O5 S2 -","- C19 H18 Cl N3 O5 S2 -","- C38 H36 Cl2 N6 O10 S4 -","2","1","OB6233","Colin H. L. Kennard; Helen G. McFadden; Karl A. Byriel","3-[(2-Chlorophenyl)sulfonylamino]-2-cyano-<i>N</i>-(3,5-dimethoxyphenyl)-3-methylsulfanyl-2-propenamide","Acta Crystallographica Section E","2003","59","7","o922","o923","10.1107/S1600536803010584","","","0.71073","Mokα","","0.0406","0.0302","","","0.081","0.0872","","","","","","1.017","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202769","11.536","0.003","11.536","0.003","43.015","0.003","90","","90","","90","","5724","2","293","2","293","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","(R,R,R,R)10,21-Di-tert-butyl-4,5,15,16-tetraphenyl-3,6,14,17-tetraaza -tricyclo[17.3.1.18,12]tetracosa-1(23),2,6,8,10,12(24),13,17, 19,21-decaene-23,24-diol ethane-1,2-diol dinuclear Nickel(II) diperchlorate bishydrate complex","","- C54 H60 Cl2 N4 Ni2 O14 -","- C54 H60 Cl2 N4 Ni2 O14 -","- C216 H240 Cl8 N16 Ni8 O56 -","4","0.5","OB6245","Wu, Jin-Cai; Li, Yi-Zhi; Tang, Ling; Tan, Min-Yu","[μ-10,21-Di-<i>tert</i>-butyl-4(<i>S</i>),5(<i>S</i>),15(<i>S</i>),16(<i>S</i>)-tetraphenyl-3,6,14,17-tetraazatricyclo[17.3.1.18,12]tetracosa-1(23),2,6,8,10,12(24),13,17,19,21-decaene-23,24-diolato](μ-ethylene glycol)dinickel(II) diperchlorate dihydrate","Acta Crystallographica Section E","2003","59","7","m494","m496","10.1107/S1600536803012868","","","0.71073","MoKα","","0.0496","0.0471","","","0.1583","0.159","","","","","","1.092","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202770","9.9305","0.0007","13.6738","0.0009","8.7309","0.0004","90","","120.583","0.003","90","","1020.63","0.11","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Ethylenediammonium disulfidodecamolybdate(VI)","","- C2 H10 Mo N2 O10 S2 -","- C2 H10 Mo N2 O10 S2 -","- C8 H40 Mo4 N8 O40 S8 -","4","0.5","OB6247","Sun, Qiaozhen; Zhang, Hanhui; Huang, Changcang; Sun, Ruiqing; Wang, Yongjing","Ethylenediammonium disulfidodecamolybdate(VI)","Acta Crystallographica Section E","2003","59","7","m449","m451","10.1107/S1600536803012418","","","0.71073","MoKα","","0.0231","0.0204","","","0.0565","0.0572","","","","","","1.001","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202771","13.91","0.004","13.425","0.004","19.074","0.006","90","","99.074","0.019","90","","3517.3","1.8","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,6-Bis(triphenylacetylamino)phenol","","- C46 H36 N2 O3 -","- C46 H36 N2 O3 -","- C184 H144 N8 O12 -","4","1","OB6248","Onoda, Akira; Okamura, Taka-aki; Yamamoto, Hitoshi; Ueyama, Norikazu","2,6-Bis(triphenylacetylamino)phenol","Acta Crystallographica Section E","2003","59","8","o1202","o1204","10.1107/S1600536803014673","","","0.71069","MoKα","","0.1276","0.0525","","","0.1094","0.1357","","","","","","0.864","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202772","7.9351","0.0006","10.1874","0.0008","12.6841","0.001","91.834","0.002","94.264","0.002","111.915","0.001","946.65","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Diaqua(2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylato-κN^3^)(1,10- phenanthroline)zinc(II) dihydrate","","- C17 H18 N4 O8 Zn -","- C17 H18 N4 O8 Zn -","- C34 H36 N8 O16 Zn2 -","2","1","OB6249","Li, Xing; Bi, Wenhua; Yuan, Daqiang; Cao, Rong","Diaqua(2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylato-κ<i>N</i>^3^)(1,10-phenanthroline)zinc(II) dihydrate","Acta Crystallographica Section E","2003","59","7","m470","m472","10.1107/S1600536803012819","","","0.71073","MoKα","","","0.0658","","","0.1455","0.1658","","","","","","1.119","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202773","5.8937","0.0006","27.647","0.003","7.9171","0.0008","90","","90","","90","","1290","0.2","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","4-chlorophenyl p-toluenesulfonate","4-chlorophenyl 4-toluenesulfonate","","- C13 H11 Cl O3 S -","- C13 H11 Cl O3 S -","- C52 H44 Cl4 O12 S4 -","4","1","OB6250","Nagarajan Vembu; Maruthai Nallu; Jered Garrison; Wiley J. Youngs","4-Chlorophenyl 4-toluenesulfonate: supramolecular aggregation through C—H···O, C‒H···Cl and C—H···π interactions","Acta Crystallographica Section E","2003","59","7","o936","o938","10.1107/S1600536803012066","","","0.71073","MoKα","","0.0413","0.0394","","","0.0936","0.0944","","","","","","1.117","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202774","7.7314","0.0011","8.3724","0.0011","10.7055","0.0015","99.079","0.002","96.119","0.002","103.134","0.002","659.04","0.16","100","2","100","2","","","","","","","","5","P -1","-P 1","2","2,4-dichlorophenyl p-toluenesulfonate","2,4-dichlorophenyl 4-toluenesulfonate","","- C13 H10 Cl2 O3 S -","- C13 H10 Cl2 O3 S -","- C26 H20 Cl4 O6 S2 -","2","1","OB6251","Nagarajan Vembu; Maruthai Nallu; Jered Garrison; Wiley J. Youngs","2,4-Dichlorophenyl 4-toluenesulfonate: supramolecular aggregation through C—H···O, C—H···Cl, C—H···π and π···π interactions","Acta Crystallographica Section E","2003","59","7","o939","o941","10.1107/S160053680301208X","","","0.71073","MoKα","","0.0296","0.0284","","","0.0761","0.0769","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202775","24.615","0.005","8.3158","0.0017","25.469","0.005","90","","104.48","0.03","90","","5047.7","1.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C43 H47 Cl2 Cu3 N11 O12 -","- C43 H47 Cl2 Cu3 N11 O12 -","- C172 H188 Cl8 Cu12 N44 O48 -","4","0.5","OB6252","Li, Chun Hui; Wang, Ru-Ji; Kou, Hui-Zhong; Li, Yadong","Heptapyridinebis(μ-dimethylglyoximato)tricopper(II) diperchlorate: a novel trinuclear copper complex bridged by glyoximate groups","Acta Crystallographica Section E","2003","59","8","m608","m610","10.1107/S160053680301331X","","","0.71073","MoKα","","0.1256","0.0514","","","0.0746","0.0822","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202776","6.7043","0.0019","10.672","0.003","16.1","0.005","75.85","0.005","88.835","0.006","75.852","0.005","1082.1","0.5","296","1","296","1","","","","","","","","6","P -1","-P 1","2","","cis-Diammine(L-pyrolglutamato)platinum(II)","","- C10 H32 N4 O9 Pt2 S -","- C10 H30 N4 O9 Pt2 S -","- C20 H60 N8 O18 Pt4 S2 -","2","1","OB6253","Sakai, Ken; Ishigami, Eri; Yokokawa, Kazuo; Kajiwara, Takashi; Ito, Tasuku","Di-μ-pivalato-bis[<i>cis</i>-diammineplatinum(II)] sulfate monohydrate","Acta Crystallographica Section E","2003","59","7","m443","m445","10.1107/S1600536803012224","","","0.71073","MoKα","","0.0888","0.0446","","","0.0838","0.0924","","","","","","0.855","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202777","10.069","0.0009","35.111","0.003","11.7298","0.001","90","","101.835","0.002","90","","4058.7","0.6","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","cis-Diammine(L-pyrolglutamato)platinum(II)","","- C32 H30 Cl4 N6 O16 Pt -","- C32 H30 Cl4 N6 O16 Pt -","- C128 H120 Cl16 N24 O64 Pt4 -","4","1","OB6254","Sakai, Ken; Osada, Manabu; Yokoyama, Yoshimi; Tomita, Yasushi; Tsubomura, Taro","(2,2'-Bipyridine)bis(<i>N</i>-methyl-4,4'-bipyridinium)platinum(II) tetraperchlorate","Acta Crystallographica Section E","2003","59","7","m512","m514","10.1107/S1600536803013801","","","0.71073","MoKα","","0.0617","0.0471","","","0.12","0.1263","","","","","","1.014","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202778","6.7374","0.0003","27.8864","0.0013","13.5619","0.0006","90","","102.876","0.001","90","","2483.96","0.19","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(2-aminopyridine)(2,2'-bipyridine)platinum(II) dinitrate dihydrate","","- C20 H24 N8 O8 Pt -","- C20 H20 N8 O8 Pt -","- C80 H80 N32 O32 Pt4 -","4","1","OB6255","Sakai, Ken; Akiyama, Norinobu; Mizota, Mina","Bis(2-aminopyridine)(2,2'-bipyridine)platinum(II) dinitrate dihydrate","Acta Crystallographica Section E","2003","59","7","m459","m461","10.1107/S1600536803012698","","","0.71073","MoKα","","0.0472","0.0375","","","0.0799","0.0831","","","","","","0.954","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202779","10.2302","0.0008","13.4229","0.0011","13.6086","0.0011","62.287","0.001","83.403","0.001","68.99","0.001","1541.3","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","cis-Diammine(L-pyrolglutamato)platinum(II)","","- C26 H24 Cl3 N5 O13 Pt -","- C26 H22 Cl3 N5 O13 Pt -","- C52 H44 Cl6 N10 O26 Pt2 -","2","1","OB6256","Sakai, Ken; Kurashima, Mai; Osada, Manabu; Takahashi, Satoru","(<i>N</i>-Methyl-4,4'-bipyridinium)(2,2':6',2''-terpyridine)platinum(II) triperchlorate monohydrate","Acta Crystallographica Section E","2003","59","7","m515","m517","10.1107/S1600536803013837","","","0.71073","MoKα","","0.0367","0.0333","","","0.088","0.0892","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202780","20.225","0.0003","10.6741","0.0003","14.2089","0.0003","90","","134.294","0.001","90","","2195.59","0.09","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[((2-(2-hydroxyphenyl)ethylidene)amino)acetato]aquacopper(II) hydrate","","- C10 H13 Cu N O5 -","- C10 H13 Cu N O5 -","- C80 H104 Cu8 N8 O40 -","8","1","OB6257","Usman, Anwar; Fun, Hoong-Kun; Basu Baul, Tushar S.; Paul, Pradip C.","Aqua[{[2-(2-hydroxyphenyl)ethylidene]amino}acetato]copper(II) monohydrate","Acta Crystallographica Section E","2003","59","7","m438","m440","10.1107/S1600536803012236","","","0.71073","MoKα","","0.0902","0.0517","","","0.1102","0.1232","","","","","","0.953","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202781","23.648","0.004","13.3574","0.0016","15.5128","0.0019","90","","96.998","0.003","90","","4863.6","1.2","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","cis-Diammine(L-pyrolglutamato)platinum(II)","","- C24 H48 N16 O28 Pt4 -","- C24 H36 N16 O28 Pt4 -","- C96 H144 N64 O112 Pt16 -","4","0.5","OB6258","Sakai, Ken; Takahashi, Satoru","A head-to-head isomer of bis{bis(μ-5-carboxy-α-pyridonato)bis[<i>cis</i>-diammineplatinum(II)]} tetranitrate tetrahydrate","Acta Crystallographica Section E","2003","59","7","m532","m535","10.1107/S1600536803013497","","","0.71073","MoKα","","0.1076","0.0632","","","0.16","0.1968","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202782","9.8953","0.0014","11.6682","0.0017","23.626","0.003","90","","99.719","0.003","90","","2688.7","0.6","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","symm-tris(tosyloxy) benzene","1,3,5-tris(tosyloxy) benzene","","- C27 H24 O9 S3 -","- C27 H24 O9 S3 -","- C108 H96 O36 S12 -","4","1","OB6259","Nagarajan Vembu; Maruthai Nallu; Jered Garrison; Wiley J. Youngs","Benzene 1,3,5-tris(<i>p</i>-toluenesulfonate): supramolecular aggregation through extensive C—H···O, C—H···π and π‒π interactions","Acta Crystallographica Section E","2003","59","7","o1019","o1021","10.1107/S1600536803013291","","","0.71073","MoKα","","0.0621","0.0537","","","0.1123","0.1159","","","","","","1.184","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202783","7.3136","0.0006","10.1125","0.0009","18.7166","0.0016","90","","93.784","0.001","90","","1381.2","0.2","293","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","cis-Diammine(L-pyrolglutamato)platinum(II)","","- C10 H13 Cl2 N3 O2 Pt -","- C10 H13 Cl2 N3 O2 Pt -","- C40 H52 Cl8 N12 O8 Pt4 -","4","1","OB6260","Sakai, Ken; Yokoyama, Yoshimi; Okamoto, Ken; Takahashi, Satoru","(4-Amino-2,2'-bipyridine)dichloroplatinum(II) dihydrate","Acta Crystallographica Section E","2003","59","7","m518","m520","10.1107/S1600536803013552","","","0.71073","MoKα","","0.0733","0.0458","","","0.0782","0.0847","","","","","","0.894","","","","has coordinates,has Fobs","199607","2020-10-21","18:00:00",""
"2202784","9.0092","0.0005","10.1125","0.0006","12.0131","0.0007","80.164","0.001","78.041","0.001","84.54","0.001","1052.94","0.11","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","di-μ-α-pyrrolidinonato-bis[cis-diamminebromoplatinum(III)] dinitrate","","- C8 H24 Br2 N8 O8 Pt2 -","- C8 H24 Br2 N8 O8 Pt2 -","- C16 H48 Br4 N16 O16 Pt4 -","2","1","OB6261","Sakai, Ken; Sakamoto, Tomohiko; Kajiwara, Takashi; Ito, Tasuku","A head-to-head isomer of di-μ-α-pyrrolidinonato-bis[<i>cis</i>-diamminebromoplatinum(III)] dinitrate","Acta Crystallographica Section E","2003","59","7","m553","m555","10.1107/S1600536803014405","","","0.71069","MoKα","","0.0631","0.0365","","","0.0841","0.0924","","","","","","0.948","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202785","8.253","0.002","5.435","0.001","19.056","0.004","90","","102.51","0.01","90","","834.5","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(E)-1,2-bis(1,2-dimethyl-3-indolizinyl)ethene","","- C22 H22 N2 -","- C22 H22 N2 -","- C44 H44 N4 -","2","0.5","OB6262","Liu, Wei-Wei; Li, Yi-Zhi; Song, Ou; Hu, Hong-Wen","(<i>E</i>)-1,2-Bis(1,2-dimethyl-3-indolizinyl)ethene","Acta Crystallographica Section E","2003","59","7","o1039","o1040","10.1107/S1600536803013795","","","0.71073","MoKα","","0.0616","0.0497","","","0.1034","0.106","","","","","","1.015","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202786","7.9315","0.0006","29.13","0.002","6.1111","0.0005","90","","92.383","0.003","90","","1410.72","0.18","120","2","120","2","","","","","","","","4","P 1 c 1","P -2yc","7","2-naphthyl p-toluenesulfonate","2-naphthyl 4-toluenesulfonate","","- C17 H14 O3 S -","- C17 H14 O3 S -","- C68 H56 O12 S4 -","4","2","OB6263","Nagarajan Vembu; Maruthai Nallu; Elinor C. Spencer; Judith A. K. Howard","2-Naphthyl 4-toluenesulfonate: supramolecular aggregation through C—H···O and C—H···π interactions","Acta Crystallographica Section E","2003","59","7","o1033","o1035","10.1107/S1600536803013849","","","0.71073","MoKα","","0.0519","0.0471","","","0.1103","0.1122","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202787","11.424","0.002","10.223","0.0012","13.669","0.002","90","","102.406","0.001","90","","1559.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-[2-Isopropyl-5-methylphenoxy]phthalonitrile","","- C18 H16 N2 O -","- C18 H16 N2 O -","- C72 H64 N8 O4 -","4","1","OB6264","Atalay, Şehriman; Aǧar, Ayşen; Akdemir, Nesuhi; Aǧar, Erbil","4-(2-Isopropyl-5-methylphenoxy)phthalonitrile","Acta Crystallographica Section E","2003","59","8","o1111","o1112","10.1107/S1600536803014685","","","0.71073","MoKα","","0.1027","0.0621","","","0.1962","0.2187","","","","","","0.883","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202788","17.959","0.0007","17.0728","0.0007","10.1189","0.0004","90","","90","","90","","3102.6","0.2","296","2","296","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","bis(μ-N-methylisonicotinamidato)bis[cis-diammineplatinum(II)] tetraperchlorate","","- C14 H28 Cl4 N8 O18 Pt2 -","- C14 H28 Cl4 N8 O18 Pt2 -","- C56 H112 Cl16 N32 O72 Pt8 -","4","0.5","OB6266","Sakai, Ken; Shiomi, Meiko; Tsubomura, Taro; Kato, Kaoru; Yokoyama, Yoshimi; Kajiwara, Takashi; Ito, Tasuku","A head-to-head isomer of bis(μ-<i>N</i>-methylisonicotinamidato)bis[<i>cis</i>-diammineplatinum(II)] tetraperchlorate","Acta Crystallographica Section E","2003","59","8","m559","m561","10.1107/S1600536803014521","","","0.71073","MoKα","","0.068","0.0349","","","0.0567","0.0619","","","","","","0.881","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202789","12.0675","0.0012","15.2713","0.0016","14.443","0.0015","90","","105.325","0.011","90","","2567","0.5","296","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H16 Br2 Cu N2 O8 -","- C26 H16 Br2 Cu N2 O8 -","- C104 H64 Br8 Cu4 N8 O32 -","4","0.5","OB6268","Ma, Ai-Qing; Xu, Duan-Jun; Zhu, Long-Guan","(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(2-bromo-4-carboxylbenzoato-κ<i>O</i>)copper(II)","Acta Crystallographica Section E","2003","59","8","m579","m581","10.1107/S1600536803014806","","","0.71069","MoKα","","0.0876","0.0568","","","0.1238","0.1345","","","","","","1.119","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202790","15.246","0.002","11.007","0.002","16.244","0.002","90","","102.31","0.01","90","","2663.3","0.7","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","9-(4-Chlorophenyl)-3,3,6,6-tetramethyl-10-(4-methylphenyl)- 1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione","","- C30 H32 Cl N O2 -","- C30 H32 Cl N O2 -","- C120 H128 Cl4 N4 O8 -","4","1","OB6269","Xiangshan Wang; Daqing Shi; Shujiang Tu","9-(4-Chlorophenyl)-3,3,6,6-tetramethyl-10-(4-methylphenyl)-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione","Acta Crystallographica Section E","2003","59","8","o1139","o1140","10.1107/S1600536803015125","","","0.71073","MoKα","","0.0776","0.04","","","0.0934","0.1033","","","","","","0.906","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202791","14.095","0.001","14.697","0.001","17.1308","0.0007","103.758","0.005","99.715","0.006","105.898","0.007","3209.5","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","Tris(2-ethylammonio)amine‒4-nitrobenzoate‒water (2/6/4)","","- C27 H37 N7 O14 -","- C27 H37 N7 O14 -","- C108 H148 N28 O56 -","4","2","OB6271","Daniel E. Lynch","Tris(2-ethylammonio)amine‒4-nitrobenzoate‒water (1/3/2)","Acta Crystallographica Section E","2003","59","8","o1157","o1158","10.1107/S1600536803015538","","","0.71073","MoKα","","0.1212","0.0586","","","0.1775","0.2056","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","199684","2020-10-21","18:00:00",""
"2202792","5.9788","0.0004","7.579","0.001","22.044","0.001","90","","94.57","0.008","90","","995.71","0.15","294","2","294","2","","","","","","","","2","P 1 21 1","P 2yb","4","","1-(p-biphenyl)-4'-(2-napthyl)cubane","","- C30 H22 -","- C30 H22 -","- C60 H44 -","2","1","OB6273","Evans, Robin N.; Gilardi, Richard; Emrick, Todd","1-(<i>p</i>-Biphenyl)-4'-(2-naphthyl)cubane","Acta Crystallographica Section E","2003","59","9","o1283","o1285","10.1107/S1600536803017483","","","1.54178","CuKα","","0.105","0.0618","","","0.141","0.1676","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202793","7.9962","0.0009","8.286","0.0009","11.8913","0.0013","70.702","0.002","71.205","0.002","72.983","0.002","688.5","0.13","153","2","93","2","","","","","","","","4","P -1","-P 1","2","","2-methyl-4,5-dinitroimidazole","","- C4 H4 N4 O4 -","- C4 H4 N4 O4 -","- C16 H16 N16 O16 -","4","2","OB6274","Gilardi, Richard; Evans, Robin N.","2-Methyl-4,5-dinitroimidazole","Acta Crystallographica Section E","2003","59","9","o1349","o1350","10.1107/S160053680301701X","","","0.71073","MoKα","","0.0829","0.0397","","","0.072","0.0803","","","","","","0.864","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2202794","13.8591","0.0002","10.8218","0.0001","13.8946","0.0002","90","","114.751","0.001","90","","1892.48","0.05","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1,3-Bis(4-fluorobenzenesulfonyl)-5-methylene-1,2,3,4,5,6-hexahydropyrimidine","","- C17 H16 F2 N2 O4 S2 -","- C17 H16 F2 N2 O4 S2 -","- C68 H64 F8 N8 O16 S8 -","4","1","OB6275","Gilardi, Richard; Dave, Paritosh R; Evans, Robin N.","1,3-Bis(4-fluorobenzenesulfonyl)-5-methylene-1,2,3,4,5,6-hexahydropyrimidine","Acta Crystallographica Section E","2003","59","9","o1286","o1287","10.1107/S1600536803017021","","","1.54178","CuKα","","0.0482","0.0446","","","0.1201","0.1241","","","","","","1.068","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202795","17.458","0.004","12.287","0.003","5.4891","0.0014","90","","90","","90","","1177.4","0.5","120","2","120","2","","","","","","","","5","P n a 21","P 2c -2n","33","Phenyl m-nitrobenzenesulfonate","Phenyl 3-nitrobenzenesulfonate","","- C12 H9 N O5 S -","- C12 H9 N O5 S -","- C48 H36 N4 O20 S4 -","4","1","OB6276","Nagarajan Vembu; Maruthai Nallu; Elinor C. Spencer; Judith A. K. Howard","Phenyl 3-nitrobenzenesulfonate","Acta Crystallographica Section E","2003","59","8","o1213","o1215","10.1107/S1600536803015964","","","0.71073","MoKα","","0.0647","0.0432","","","0.0563","0.0598","","","","","","0.913","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202796","11.125","0.002","9.643","0.002","13.236","0.003","90","","90.257","0.005","90","","1419.9","0.5","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","methyl 4-(3-nitrobenzenesulfonyloxy)benzoate","methyl 4-(3-nitrobenzenesulfonyloxy)benzoate","","- C14 H11 N O7 S -","- C14 H11 N O7 S -","- C56 H44 N4 O28 S4 -","4","1","OB6277","Nagarajan Vembu; Maruthai Nallu; Elinor C. Spencer; Judith A. K. Howard","Methyl 4-(3-nitrobenzenesulfonyloxy)benzoate","Acta Crystallographica Section E","2003","59","8","o1216","o1219","10.1107/S1600536803015976","","","0.71073","MoKα","","0.0541","0.036","","","0.0775","0.0823","","","","","","0.952","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202797","6.4168","0.0016","11.505","0.003","24.943","0.006","90","","90","","90","","1841.4","0.8","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-Dimethylaminopyridinium 4-nitrophenolate/4-nitrophenol","","- C19 H20 N4 O6 -","- C19 H20 N4 O6 -","- C76 H80 N16 O24 -","4","1","OB6278","Nagarajan Vembu; Maruthai Nallu; Elinor C. Spencer; Judith A. K. Howard","4-Dimethylaminopyridinium‒4-nitrophenolate‒4-nitrophenol (1/1/1)","Acta Crystallographica Section E","2003","59","8","o1192","o1195","10.1107/S1600536803016179","","","0.71073","MoKα","","0.0581","0.0412","","","0.0616","0.0647","","","","","","1.088","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202798","15.5805","0.0015","16.8464","0.0016","10.203","0.0012","90","","90.742","0.002","90","","2677.8","0.5","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H13 Cr N2 Na O9.5 -","- C8 H13 Cr N2 Na O9.5 -","- C64 H104 Cr8 N16 Na8 O76 -","8","2","OB6279","Hong Li; Duan-Jun Xu; Kai-Liang Yin","Sodium <i>cis</i>-bis(iminodiacetato-κ^3^<i>N,O,O</i>')chromate(III) sesquihydrate","Acta Crystallographica Section E","2003","59","8","m671","m673","10.1107/S1600536803016246","","","0.71073","MoKα","","0.044","0.029","","","0.071","0.075","","","","","","0.977","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202799","16.5136","0.0009","16.5136","0.0009","14.9106","0.0008","90","","90","","90","","4066.1","0.4","123","2","123","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","1,1-Dimethylethyl N-propanoylcarbamate","","- C8 H15 N O3 -","- C8 H15 N O3 -","- C128 H240 N16 O48 -","16","1","OB6280","Brodesser, Susanne; Mikeska, Thomas; Nieger, Martin; Kolter, Thomas","1,1-Dimethylethyl <i>N</i>-propanoylcarbamate","Acta Crystallographica Section E","2003","59","9","o1359","o1361","10.1107/S1600536803016520","","","0.71073","MoKα","","0.1188","0.044","","","0.0945","0.1111","","","","","","0.886","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202800","6.478","0.001","25.557","0.005","10.549","0.002","90","","96.75","0.02","90","","1734.4","0.5","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-amino-3-cyano-4-(4-methoxylphenyl)-1,4,5,6-tetrahydro- benzo[h]chromene","","- C21 H18 N2 O2 -","- C21 H18 N2 O2 -","- C84 H72 N8 O8 -","4","1","OB6281","Xiangshan Wang; Yuling Li; Daqing Shi; Shujiang Tu","2-Amino-3-cyano-4-(4-methoxyphenyl)-1,4,5,6-tetrahydrobenzo[<i>h</i>]chromene","Acta Crystallographica Section E","2003","59","8","o1210","o1212","10.1107/S1600536803016404","","","0.71073","MoKα","","0.0666","0.0367","","","0.0854","0.0933","","","","","","0.891","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202801","13.893","0.002","14.248","0.002","8.662","0.001","90","","94.63","0.01","90","","1709","0.4","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(4-Methoxyphenyl)-4-methylbenzo[de]cyclobut[i]isoquinoline-3,5(2H)-dione","","- C22 H17 N O3 -","- C22 H17 N O3 -","- C88 H68 N4 O12 -","4","1","OB6282","Qingjian Liu; Rongjun Qu; Jianhua Xu","2-(4-Methoxyphenyl)-4-methylbenzo[<i>de</i>]cyclobut[<i>i</i>]isoquinoline-3,5(2<i>H</i>)-dione","Acta Crystallographica Section E","2003","59","9","o1246","o1248","10.1107/S1600536803016611","","","0.71073","MoKα","","0.0685","0.0384","","","0.092","0.1005","","","","","","0.935","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202802","13.209","0.006","11.107","0.005","17.248","0.008","90","","109.673","0.007","90","","2382.8","1.9","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","4'-(2,4-Dichlorophenyl)-1'-methyl-2,3,2'',3''-tetrahydro-1H-indole- 3-spiro-2'-pyrrolidine-3'-spiro-2''-(1,3-benzimidazo[2,1-b]thiazole)- 2,3''-dione","","- C26 H18 Cl2 N4 O2 S -","- C26 H18 Cl2 N4 O2 S -","- C104 H72 Cl8 N16 O8 S4 -","4","1","OB6283","Li, Xiao-Fang; Feng, Ya-Qing; Shi, Da-Xin; Chen, Hong-Liang","4'-(2,4-Dichlorophenyl)-1'-methyl-2,3,2'',3''-tetrahydro-1<i>H</i>-indole-3-spiro-2'-pyrrolidine-3'-spiro-2''-(1,3-benzimidazo[2,1-<i>b</i>]thiazole)-2,3''-dione","Acta Crystallographica Section E","2003","59","9","o1405","o1406","10.1107/S1600536803018610","","","0.71073","MoKα","","0.0854","0.0499","","","","0.107","","","","","","1.094","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202803","14.6504","0.0003","7.038","0.0002","22.6423","0.0005","90","","91.866","0.001","90","","2333.4","0.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C7.5 H10.75 N1.25 O9 Zn -","- C7.5 H4 N1.25 O9 Zn -","- C60 H32 N10 O72 Zn8 -","8","1","OB6284","Guo-Wei Zhou; Guo-Cong Guo; Bing Liu; Ming-Sheng Wang; Li-Zhen Cai; Guang-Hua Guo; Jin-Shun Huang","Triaqua(4-hydroxypyridine-2,6-dicarboxylato-κ^3^<i>N,O,O</i>')zinc(II)‒acetonitrile‒water(1/0.25/1)","Acta Crystallographica Section E","2003","59","10","m926","m928","10.1107/S1600536803019846","","","0.71073","MoKα","","0.0601","0.0515","","","0.142","0.154","","","","","","1.001","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2202804","13.491","0.004","13.375","0.004","9.903","0.003","90","","93.51","0.02","90","","1783.6","0.9","292","2","292","2","","","","","","","","5","C 1 c 1","C -2yc","9","","2-amino-4-(2-chlorophenyl)-3-ethoxycarbonyl-4H-benzo[f]chromene","","- C22 H18 Cl N O3 -","- C22 H18 Cl N O3 -","- C88 H72 Cl4 N4 O12 -","4","1","OB6285","Qiya Zhuang; Daqing Shi; Xiangshan Wang","2-Amino-4-(2-chlorophenyl)-3-ethoxycarbonyl-4<i>H</i>-benzo[<i>f</i>]chromene","Acta Crystallographica Section E","2003","59","10","o1474","o1475","10.1107/S1600536803019779","","","0.71073","MoKα","","0.0354","0.0327","","","0.0848","0.0858","","","","","","1.108","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202805","8.266","0.001","9.773","0.001","12.375","0.002","81.4","0.01","73.41","0.01","82.15","0.01","942.6","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 2-amino-7,7-dimethyl-4-(4-fluorophenyl)-5-oxo- 4H-5,6,7,8-tetrahydrobenzo[b]pyran-3-carboxylate","","- C20 H22 F N O4 -","- C20 H22 F N O4 -","- C40 H44 F2 N2 O8 -","2","1","OB6286","Daqing Shi; Shu Zhang; Xiangshan Wang; Qiya Zhuang","Ethyl 2-amino-4-(4-fluorophenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4<i>H</i>-benzo[<i>b</i>]pyran-3-carboxylate","Acta Crystallographica Section E","2003","59","10","o1501","o1502","10.1107/S1600536803019834","","","0.71073","MoKα","","0.0613","0.0403","","","0.1057","0.114","","","","","","1.001","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202806","10.9819","0.0001","13.5905","0.0002","14.0636","0.0003","77.32","0.003","79.481","0.003","69.137","0.001","1900.94","0.06","296.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C27 H23 Cl F12 Ir N5 P2 -","- C27 H23 Cl F12 Ir N5 P2 -","- C54 H46 Cl2 F24 Ir2 N10 P4 -","2","1","OB6287","Naokazu Yoshikawa; Jun Sakamoto; Nobuko Kanehisa; Yasushi Kai; Takeko Matsumura-Inoue; Hiroshi Takashima; Keiichi Tsukahara","(4,4'-Dimethyl-2,2'-bipyridine)chloro-(2,2':6',2''-terpyridine)-iridium(III) hexafluorophosphate","Acta Crystallographica Section E","2003","59","10","m830","m832","10.1107/S1600536803019081","","","0.7107","MoKα","","","0.0709","","","","0.1564","","","","","","1.501","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202807","10.884","0.001","12.132","0.002","7.948","0.001","102.78","0.01","106.02","0.01","79.52","0.01","975.5","0.2","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H20 N O5 S5 -","- C15 H20 N O5 S5 -","- C30 H40 N2 O10 S10 -","2","1","OB6288","Akutsu, Hiroki; Yamada, Jun-ichi; Nakatsuji, Shin'ichi","Tetrathiafulvalenium 4-oxo-2,2,6,6-tetramethylpiperidin-1-sulfate","Acta Crystallographica Section E","2003","59","10","o1441","o1443","10.1107/S1600536803019032","","","0.7107","MoKα","","0.0671","0.067","","0.042","","0.042","","","1.712","","","1.71","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2202808","13.631","0.003","14.297","0.004","18.557","0.005","99.71","0.01","99.01","0.01","108.39","0.01","3296.4","1.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H11 F N5 Pt S4 -","- C20 H11 F N5 Pt S4 -","- C120 H66 F6 N30 Pt6 S24 -","6","3","OB6290","XiaoMing Ren; Jingli Xie; Qingjin Meng","1-(4-Fluorobenzyl)pyridinium bis(maleonitriledithiolato)platinate(III)","Acta Crystallographica Section E","2003","59","10","m855","m858","10.1107/S1600536803019160","","","0.71073","MoKα","","0.0736","0.0518","","","0.1182","0.1354","","","","","","1.085","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202809","8.656","0.003","13.768","0.007","11.67","0.005","90","","110.61","0.02","90","","1301.8","1","93.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H18 Cl6 N6 -","- C24 H18 Cl6 N6 -","- C48 H36 Cl12 N12 -","2","0.5","OB6291","Mizuguchi, Jin","2,5-Dihydro-2,5-dimethyl-3,6-diphenylpyrrolo[3,4-<i>c</i>]pyrrole-1,4-(diylidene)bis(cyanamide) chloroform disolvate","Acta Crystallographica Section E","2003","59","10","o1453","o1454","10.1107/S1600536803019172","","","1.5418","CuKα","","","0.0435","","","","0.1183","","","","","","1.289","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202810","9.597","0.002","9.828","0.002","17.783","0.003","74.16","0.01","78.85","0.01","65.11","0.01","1457.8","0.5","93.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C15 H22 O3 -","- C15 H22 O3 -","- C60 H88 O12 -","4","2","OB6292","Mizuguchi, Jin","3,5-Di-<i>tert</i>-butyl-2-hydroxybenzoic acid","Acta Crystallographica Section E","2003","59","10","o1530","o1531","10.1107/S1600536803020713","","","1.5418","CuKα","","","0.0432","","","","0.1038","","","","","","0.952","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202811","13.1442","0.0007","10.2568","0.0006","12.868","0.0007","90","","101.502","0.001","90","","1699.99","0.16","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","eta5-cyclopentadienyldicarbonyliodoiron","eta5-cyclopentadienyldicarbonyliodoiron","","- C7 H5 Fe I O2 -","- C7 H5 Fe I O2 -","- C56 H40 Fe8 I8 O16 -","8","2","OB6294","Zeller, Matthias; Lazich, Evelyn; Hunter, Allen D.","Dicarbonyl(η^5^-cyclopentadienyl)iodoiron(II)","Acta Crystallographica Section E","2003","59","10","m914","m915","10.1107/S1600536803019950","","","0.71073","MoKα","","0.0268","0.0256","","","0.0584","0.0589","","","","","","1.322","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202812","6.582","0.005","11.377","0.005","8.236","0.004","85.46","0.05","76.18","0.04","89.29","0.05","597","0.6","296.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C30 H32 N2 O2 -","- C30 H32 N2 O2 -","- C30 H32 N2 O2 -","1","0.5","OB6295","Mizuguchi, Jin; Shiozaki, Hisayoshi","4,8-Bis[(4-butylphenyl)amino]-1,5-naphthalenedione","Acta Crystallographica Section E","2003","59","10","o1490","o1492","10.1107/S1600536803019780","","","1.5418","CuKα","","","0.0965","","","","0.2091","","","","","","1.553","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2202813","5.2257","0.0007","6.893","0.0009","12.162","0.001","97.72","0.01","91.93","0.01","93.66","0.01","432.83","0.09","93.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H24 N2 O4 -","- C18 H24 N2 O4 -","- C18 H24 N2 O4 -","1","0.5","OB6296","Mizuguchi, Jin; Shiozaki, Hisayoshi","2,6-Bis(butylamino)-4,8-dihydroxy-1,5-naphthalenedione","Acta Crystallographica Section E","2003","59","10","o1493","o1495","10.1107/S1600536803019792","","","1.5418","CuKα","","","0.0469","","","","0.1174","","","","","","1.063","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2202814","12.6648","0.0008","9.1249","0.0005","8.2136","0.0005","90","","90","","90","","949.2","0.1","298","2","298","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","(h6-p-fluoroaniline)chromium(tricarbonyl)","","- C9 H6 Cr F N O3 -","- C9 H6 Cr F N O3 -","- C36 H24 Cr4 F4 N4 O12 -","4","0.5","OB6297","Zeller, Matthias; Hunter, Allen D.; Regula, Jody L.; Szalay, Paul S.","Tricarbonyl(η^6^-4-fluoroaniline)chromium","Acta Crystallographica Section E","2003","59","11","m975","m976","10.1107/S1600536803021469","","","0.71073","MoKα","","0.0273","0.0262","","","0.0755","0.0765","","","","","","1.077","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202815","8.412","0.002","10.931","0.002","11.989","0.002","83.73","0.01","81.3","0.01","80.32","0.01","1070.2","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Methyl {2-[4-ethyl-1-(tolylsulfonyl)-2,3-dihydropyrrol-3-yl]ethyl}benzoate","","- C23 H27 N O4 S -","- C23 H27 N O4 S -","- C46 H54 N2 O8 S2 -","2","1","OB6298","Hu, Yi-Min; Li, Yi-Zhi; Zhou, Jie; Hu, Hong-Wen; Pan, Yi","Methyl {2-[4-ethyl-1-(tolylsulfonyl)-2,3-dihydropyrrol-3-yl]ethyl}benzoate","Acta Crystallographica Section E","2003","59","10","o1578","o1580","10.1107/S1600536803021056","","","0.71073","MoKα","","0.0527","0.0402","","","0.1099","0.1152","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202816","12.405","0.001","6.591","0.0007","14.927","0.001","90","","101.445","0.008","90","","1196.18","0.18","93.2","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C36 H22 N4 -","- C36 H22 N4 -","- C72 H44 N8 -","2","0.5","OB6299","Aramaki, Shinji; Mizuguchi, Jin","29<i>H</i>,31<i>H</i>-Tetrabenzo[<i>b</i>,<i>g</i>,<i>l</i>,<i>q</i>]porphin","Acta Crystallographica Section E","2003","59","10","o1556","o1558","10.1107/S1600536803020750","","","1.5418","CuKα","","","0.0329","","","","0.0663","","","","","","0.334","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202817","8.2127","0.0004","17.9985","0.001","10.8564","0.0005","90","","94.603","0.003","90","","1599.58","0.14","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Amino-5-methylpyridinium 3-(4-hydroxy-3-methoxyphenyl)-2-propenoate monohydrate","","- C16 H20 N2 O5 -","- C16 H20 N2 O5 -","- C64 H80 N8 O20 -","4","1","OB6300","Xuan, Richeng; Wan, Yuehua; Hu, Weixiao; Yang, Zhongyu; Cheng, Dongping; Xuan, Rirong","2-Amino-5-methylpyridinium 3-(4-hydroxy-3-methoxyphenyl)-2-propenoate monohydrate","Acta Crystallographica Section E","2003","59","11","o1704","o1706","10.1107/S1600536803022165","","","0.71073","MoKα","","","0.049","","","","0.137","","","","","","0.928","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202818","8.0835","0.0004","8.1546","0.0003","13.7591","0.0007","90","","90","","90","","906.97","0.07","293","2","","","","","","","","","","5","P 21 a b","P -2b 2a","29","","","","- C4 H12 N2 O5 S -","- C4 H12 N2 O5 S -","- C16 H48 N8 O20 S4 -","4","1","OB6301","Richeng Xuan; Weixiao Hu; Zhongyu Yang; Rirong Xuan","<small>DL</small>-2-Amino-2-thiazoline-4-carboxylic acid trihydrate","Acta Crystallographica Section E","2003","59","11","o1707","o1709","10.1107/S1600536803022360","","","0.71073","MoKα","","","0.0234","","","","0.0815","","","","","","1.072","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202819","6.491","0.0005","14.2605","0.0013","8.5148","0.0009","90","","98.457","0.003","90","","779.6","0.12","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H7 Cl O3 -","- C8 H7 Cl O3 -","- C32 H28 Cl4 O12 -","4","1","OB6302","Richeng Xuan; Ying Zhou; Yuehua Wan; Rirong Xuan","2-Chloro-3-hydroxy-4-methoxybenzaldehyde","Acta Crystallographica Section E","2003","59","11","o1710","o1711","10.1107/S1600536803022372","","","0.71073","MoKα","","","0.0363","","","","0.098","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202820","12.028","0.006","7.358","0.004","13.561","0.007","90","","96.364","0.007","90","","1192.8","1.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)benzoate","","- C13 H11 N O4 -","- C13 H11 N O4 -","- C52 H44 N4 O16 -","4","1","OB6303","Vasu; K. A. Nirmala; Deepak Chopra; M. Vishwas","Ethyl 4-(2,5-dioxo-2,5-dihydro-1<i>H</i>-pyrrol-1-yl)benzoate","Acta Crystallographica Section E","2003","59","10","o1549","o1550","10.1107/S1600536803020701","","","0.71073","MoKα","","0.0516","0.0441","","","0.1284","0.138","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202821","11.516","0.002","9.71","0.001","14.914","0.002","90","","103.97","0.01","90","","1618.4","0.4","291","2","291","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Amino-1-(4-fluorophenyl)-3a,3b,6,7-tetrahydrobenzo[4,5]indene-2-carbonitrile","","- C20 H17 F N2 -","- C20 H17 F N2 -","- C80 H68 F4 N8 -","4","1","OB6305","Shi, Daqing; Rong, Liangce; Wang, Juxian; Wang, Xiangshan; Hu, Hongwen","3-Amino-1-(4-fluorophenyl)-3a,3b,6,7-tetrahydrobenz[4,5]indene-2-carbonitrile","Acta Crystallographica Section E","2003","59","10","o1562","o1563","10.1107/S1600536803020798","","","0.71073","MoKα","","0.0869","0.0379","","","0.079","0.0906","","","","","","0.828","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202822","33.891","0.004","11.191","0.001","9.491","0.001","90","","93.75","0.01","90","","3592","0.7","93.2","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C34 H54 O8 Zn -","- C34 H52 O8 Zn -","- C136 H208 O32 Zn4 -","4","0.5","OB6306","Mizuguchi, Jin","<i>cis</i>-Bis(3,5-di-<i>tert</i>-butyl-2-hydroxybenzoato-κ^2^<i>O</i>,<i>O</i>')bis(ethanol)zinc(II)","Acta Crystallographica Section E","2003","59","10","m955","m956","10.1107/S1600536803020877","","","1.5418","CuKα","","","0.042","","","","0.126","","","","","","1.647","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202823","7.789","0.001","17.777","0.002","26.04","0.003","90","","94.7","0.01","90","","3593.5","0.7","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-chloro-6-methyl-8,9-diphenylimidazo[1,2-c]quinazoline","","- C23 H16 Cl N3 -","- C23 H16 Cl N3 -","- C184 H128 Cl8 N24 -","8","2","OB6307","Daqing Shi; Juxian Wang; Chunling Shi; Liangce Rong; Xiangshan Wang; Hongwen Hu","2-Chloro-6-methyl-8,9-diphenylimidazo[1,2-<i>c</i>]quinazoline","Acta Crystallographica Section E","2003","59","11","o1594","o1595","10.1107/S1600536803021482","","","0.71073","MoKα","","0.0983","0.0391","","","0.0747","0.0868","","","","","","0.795","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202824","24.101","0.003","13.76","0.001","8.989","0.001","90","","100.87","0.01","90","","2927.5","0.5","295","2","295","2","","","","","","","","5","C 1 2 1","C 2y","5","{N,N'-Bis[3-methoxymethyl-5-methylsalicylidene]-(R,R)-1,2- diphenylenediamino}nickel(II)","6,6'-bis(methoxymethyl)-4,4'-dimethyl-2,2'-[1,2-diphenyl-1,2- ethanediylbis(nitrilomethylidyne)]diphenol","","- C34 H34 N2 Ni O4 -","- C34 H34 N2 Ni O4 -","- C136 H136 N8 Ni4 O16 -","4","1","OB6309","Jin-Cai Wu; Ning Tang; Kai-Bei Yu","{<i>N,N</i>'-Bis[3-methoxymethyl-5-methylsalicylidene]-(<i>R,R</i>)-1,2-diphenylenediamino}nickel(II)","Acta Crystallographica Section E","2003","59","11","m977","m979","10.1107/S1600536803021949","","","0.71073","MoKα","","0.0677","0.0432","","","0.0928","0.0999","","","","","","0.964","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202825","5.7929","0.0018","13.509","0.004","9.98","0.003","90","","105.049","0.005","90","","754.2","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-poly[bis[chloro(μ~-pyridine N-oxide-κ^2^O:O)copper(II)]-di-μ-chloro]","","- C10 H10 Cl4 Cu2 N2 O2 -","- C10 H10 Cl4 Cu2 N2 O2 -","- C20 H20 Cl8 Cu4 N4 O4 -","2","0.5","OB6310","Ana María Atria; Piedad Cortés; .; María Teresa Garland; .; Ricardo Baggio; .","Redetermination of <i>catena</i>-poly[bis[chloro(μ-pyridine <i>N</i>-oxide-κ^2^<i>O</i>:<i>O</i>)copper(II)]-di-μ-chloro]","Acta Crystallographica Section E","2003","59","11","m967","m969","10.1107/S1600536803021470","","","0.71073","MoKα","","0.041","0.0351","","","0.0844","0.0869","","","","","","1.079","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202826","5.403","0.001","30.252","0.005","8.293","0.002","90","","99.24","0.01","90","","1337.9","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-[N,N-bis(2-cyanoethyl)amino]pyridine perchlorate","","- C11 H13 Cl N4 O4 -","- C11 H13 Cl N4 O4 -","- C44 H52 Cl4 N16 O16 -","4","1","OB6311","Geng, Jin-Long; Ni, Jun; Liu, Rui; Chen, Hui-Lan; Wang, Zhi-Lin","4-[<i>N,N</i>-Bis(2-cyanoethyl)amino]pyridinium perchlorate","Acta Crystallographica Section E","2003","59","11","o1697","o1699","10.1107/S1600536803021676","","","0.71073","MoKα","","0.0613","0.0493","","","0.1129","0.1179","","","","","","1.001","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202827","11.917","0.002","6.911","0.001","17.821","0.004","90","","98.81","0.01","90","","1450.4","0.5","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,2-dimethyl-3-(4-methylphenyl)1,2-dihydroquinazolin-4(3H)-one","","- C17 H18 N2 O -","- C17 H18 N2 O -","- C68 H72 N8 O4 -","4","1","OB6312","Daqing Shi; Juxian Wang; Liangce Rong; Xiangshan Wang; Hongwen Hu","2,2-Dimethyl-3-(4-methylphenyl)-1,2-dihydroquinazolin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2003","59","11","o1689","o1690","10.1107/S1600536803022128","","","0.71073","MoKα","","0.077","0.0433","","","0.1076","0.1194","","","","","","0.921","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202828","8.436","0.003","11.857","0.004","8.352","0.003","90","","113.96","0.03","90","","763.4","0.5","297.2","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C6 H20 Cl2 Cu N4 O8 -","- C6 H20 Cl2 Cu N4 O8 -","- C12 H40 Cl4 Cu2 N8 O16 -","2","0.5","OB6313","Akitsu, Takashiro; Einaga, Yasuaki","A redetermination of bis(<i>N</i>-methylethylenediamine-κ^2^<i>N,N</i>')bis(perchlorato-κ<i>O</i>)copper(II)","Acta Crystallographica Section E","2003","59","11","m991","m993","10.1107/S160053680302213X","","","0.7107","MoKα","","","0.0241","","","","0.0676","","","","","","1.075","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202829","7.716","0.001","14.495","0.002","27.526","0.005","90","","90","","90","","3078.6","0.8","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Alisol B monoacetate","11-hydroxy-24,25-epoxy-3-oxoprotost-13(17)-en-23-yl acetate","","- C32 H50 O5 -","- C32 H50 O5 -","- C128 H200 O20 -","4","1","OB6316","Yi-Ping Ye; Cui-Rong Sun; Xiao-Yu Li; Hong-Xiang Sun; Yuan-Jiang Pan","Alisol B monoacetate from the rhizome of <i>Alisma orientale</i>","Acta Crystallographica Section E","2003","59","11","o1858","o1859","10.1107/S1600536803024620","","","0.71073","MoKα","","0.087","0.0373","","","0.0771","0.0862","","","","","","0.801","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202830","47.219","0.012","24.229","0.006","4.1085","0.001","90","","90","","90","","4700","2","293","2","293","2","","","","","","","","4","F d d 2","F 2 -2d","43","4'-Bromomethyl-2-cyanobiphenyl","4'-Bromomethylbiphenyl-2-carbonitrile","","- C14 H10 Br N -","- C14 H10 Br N -","- C224 H160 Br16 N16 -","16","1","OB6317","Song, Qing-Bao; Li, Yi-Zhi; Qi, Chen-Ze; Shen, Tian-Hua; Wang, Hai-Bin","4'-Bromomethylbiphenyl-2-carbonitrile","Acta Crystallographica Section E","2003","59","12","o1944","o1945","10.1107/S1600536803025571","","","0.71073","MoKα","","0.0637","0.0448","","","0.0854","0.0882","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202831","10.347","0.002","9.3127","0.0019","13.16","0.003","90","","107.53","0.03","90","","1209.2","0.5","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Diethyl (2'R,4R,4'R)-2-(4'-ethoxycarbonyl-2'-thiazolidinyl)-6-methyl-4-(2''-thienyl)- 1,4-dihydropyridine-3,5-dicarboxylate","","- C22 H28 N2 O6 S2 -","- C22 H28 N2 O6 S2 -","- C44 H56 N4 O12 S4 -","2","1","OB6318","Vrábel, Viktor; Kožíšek, Jozef; Marchalín, Štefan","Diethyl (2'<i>R</i>,4<i>R</i>,4'<i>R</i>)-2-(4'-ethoxycarbonyl-2'-thiazolidinyl)-6-methyl-4-(2''-thienyl)-1,4-dihydropyridine-3,5-dicarboxylate","Acta Crystallographica Section E","2003","59","12","o1964","o1966","10.1107/S1600536803025911","","","0.71073","MoKα","","0.1058","0.0443","","","0.0877","0.0958","","","","","","0.978","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202832","7.086","0.002","16.669","0.003","10.915","0.003","90","","98.13","0.03","90","","1276.3","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","4,4'-bipyridinium sulfosalicyclate monohydrate","4,4'-bipyridinium bis(3-carboxy-4-hydroxy-benzenesulfonate) dihydrate","","- C24 H24 N2 O14 S2 -","- C24 H24 N2 O14 S2 -","- C48 H48 N4 O28 S4 -","2","0.5","OB6319","Packianathan Thomas Muthiah; Madhukar Hemamalini; Gabriele Bocelli; Andrea Cantoni","Hydrogen-bonding patterns in 4,4'-bipyridinium bis(3-carboxy-4-hydroxybenzenesulfonate) dihydrate","Acta Crystallographica Section E","2003","59","12","o2015","o2017","10.1107/S1600536803026813","","","1.54178","CuKα","","0.0515","0.0474","","","0.1274","0.1314","","","","","","1.09","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2202833","18.194","0.004","9.874","0.002","18.987","0.004","90","","118.155","0.005","90","","3007.4","1.1","296","1","296","1","","","","","","","","6","C 1 2/m 1","-C 2y","12","","Di-μ-pivalato-bis[cis-diammineplatinum(II)] bis(perchlorate) pivalic acid","","- C15 H40 Cl2 N4 O14 Pt2 -","- C15 H39 Cl2 N4 O14 Pt2 -","- C60 H156 Cl8 N16 O56 Pt8 -","4","0.5","OB6323","Sakai, Ken; Ishigami, Eri; Yokokawa, Kazuo; Kajiwara, Takashi; Ito, Tasuku","Di-μ-pivalato-bis[<i>cis</i>-diammineplatinum(II)] bis(perchlorate) pivalic acid solvate","Acta Crystallographica Section E","2003","59","12","m1178","m1180","10.1107/S1600536803026503","","","0.71073","MoKα","","0.0822","0.0415","","","0.0732","0.0793","","","","","","0.855","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2202834","7.2359","0.0011","7.7367","0.0011","13.2036","0.0019","82.309","0.003","76.268","0.003","72.365","0.002","682.76","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H28 Co N6 O8 -","- C26 H28 Co N6 O8 -","- C26 H28 Co N6 O8 -","1","0.5","OB6324","He, Hong-Yin; Zhu, Long-Guan","<i>trans</i>-Bis(3-aminopyridine)diaquabis(4-cyanobenzoato)cobalt(II) dihydrate","Acta Crystallographica Section E","2003","59","12","m1192","m1193","10.1107/S1600536803026709","","","0.71073","MoKα","","0.0501","0.0414","","","0.0754","0.0784","","","","","","0.94","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202835","8.4548","0.0004","12.4176","0.0005","22.6477","0.0009","86.51","0.001","79.359","0.001","73.167","0.001","2236.66","0.17","293","2","293","2","","","","","","","","8","P -1","-P 1","2","Re C15.5 H12 N3 O3 Sb F6 Cl","(2,2'-Bipyridine-κ^2^N,N')tricarbonyl(acetonitrile-κN)rhenium(I) hexafluoroantimonate dichloromethane hemisolvate","","- C15.5 H12 Cl F6 N3 O3 Re Sb -","- C15.5 H12 Cl F6 N3 O3 Re Sb -","- C62 H48 Cl4 F24 N12 O12 Re4 Sb4 -","4","2","OM6143","Chen, Yandan; Zhang, Liyi; Chen, Zhongning","(2,2'-Bipyridine-κ^2^<i>N,N</i>')tricarbonyl(acetonitrile-κ<i>N</i>)rhenium(I) hexafluoroantimonate dichloromethane hemisolvate","Acta Crystallographica Section E","2003","59","7","m429","m430","10.1107/S160053680301095X","","","0.71073","MoKα","","0.0831","0.0608","","","0.1421","0.1612","","","","","","1.126","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202836","10.482","0.003","11.026","0.003","13.146","0.004","90","","90","","90","","1519.3","0.8","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Bis(N,N-dimethylethylenediamine)copper(II) oxalate dihydrate","","- C10 H28 Cu N4 O6 -","- C10 H28 Cu N4 O6 -","- C40 H112 Cu4 N16 O24 -","4","0.5","OM6144","Bian, He-Dong; Xu, Jing-Yuan; Gu, Wen; Yan, Shi-Ping; Liao, Dai-Zheng; Jiang, Zong-Hui","Bis(<i>N,N</i>'-dimethylethylenediamine)copper(II) oxalate dihydrate","Acta Crystallographica Section E","2003","59","7","m441","m442","10.1107/S1600536803011929","","","0.71073","MoKα","","0.0422","0.028","","","0.0677","0.0754","","","","","","1.085","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202837","16.969","0.002","8.0436","0.0011","16.552","0.002","90","","90","","90","","2259.2","0.5","293","2","293","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","fac-tris(4,6-dimethylpyrimidine-2-thiolato-N,S)cobalt(III) monohydrate","","- C18 H23 Co N6 O S3 -","- C18 H23 Co N6 O S3 -","- C72 H92 Co4 N24 O4 S12 -","4","1","OM6145","Burrow, Robert Alan; Schulz Lang, Ernesto; Fernandes Jr, Ramão Marceli; Vázquez-López, Ezequiel M.","A new polymorph of <i>fac</i>-tris(4,6-dimethylpyrimidine-2-thiolato-κ^2^<i>N,S</i>)cobalt(III) monohydrate","Acta Crystallographica Section E","2003","59","7","m396","m398","10.1107/S1600536803011486","","","0.71073","MoKα","","0.1503","0.0611","","","0.1147","0.1388","","","","","","0.845","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202838","9.8575","0.0015","15.195","0.002","20.974","0.003","90","","96.654","0.004","90","","3120.4","0.8","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C13 H12 Ag F3 N2 O3 S -","- C13 H12 Ag F3 N2 O3 S -","- C104 H96 Ag8 F24 N16 O24 S8 -","8","2","OM6146","Li, Xiaoju; Cao, Rong; Sun, Daofeng; Bi, Wenhua; Wang, Yanqin; Hong, Maochun","<i>catena</i>-Poly[[silver(I)-μ-1,2-bis(4-pyridyl)ethane-κ^2^<i>N</i>:<i>N</i>'] trifluoromethanesulfonate]","Acta Crystallographica Section E","2003","59","7","m416","m418","10.1107/S1600536803011565","","","0.71073","MoKα","","0.1264","0.0438","","","0.0661","0.0756","","","","","","0.953","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202839","28.167","0.007","10.817","0.002","11.648","0.002","90","","90","","90","","3548.9","1.3","120","","120","","","","","","","","","6","P c c n","-P 2ab 2ac","56","","cis-dichlorotetrakis(dimethyl sulfoxide)ruthenium(II)","","- C8 H24 Cl2 O4 Ru S4 -","- C8 H24 Cl2 O4 Ru S4 -","- C64 H192 Cl16 O32 Ru8 S32 -","8","1","OM6147","Srivastava, Radhey S.; Fronczek, Frank R.","Orthorhombic <i>cis</i>-dichlorotetrakis(dimethyl sulfoxide)ruthenium(II) at 120K","Acta Crystallographica Section E","2003","59","7","m427","m428","10.1107/S1600536803011577","","","0.71073","MoKα","","0.116","0.046","","","0.074","0.088","","","","","","0.949","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202840","3.9191","0.0008","10.894","0.002","9.852","0.002","90","","100.87","0.03","90","","413.08","0.15","90","0.2","90","0.2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H2 Cl3 I -","- C6 H2 Cl3 I -","- C12 H4 Cl6 I2 -","2","0.5","OM6149","Kania-Korwel, Izabela; Robertson, Larry W.; Lehmler, Hans-Joachim; Parkin, Sean","2,4,5-Trichloro-1-iodobenzene","Acta Crystallographica Section E","2003","59","7","o1048","o1049","10.1107/S1600536803013977","","","0.71073","MoKα","","0.0373","0.0352","","","0.077","0.0779","","","","","","1.35","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202841","10.1973","0.0007","10.8295","0.0007","21.91","0.001","90","","90","","90","","2419.6","0.3","213","2","213","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(S)-N-(1-Phenethylpiperidin-1-ium-3-ylmethyl)-N-phenylpropionamide trifluoroacetate","","- C25 H31 F3 N2 O3 -","- C25 H31 F3 N2 O3 -","- C100 H124 F12 N8 O12 -","4","1","OM6150","Liming Shao; Gregory D. Cuny; James R. Hauske; Richard J. Staples","(<i>S</i>)-<i>N</i>-(1-Phenylethylpiperidin-1-ium-3-ylmethyl)-<i>N</i>-phenylpropionamide trifluoroacetate","Acta Crystallographica Section E","2003","59","9","o1398","o1399","10.1107/S1600536803015654","","","0.71073","MoKα","","0.0501","0.0469","","","0.1213","0.1248","","","","","","1.098","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202842","10.9235","0.0012","13.1172","0.0014","16.6861","0.0014","90","","97.325","0.008","90","","2371.4","0.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tris(8-quinolinolato-κ^2^N,O)cobalt(III) methanol solvate","","- C28 H22 Co N3 O4 -","- C28 H18 Co N3 O4 -","- C112 H72 Co4 N12 O16 -","4","1","OM6151","Dai-Xi Li; Duan-Jun Xu; Jian-Ming Gu; Yuan-Zhi Xu","Tris(8-quinolinolato-κ^2^<i>N,O</i>)cobalt(III) methanol solvate","Acta Crystallographica Section E","2003","59","7","m543","m545","10.1107/S1600536803014211","","","0.71069","MoKα","","0.063","0.042","","","0.117","0.13","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202843","16.042","0.004","16.042","0.004","8.656","0.002","90","","90","","90","","2227.6","0.9","174","2","174","2","","","","","","","","3","I 41/a :2","-I 4ad","88","durenedimethanol","2,3,5,6-tetramethyl-1,4-phenylenedimethanol","","- C12 H18 O2 -","- C12 H18 O2 -","- C96 H144 O16 -","8","0.5","OM6152","Britton, Doyle","Durenedimethanol","Acta Crystallographica Section E","2003","59","8","o1089","o1091","10.1107/S1600536803014223","","","0.71073","MoKα","","0.05","0.043","","","0.101","0.104","","","","","","1.13","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2202844","10.902","0.004","10.613","0.004","19.505","0.008","90","","103.32","0.03","90","","2196.1","1.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H52 N8 Ni2 O14 -","- C40 H52 N8 Ni2 O14 -","- C80 H104 N16 Ni4 O28 -","2","0.5","OM6153","Pal Chaudhuri, Urmila; Varghese, Babu; Murthy, Narasimha N.","Bis[μ-2-{bis(2-pyridylethyl)amino}phenolato]bis[aquanickel(II)] dinitrate tetrahydrate","Acta Crystallographica Section E","2003","59","8","m627","m629","10.1107/S1600536803015174","","","0.71073","MoKα","","0.078","0.0526","","","0.1289","0.1448","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202845","11.754","0.0015","9.639","0.0013","5.1732","0.0007","90","","112.946","0.002","90","","539.73","0.12","93","2","93","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","potassium 1,3,4,6-tetranitro-2,5-diazapentalene","potassium 1,3,4,6-tetranitro-2,5-diazapentalene","","- C6 K2 N6 O8 -","- C6 K2 N6 O8 -","- C12 K4 N12 O16 -","2","0.25","OM6154","Butcher, Ray J.; Bottaro, Jeffrey C.; Gilardi, R.","Potassium 1,3,4,6-tetranitro-2,5-diazapentalene","Acta Crystallographica Section E","2003","59","8","m591","m593","10.1107/S1600536803015095","","","0.71073","MoKα","","0.0259","0.0237","","","0.0623","0.0632","","","","","","1.128","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202846","12.1938","0.0003","9.8825","0.0002","5.213","0.0001","90","","112.294","0.001","90","","581.24","0.02","294","2","294","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","Ammonium 1,3,4,6-tetranitro-2,5-diazapentalene","Ammonium 1,3,4,6-tetranitro-2,5-diazapentalene","","- C6 H8 N8 O8 -","- C6 H8 N8 O8 -","- C12 H16 N16 O16 -","2","0.25","OM6155","Butcher, Ray J.; Bottaro, Jeffrey C.; Gilardi, R.","Ammonium 1,3,4,6-tetranitro-2,5-diazapentalene","Acta Crystallographica Section E","2003","59","8","o1149","o1150","10.1107/S1600536803015101","","","1.54178","CuKα","","0.0351","0.0312","","","0.0832","0.0854","","","","","","1.066","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202847","16.1201","0.0019","16.1201","0.0019","11.715","0.003","90","","90","","120","","2636.4","0.8","100","2","100","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C15 H21 Co Na O6 -","- C15 H21 Co Na O6 -","- C90 H126 Co6 Na6 O36 -","6","0.166667","OM6156","Li, Xiaobao; Musie, Ghezai; Powell, Douglas R.","Sodium tris(acetylacetonato-κ^2^<i>O</i>,<i>O</i>')cobalt(II)","Acta Crystallographica Section E","2003","59","9","m717","m718","10.1107/S1600536803017318","","","0.71073","MoKα","","0.0675","0.0378","","","0.0918","0.1194","","","","","","1.245","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202848","15.5786","0.0003","14.4453","0.0003","15.5995","0.0003","90","","99.749","0.001","90","","3459.78","0.12","150","1","150","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Aqua(N,N',N'',N'''-tetrakis(2-hydroxyethyl)-1,4,7,10- tetrazacyclododecane)praseodymium(III) hexanitratopraseodymate(III) dihydrate","","- C16 H42 N10 O25 Pr2 -","- C16 H42 N10 O25 Pr2 -","- C64 H168 N40 O100 Pr8 -","4","1","OM6157","Richards-Johnson, Roxan U.; Kahwa, Ishenkumba A.; Lough, Alan J.","Aqua(<i>N,N</i>',<i>N</i>'',<i>N</i>'''-tetrakis(2-hydroxyethyl)-1,4,7,10-tetrazacyclododecane)praseodymium(III) hexanitratopraseodymate(III) dihydrate","Acta Crystallographica Section E","2003","59","9","m742","m744","10.1107/S1600536803017458","","","0.71073","MoKα","","0.0279","0.023","","","0.0529","0.0551","","","","","","1.091","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202849","8.4576","0.0002","10.6599","0.0003","12.3642","0.0004","106.917","0.0014","98.624","0.0016","100.803","0.002","1022.48","0.05","120","0.2","120","0.2","","","","","","","","3","P -1","-P 1","2","","3,5-Dimethyl-1,7-diphenyl-4-(2-pyridinyl)-1H,7H-pyrazolo[3,4-b:4',3'-e]pyridine","","- C26 H20 N6 -","- C26 H20 N6 -","- C52 H40 N12 -","2","1","OM6158","Low, John Nicolson; Cobo, Justo; Portilla, Jaime; Quiroga, Jairo","3,5-Dimethyl-1,7-diphenyl-4-(2-pyridyl)-1<i>H</i>,7<i>H</i>-pyrazolo[3,4-<i>b</i>:4',3'-<i>e</i>]pyridine","Acta Crystallographica Section E","2003","59","9","o1327","o1329","10.1107/S1600536803018208","","","0.71073","MoKα","","0.054","0.0402","","","0.1014","0.1098","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202850","8.5006","0.0002","10.5829","0.0003","12.4093","0.0003","106.077","0.0012","97.6152","0.0015","100.675","0.001","1033.96","0.05","120","0.2","120","0.2","","","","","","","","3","P -1","-P 1","2","","3,5-Dimethyl-1,4,7-triphenyl-1H,7H-pyrazolo[3,4-b:4',3'-e]pyridine","","- C27 H21 N5 -","- C27 H21 N5 -","- C54 H42 N10 -","2","1","OM6159","Low, John Nicolson; Cobo, Justo; Portilla, Jaime; Quiroga, Jairo","3,5-Dimethyl-1,4,7-triphenyl-1<i>H</i>,7<i>H</i>-pyrazolo[3,4-<i>b</i>:4',3'-<i>e</i>]pyridine","Acta Crystallographica Section E","2003","59","9","o1330","o1331","10.1107/S160053680301821X","","","0.71073","MoKα","","0.0527","0.0403","","","0.0985","0.105","","","","","","1.052","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202851","12.4234","0.0018","7.5526","0.0011","13.628","0.002","90","","101.32","0.003","90","","1253.8","0.3","170","2","170","2","","","","","","","","3","P 1 21 1","P 2yb","4","fern-7en-3a-ol","","","- C30 H50 O -","- C30 H50 O -","- C60 H100 O2 -","2","1","OM6160","Khera, S.; Jolad, S. D.; Carducci, M. D.; Timmermann, B. N.","({-})-Fern-7-en-3α-ol from <i>Sebastiania brasiliensis</i>","Acta Crystallographica Section E","2003","59","9","o1403","o1404","10.1107/S1600536803018233","","","0.71073","MoKα","","0.051","0.0439","","","0.0997","0.103","","","","","","1.057","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202852","8.7821","0.0005","10.3347","0.0006","10.975","0.001","104.779","0.005","92.572","0.002","105.331","0.002","922.1","0.1","296.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C19 H18 Br N3 O3 -","- C19 H18 Br N3 O3 -","- C38 H36 Br2 N6 O6 -","2","1","","Wu, Jun; Zhang, Pei-Zhi; Yu, Qing-Sen; Hu, Xiu-Rong; Gu, Jian-Min","N-(2-Bromophenyl)-2-(4,6-dimethoxypyrimidin-2-yloxy)benzylamine","Acta Crystallographica, Section E: Structure Reports Online","2003","59","9","o1393","o1394","10.1107/s160053680301852x","","","","","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2202853","16.4457","0.0005","12.8087","0.0004","20.954","0.0008","90","","104.559","0.0013","90","","4272.2","0.2","250","2","250","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,2'-disulfanyldibenzoic acid","","- C14 H10 O4 S2 -","- C14 H10 O4 S2 -","- C168 H120 O48 S24 -","12","1.5","OM6162","Humphrey, Simon M.; Wood, Paul T.","2,2'-Disulfanyldibenzoic acid","Acta Crystallographica, Section E: Structure Reports Online","2003","59","9","o1364","o1366","10.1107/s1600536803017306","","","0.7107","MoKα","","0.122","0.0562","","","0.1145","0.1373","","","","","","1.024","","","","has coordinates,has Fobs","219073","2020-10-21","18:00:00",""
"2202854","11.819","0.003","18.418","0.005","6.075","0.0015","90","","90","","90","","1322.4","0.6","297","2","297","2","","","","","","","","6","P n m a","-P 2ac 2n","62","tetrafluorodiiodobenzene/DMSO","2,3,5,6-Tetrafluoro-1,4-diiodobenzene‒dimethyl sulfoxide (1/1)","","- C8 H6 F4 I2 O S -","- C8 H6 F4 I2 O S -","- C32 H24 F16 I8 O4 S4 -","4","0.5","OM6163","Britton, Doyle","2,3,5,6-Tetrafluoro-1,4-diiodobenzene‒dimethyl sulfoxide (1/1)","Acta Crystallographica Section E","2003","59","9","o1332","o1333","10.1107/S1600536803018221","","","0.71073","MoKα","","0.103","0.045","","","0.101","0.125","","","","","","0.92","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202855","8.6828","0.0009","13.385","0.0014","17.8678","0.0018","91.572","0.012","98.95","0.012","104.045","0.012","1985.4","0.4","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","2-(Diphenylphosphinoyl)benzoic acid chloroform solvate","","- C20 H16 Cl3 O3 P -","- C20 H16 Cl3 O3 P -","- C80 H64 Cl12 O12 P4 -","4","2","OM6164","Burger, Sylvain; Therrien, Bruno; Süss-Fink, Georg","2-(Diphenylphosphinoyl)benzoic acid chloroform solvate","Acta Crystallographica Section E","2003","59","9","o1336","o1338","10.1107/S1600536803018245","","","0.71073","MoKα","","0.0952","0.0512","","","0.1171","0.1265","","","","","","0.966","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202856","14.99","0.006","11.375","0.005","17.815","0.008","90","","92.254","0.006","90","","3035","2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ethyl 4'-(4-methoxyphenyl)-1',7''-dimethyl-2,3''-dioxo-5''-phenyl- 2,3,2'',3'',4'',5''-tetrahydro-1H-indole-3-spiro-2'-pyrrolidine-3'-spiro- 2''-(thiazolo[3,2-a]pyrimidine)-6''-carboxylate","","- C34 H32 N4 O5 S -","- C34 H32 N4 O5 S -","- C136 H128 N16 O20 S4 -","4","1","OM6165","Li, Xiao-Fang; Feng, Ya-Qing; Shi, Da-Xin; Chen, Hong-Liang","Ethyl 4'-(4-methoxyphenyl)-1',7''-dimethyl-2,3''-dioxo-5''-phenyl-2,3,2'',3'',4'',5''-tetrahydro-1<i>H</i>-indole-3-spiro-2'-pyrrolidine-3'-spiro-2''-(thiazolo[3,2-<i>a</i>]pyrimidine)-6''-carboxylate","Acta Crystallographica Section E","2003","59","9","o1416","o1417","10.1107/S1600536803018786","","","0.71073","MoKα","","0.1136","0.0531","","","","0.1367","","","","","","1.003","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202857","8.66","0.003","9.843","0.004","14.095","0.006","88.374","0.007","73.054","0.006","79.895","0.006","1131.1","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4'-(4-Methoxyphenyl)-1'-methyl-4'',5'',6'',7''-tetrahydro- 1H-indole-3-spiro-2'-pyrrolidine-3'-spiro-2''-(thiazolo[3,2-a]pyrimidine)- 2(3H),3''(2''H)-dione","","- C24 H24 N4 O3 S -","- C24 H24 N4 O3 S -","- C48 H48 N8 O6 S2 -","2","1","OM6166","Li, Xiao-Fang; Feng, Ya-Qing; Shi, Da-Xin; Chen, Hong-Liang","4'-(4-Methoxyphenyl)-1'-methyl-4'',5'',6'',7''-tetrahydro-1<i>H</i>-indole-3-spiro-2'-pyrrolidine-3'-spiro-2''-(thiazolo[3,2-<i>a</i>]pyrimidine)-2(3<i>H</i>),3''(2''<i>H</i>)-dione","Acta Crystallographica Section E","2003","59","9","o1418","o1419","10.1107/S1600536803018798","","","0.71073","MoKα","","0.0841","0.0483","","","","0.1127","","","","","","1.014","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202858","8.876","0.0004","13.729","0.0009","14.232","0.0008","81.892","0.002","74.61","0.002","82.388","0.002","1647.16","0.16","150","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C62 H106 P4 Pt2 -","- C62 H106 P4 Pt2 -","- C62 H106 P4 Pt2 -","1","0.5","OM6167","Khan, Muhammad S.; Al-Suti, Mohammed K.; Mahon, Mary F.; Male, Louise; Raithby, Paul R.","<i>trans</i>-μ-(2,5-Dioctyl-1,4-phenylene)diethynyl-bis[phenylbis(triethylphosphine)platinum(II)]","Acta Crystallographica Section E","2003","59","10","m833","m835","10.1107/S1600536803018889","","","0.71073","MoKα","","","0.0662","","","","0.1715","","","","","","1.069","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202859","9.866","0.003","16.092","0.005","18.392","0.005","90","","90","","90","","2920","1.5","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","swietenine","swietenine","","- C32 H40 O9 -","- C32 H40 O9 -","- C128 H160 O36 -","4","1","OM6168","K. Anand Solomon; R. Malathi; S. S. Rajan; S. Narasimhan; M. Nethaji","Swietenine","Acta Crystallographica Section E","2003","59","10","o1519","o1521","10.1107/S1600536803020476","","","0.71073","MoKα","","0.0526","0.0467","","","0.1271","0.132","","","","","","1.087","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202860","10.1341","0.0013","16.168","0.002","6.9249","0.0009","90","","90","","90","","1134.6","0.3","173","2","173","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","N,N'-Bis(salicylidene)-1,2-(1S,2S)-(-)-diphenyl-1,2-ethanediamine","","- C28 H24 N2 O2 -","- C28 H24 N2 O2 -","- C56 H48 N4 O4 -","2","0.5","OM6169","Korendovych, Ivan V.; Rybak-Akimova, Elena V.","(‒)-(1<i>S</i>,2<i>S</i>)-<i>N,N</i>'-Bis(salicylidene)-1,2-diphenyl-1,2-ethanediamine","Acta Crystallographica Section E","2003","59","10","o1498","o1500","10.1107/S1600536803019603","","","0.71073","MoKα","","0.0458","0.0416","","","0.1123","0.1172","","","","","","1.094","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202861","11.321","0.001","5.879","0.0006","16.1","0.002","90","","94.058","0.01","90","","1068.9","0.2","173","2","173","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Z)-2-Thiophen-3-ylmethylene-1-aza-bicyclo[2.2.2]octan-3-one","","- C12 H13 N O S -","- C12 H13 N O S -","- C48 H52 N4 O4 S4 -","4","1","OM6170","Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.","(<i>Z</i>)-2-Thiophen-3-ylmethylene-1-aza-bicyclo[2.2.2]octan-3-one","Acta Crystallographica Section E","2003","59","10","o1464","o1466","10.1107/S1600536803019007","","","0.71073","MoKα","","0.0676","0.0453","","","0.1106","0.1216","","","","","","1.025","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202862","8.356","0.003","17.406","0.005","19.052","0.006","90","","90","","90","","2771","1.5","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","2-Phenylbenzenepentanenitrile","","- C17 H17 N -","- C17 H17 N -","- C136 H136 N8 -","8","1","OM6172","Li, Jie; Li, Chun-Bao; Shao, Qi-Yun","2,5-Diphenylpentanenitrile","Acta Crystallographica Section E","2003","59","11","o1668","o1669","10.1107/S1600536803020178","","","0.71073","MoKα","","0.0982","0.0555","","","","0.1426","","","","","","1.043","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202863","8.741","0.004","9.255","0.004","14.097","0.007","85.69","0.007","72.206","0.007","79.169","0.008","1066.3","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-Methyl-spiro[2.3']oxindole-spiro[3.2""]5"",6""-dihydro-imidazo [2"",1""-b]thiazol-3""-one -4-(2-benzo[1,3]dioxol-5-yl)-pyrrolidine","","- C23 H20 N4 O4 S -","- C23 H20 N4 O4 S -","- C46 H40 N8 O8 S2 -","2","1","OM6173","Li, Xiao-Fang; Feng, Ya-Qing; Gao, Bo; Chen,Hong-Liang","1-Methyl-spiro[2.3']oxindole-spiro[3.2'']5'',6''-dihydroimidazo[2'',1''-<i>b</i>]thiazol-3''-one-4-(2-benzo[1,3]dioxol-5-yl)pyrrolidine","Acta Crystallographica Section E","2003","59","10","o1467","o1468","10.1107/S1600536803019512","","","0.71073","MoKα","","0.042","0.0341","","","","0.1072","","","","","","1.091","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202864","10.8616","0.0012","13.6096","0.0015","15.0657","0.0017","90","","106.282","0.012","90","","2137.7","0.4","295","2","295","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 Cl2 Co N8 O2 S4 -","- C12 H16 Cl2 Co N8 O2 S4 -","- C48 H64 Cl8 Co4 N32 O8 S16 -","4","1","OM6174","Jia-Geng Liu; Duan-Jun Xu; Yuan-Zhi Xu","Bis(2,2'-diamino-4,4'-bi-1,3-thiazole-<i>N,N</i>')(dichloro)cobalt(II) dihydrate","Acta Crystallographica Section E","2003","59","10","m886","m888","10.1107/S1600536803019524","","","0.71073","MoKα","","0.088","0.047","","","0.098","0.108","","","","","","0.863","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202865","7.22","0.001","10.928","0.002","13.919","0.003","110.08","0.03","98.73","0.03","96.31","0.03","1003.9","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Tris(1,6-diaminohexane)diterephthalatotetrasilver(I) dihydrate","","- C17 H30 Ag2 N3 O5 -","- C17 H30 Ag2 N3 O5 -","- C34 H60 Ag4 N6 O10 -","2","1","OM6175","Zhu, Hai-Liang; Wang, Zao-Gui; Lin, Yong-Shan; Zou, Ying; Tang, Lu-Lu; Shao, Si-Chang","Tris(μ-1,6-diaminohexane)diterephthalatotetrasilver(I) dihydrate","Acta Crystallographica Section E","2003","59","10","m942","m943","10.1107/S1600536803020373","","","0.71073","MoKα","","0.0422","0.0371","","","0.09","0.0926","","","","","","1.074","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202866","8.7854","0.0002","11.3729","0.0001","11.5862","0.0003","85.828","0.001","84.276","0.001","73.129","0.001","1101.13","0.04","175","2","175","2","","","","","","","","6","P -1","-P 1","2","","bis(1,4,7-trithiacyclononane-S,S',S"")-iron(II) bis(perchlorate)","","- C12 H24 Cl2 Fe O8 S6 -","- C12 H24 Cl2 Fe O8 S6 -","- C24 H48 Cl4 Fe2 O16 S12 -","2","1","OM6176","Green, Tyler W.; Krause Bauer, Jeanette A.; Connick, William B.","Bis(1,4,7-trithiacyclononane-κ^3^<i>S,S</i>',<i>S</i>'')iron(II) bis(perchlorate)","Acta Crystallographica Section E","2003","59","10","m953","m954","10.1107/S1600536803020385","","","0.71073","MoKα","","0.033","0.0259","","","0.0622","0.0649","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202867","10.2097","0.0006","7.5773","0.0003","20.6921","0.0012","90","","110.203","0.003","90","","1502.29","0.14","120","0.2","120","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(p-Chlorophenyl)-3,4-dimethyl-5,6,7,8-tetrahydropyrazolo[3,4-b]quinoline","","- C18 H18 Cl N3 -","- C18 H18 Cl N3 -","- C72 H72 Cl4 N12 -","4","1","OM6177","Low, John Nicolson; Quiroga, Jairo; Portilla, Jaime; Cobo, Justo","1-(<i>p</i>-Chlorophenyl)-3,4-dimethyl-5,6,7,8-tetrahydropyrazolo[3,4-<i>b</i>]quinoline","Acta Crystallographica Section E","2003","59","11","o1657","o1658","10.1107/S1600536803021901","","","0.71073","MoKα","","0.1116","0.0505","","","0.1056","0.1277","","","","","","0.968","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202868","15.172","0.004","12.218","0.003","18.153","0.005","90","","106.603","0.005","90","","3224.8","1.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","1,4-Bis(thiazol-2-ylsulfanyl)butane","trans-Dichlorobis{2-[2-(4-methoxylphenyl)ethenyl]-5-methyl-1,3-benzoxazole- κN}cobalt(II)","","- C34 H30 Cl2 Co N2 O4 -","- C34 H30 Cl2 Co N2 O4 -","- C136 H120 Cl8 Co4 N8 O16 -","4","0.5","OM6178","Jia, Zheng-shan; Liu, Hui-Min; Zheng, Yan; Zhang, Wen-Qin","<i>trans</i>-Dichlorobis{2-[2-(4-methoxyphenyl)ethenyl]-5-methyl-1,3-benzoxazole-κ<i>N</i>}cobalt(II)","Acta Crystallographica Section E","2003","59","11","m1002","m1003","10.1107/S1600536803022177","","","0.71073","MoKα","","0.105","0.05","","","","0.1211","","","","","","1.011","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202869","3.997","0.0001","21.584","0.0004","9.751","0.0002","90","","100.994","0.001","90","","825.79","0.03","90","0.2","90","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,4,6-Trichloro-1-iodobenzene","","- C6 H2 Cl3 I -","- C6 H2 Cl3 I -","- C24 H8 Cl12 I4 -","4","1","OM6179","Kania-Korwel Izabela; Robertson, Larry W.; Lehmler, Hans-Joachim; Parkin, Sean","2,4,6-Trichloroiodobenzene","Acta Crystallographica Section E","2003","59","11","o1770","o1771","10.1107/S1600536803022530","","","0.71073","MoKα","","0.0255","0.0213","","","0.0508","0.0524","","","","","","1.097","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202870","7.8251","0.0011","16.1448","0.0013","13.2147","0.0011","90","","101.508","0.013","90","","1635.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Chloro-3,4-dimethoxybenzaldehyde 2,4-dinitrophenylhydrazone","","- C15 H13 Cl N4 O6 -","- C15 H13 Cl N4 O6 -","- C60 H52 Cl4 N16 O24 -","4","1","OM6180","Shang Shan; Wei-Rong Chen; Wei-Xiao Hu; Duan-Jun Xu","2-Chloro-3,4-dimethoxybenzaldehyde 2,4-dinitrophenylhydrazone","Acta Crystallographica Section E","2003","59","11","o1723","o1725","10.1107/S1600536803022542","","","0.71073","MoKα","","0.055","0.045","","","0.106","0.115","","","","","","1.169","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202871","6.2144","0.0001","6.8078","0.0001","8.4492","0.0002","102.896","0.0009","94.7214","0.0009","110.262","0.001","321.861","0.011","90","0.2","90","0.2","","","","","","","","5","P 1","P 1","1","","(Z)-(2-Benzo[b]thiophen-3-ylmethylene)-1-azabicyclo[2.2.2]octan-3-one","","- C16 H15 N O S -","- C16 H15 N O S -","- C16 H15 N O S -","1","1","OM6181","Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.","(<i>Z</i>)-2-(Benzo[<i>b</i>]thiophen-3-ylmethylene)-1-azabicyclo[2.2.2]octan-3-one","Acta Crystallographica Section E","2003","59","11","o1726","o1728","10.1107/S1600536803022797","","","0.71073","MoKα","","0.0263","0.0257","","","0.0685","0.0696","","","","","","1.151","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202872","7.9329","0.0004","23.2431","0.001","9.9054","0.0004","90","","105.044","0.001","90","","1763.81","0.14","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis[tris(pyrazol-1-yl)methane-κ^2^N,N']platinum(II) bis(hexafluorophosphate) nitromethane solvate","","- C22 H26 F12 N14 O4 P2 Pt -","- C22 H26 F12 N14 O4 P2 Pt -","- C44 H52 F24 N28 O8 P4 Pt2 -","2","0.5","OM6182","Green, Tyler W.; Krause Bauer, Jeanette A.; Coker, Nathan L.; Connick, William B.","Bis[tris(pyrazol-1-yl)methane-κ^2^<i>N,N</i>']platinum(II) bis(hexafluorophosphate) nitromethane solvate","Acta Crystallographica Section E","2003","59","11","m1035","m1037","10.1107/S1600536803022529","","","0.71073","MoKα","","0.0469","0.0253","","","0.0514","0.0566","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202873","3.7798","0.001","11.368","0.004","12.089","0.004","90","","94.54","0.03","90","","517.8","0.3","173","2","173","2","","","","","","","","3","P 1 21 1","P 2yb","4","","4,4'-dicyanobiphenyl","","- C14 H8 N2 -","- C14 H8 N2 -","- C28 H16 N4 -","2","1","OM6185","Britton, Doyle; Young Jr, Victor G.","4,4'-Dicyanobiphenyl","Acta Crystallographica Section E","2003","59","11","o1849","o1851","10.1107/S1600536803023274","","","0.71073","MoKα","","0.062","0.052","","","0.112","0.1162","","","","","","1.15","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202874","22.3211","0.0008","22.3211","0.0008","17.222","0.0009","90","","90","","120","","7431","0.5","120","0.2","120","0.2","","","","","","","","4","R -3 :H","-R 3","148","","6-(4-fluorophenyl)-5,6-dihydrobenzimidazo[1,2-c]quinazoline","","- C20 H14 F N3 -","- C20 H14 F N3 -","- C360 H252 F18 N54 -","18","1","OM6186","Low, John Nicolson; Insuasty, Braulio; Torres, Harlen; Cobo, Justo","6-(4-Fluorophenyl)-5,6-dihydrobenzimidazo[1,2-<i>c</i>]quinazoline","Acta Crystallographica, Section E: Structure Reports Online","2003","59","11","o1801","o1803","10.1107/S1600536803023663","","","0.71073","MoKα","","0.0905","0.0569","","","0.1463","0.1624","","","","","","1.041","","","","has coordinates,has Fobs","209472","2020-10-21","18:00:00",""
"2202875","10.6825","0.0004","11.9254","0.0004","13.1219","0.0006","111.211","0.0017","90.5164","0.0018","96.533","0.002","1546.01","0.11","120","0.2","120","0.2","","","","","","","","4","P -1","-P 1","2","","3,7,7-trimethyl-1-phenyl-1,6,7,8-tetrahydro-5H-pyrazolo[3,4-b]quinolin-5-one","","- C19 H19 N3 O -","- C19 H19 N3 O -","- C76 H76 N12 O4 -","4","2","OM6187","Low, John Nicolson; Vera, Jaime; Quiroga, Jairo; Cobo, Justo","3,7,7-Trimethyl-1-phenyl-1,6,7,8-tetrahydro-5<i>H</i>-pyrazolo[3,4-<i>b</i>]quinolin-5-one","Acta Crystallographica Section E","2003","59","11","o1804","o1806","10.1107/S1600536803023675","","","0.71073","MoKα","","0.0955","0.059","","","0.1244","0.1381","","","","","","1.049","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202876","14.5564","0.0014","13.5072","0.0012","15.7929","0.0011","90","","115.43","0.012","90","","2804.3","0.5","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H23 N8 Ni O7.5 S4 -","- C20 H23 N8 Ni O7.5 S4 -","- C80 H92 N32 Ni4 O30 S16 -","4","1","OM6188","Bing-Xin Liu; Duan-Jun Xu","Bis(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^<i>N,N</i>')(phthalato-κ^2^<i>O,O</i>')nickel(II) 3.5-hydrate","Acta Crystallographica Section E","2003","59","12","m1096","m1098","10.1107/S1600536803024516","","","0.71073","MoKα","","0.065","0.045","","","0.104","0.112","","","","","","1.026","","","","has coordinates,has Fobs","199684","2020-10-21","18:00:00",""
"2202877","26.807","0.003","14.3442","0.0018","20.3758","0.0015","90","","126.362","0.006","90","","6309.4","1.3","296","1","296","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(μ-pentafluorobenzenethiolato-κ^2^S:S)-trans- bis{(pentafluorobenzenethiolato-κS)[(pentafluorophenyl)diphenylphosphine- κP]palladium(II)}","","- C60 H20 F30 P2 Pd2 S4 -","- C60 H20 F30 P2 Pd2 S4 -","- C240 H80 F120 P8 Pd8 S16 -","4","0.5","OM6189","Villanueva, Luis; Bernès, Sylvain; Torrens, Hugo","Bis(μ-pentafluorobenzenethiolato-κ^2^<i>S</i>:<i>S</i>)-<i>trans</i>-bis{(pentafluorobenzenethiolato-κ<i>S</i>)[(pentafluorophenyl)diphenylphosphine-κ<i>P</i>]palladium(II)}","Acta Crystallographica Section E","2003","59","12","m1140","m1142","10.1107/S1600536803025558","","","0.71073","MoKα","","0.0923","0.0472","","","0.094","0.1111","","","","","","0.999","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202878","28.0466","0.0014","9.0833","0.0004","14.7948","0.0007","90","","93.587","0.001","90","","3761.7","0.3","203","2","203","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Glycoluril Diamide","cis-N,N'-bis(2-hydroxyethyl)-4,8-dioxo-2,6-dioxa-3a,4a,7a,8a- tetraazacyclopenta[def]fluorene-8b,8c-dicarboxamide dihydrate","","- C14 H24 N6 O10 -","- C14 H24 N6 O10 -","- C112 H192 N48 O80 -","8","1","OM6191","Fettinger, James C.; Burnett, Christopher A.; Isaacs, Lyle","Glycoluril diamide dihydrate","Acta Crystallographica Section E","2003","59","12","o1927","o1929","10.1107/S1600536803025224","","","0.71073","MoKα","","0.0375","0.0338","","","0.0953","0.0985","","","","","","1.053","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202879","12.621","0.004","10.778","0.004","22.761","0.007","90","","105.14","0.03","90","","2988.7","1.8","296","","296","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","9-(p-Methylpheny)-9-fluorenol","","- C20 H16 O -","- C20 H16 O -","- C160 H128 O8 -","8","2","OM6192","Robinson, Paul D.; McLean, Aaron W.; Meyers, Cal Y.","9-(<i>p</i>-Methylpheny)-9-fluorenol","Acta Crystallographica Section E","2003","59","12","o1915","o1917","10.1107/S1600536803025212","","","0.71069","MoKα","","0.105","0.037","","","0.101","0.128","","","","","","1.009","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202880","12.622","0.004","9.644","0.003","24.576","0.009","90","","92.958","0.006","90","","2987.6","1.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(2,6-Dichlorophenyl)-1""-methyl- 4,4""-diphenyloxazole-5(4H)-spiro-2'-cyclopentane- 5'-spiro-3""-pyrrolidine-2""-spiro-3""'-1H-indole- 2""'(3""'H),1'-dione","","- C36 H29 Cl2 N3 O3 -","- C36 H29 Cl2 N3 O3 -","- C144 H116 Cl8 N12 O12 -","4","1","RN6000","Li, Xiao-Fang; Feng, Ya-Qing; Gao, Bo; Li, Nan","3'''-(2,6-Dichlorophenyl)-1'-methyl-4',4'''-diphenyl-4''',5'''-dihydro-indole-3-spiro-2'-pyrrolidine-3'-spiro-1''-cyclopentane-3''-spiro-5'''-[1,2]oxazole-2(3<i>H</i>),2''-dione","Acta Crystallographica Section E","2003","59","11","o1659","o1660","10.1107/S1600536803022001","","","0.71073","MoKα","","0.1307","0.0611","","","","0.126","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202881","10.731","0.0018","10.827","0.003","9.7916","0.0014","95.607","0.017","94.68","0.013","76.484","0.017","1098.8","0.4","295","","295","","","","","","","","","4","P -1","-P 1","2","","3-(Z)-isobutylidene-1-acetylpiperazine-2,5-dione","","- C10 H14 N2 O3 -","- C10 H14 N2 O3 -","- C40 H56 N8 O12 -","4","2","RN6001","Wendy A. Loughlin; Michelle A. McCleary; Peter C. Healy","Conformational isomerism in 3-(<i>Z</i>)-isobutylidene-1-acetylpiperazine-2,5-dione","Acta Crystallographica Section E","2003","59","11","o1807","o1809","10.1107/S1600536803023729","","","0.71069","MoKα","","0.0799","0.0532","","","0.1649","0.1876","","","","","","1.085","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202882","11.4234","0.0013","15.1383","0.0019","9.3774","0.001","90","","104.885","0.009","90","","1567.2","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-[6-(2,2-Dimethylpropionylamino)pyridin-2-yl]-2,2-dimethylpropionamide","","- C15 H23 N3 O2 -","- C15 H23 N3 O2 -","- C60 H92 N12 O8 -","4","1","RN6002","Jonathan D Crane","<i>N</i>-[6-(2,2-Dimethylpropionylamino)pyridin-2-yl]-2,2-dimethylpropionamide","Acta Crystallographica Section E","2003","59","11","o1854","o1855","10.1107/S1600536803024735","","","0.71073","MoKα","","0.0694","0.0333","","","0.0656","0.0717","","","","","","0.804","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202883","8.1406","0.0012","8.2225","0.0012","8.7087","0.0013","82.044","0.012","71.59","0.011","68.264","0.011","513.62","0.14","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","[3,5-Bis(trifluoromethyl)phenyl]{(E)-2-[(E)-3,5- bis(trifluoromethyl)phenylimino]-1-methylpropylidene}amine","","- C20 H12 F12 N2 -","- C20 H12 F12 N2 -","- C20 H12 F12 N2 -","1","0.5","RN6003","Helen L. Aberdeen; Robert E. Allan; Jonathan D. Crane","[3,5-Bis(trifluoromethyl)phenyl]{(<i>E</i>)-2-[(<i>E</i>)-3,5-bis(trifluoromethyl)phenylimino]-1-methylpropylidene}amine","Acta Crystallographica Section E","2003","59","12","o1896","o1897","10.1107/S160053680302508X","","","0.71073","MoKα","","0.0793","0.059","","","0.1824","0.1921","","","","","","1.147","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202884","11.5768","0.0004","10.6642","0.0003","7.5782","0.0002","90","","108.013","0.001","90","","889.73","0.05","120","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 Cu N4 O8 -","- C16 H18 Cu N4 O8 -","- C32 H36 Cu2 N8 O16 -","2","0.5","RN6005","Tony D. Keene; Michael B. Hursthouse; Daniel J. Price","<i>trans</i>-Bis(2-aminoanilinium-κ<i>N</i>^2^)bis(oxalato-κ^2^<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section E","2003","59","12","m1131","m1133","10.1107/S1600536803025613","","","0.71073","MoKα","","","0.0354","","","","0.0909","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202885","8.0693","0.0008","13.002","0.001","13.931","0.002","90","","105.623","0.004","90","","1407.6","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Chloro-3-(3-dimethylaminopropylamino)-1,4-naphthoquinone","","- C15 H17 Cl N2 O2 -","- C15 H17 Cl N2 O2 -","- C60 H68 Cl4 N8 O8 -","4","1","SU6003","Daniel E. Lynch; Ian McClenaghan","2-Chloro-3-(3-dimethylaminopropylamino)-1,4-naphthoquinone","Acta Crystallographica Section E","2003","59","9","o1427","o1428","10.1107/S1600536803018932","","","0.71073","MoKα","","0.2654","0.0667","","","0.1159","0.1763","","","","","","0.88","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202886","7.844","0.002","19.406","0.004","8.376","0.002","90","","93.72","0.03","90","","1272.3","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H10 Ag N5 O7 -","- C8 H10 Ag N5 O7 -","- C32 H40 Ag4 N20 O28 -","4","1","SU6025","Hai-Liang Zhu; Xian-Jiang Wang; Fan-Jin Meng; Xiu-Ying Liu","Polymeric (ethylenediamine)silver(I) 2,4,6-trinitrophenolate","Acta Crystallographica Section E","2003","59","9","m698","m699","10.1107/S1600536803016635","","","0.71073","MoKα","","0.0773","0.0609","","","0.0967","0.1018","","","","","","1.195","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202887","5.4761","0.0003","21.7289","0.0012","12.2512","0.0006","90","","104.156","0.002","90","","1413.5","0.13","293","2","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3,3'-Diethyl-1,1'-butylenedi[5(6)-methylbenzimidazolium] diiodide dihydrate","","- C24 H36 I2 N4 O2 -","- C24 H36 I2 N4 O2 -","- C48 H72 I4 N8 O4 -","2","0.5","SU6026","Sema Öztürk; Mehmet Akkurt; Hasan Küçükbay; Naif Okuyucu; Hoong-Kun Fun","3,3'-Diethyl-1,1'-butylenedi[5(6)-methylbenzimidazolium] diiodide dihydrate","Acta Crystallographica Section E","2003","59","7","o1014","o1016","10.1107/S1600536803013473","","","0.71073","MoKα","","0.0748","0.0572","","","0.1056","0.1142","","","","","","0.97","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202888","11.1294","0.0014","6.9653","0.0009","31.174","0.004","90","","110.437","0.004","90","","2264.5","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H11 Cl N5 Ni S4 -","- C20 H11 Cl N5 Ni S4 -","- C80 H44 Cl4 N20 Ni4 S16 -","4","1","SU6029","Guangxiang Liu; Jingli Xie; Xiaoming Ren; Youcun Chen","1-(2-Chlorobenzyl)pyridinium bis(maleonitriledithiolato)nickelate(III)","Acta Crystallographica Section E","2003","59","7","m527","m529","10.1107/S1600536803013576","","","0.71073","MoKα","","0.1338","0.0883","","","0.1847","0.1985","","","","","","1.089","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202889","8.4114","0.0017","10.891","0.002","15.245","0.003","90","","100.55","0.03","90","","1373","0.5","83","2","83","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(MEDA)CdI4","Methylethylenediamine tetraiodocadmium(II)","","- C3 H12 Cd I4 N2 -","- C3 H12 Cd I4 N2 -","- C12 H48 Cd4 I16 N8 -","4","1","SU6030","Adrienne A. Thorn; Roger D. Willett; Brendan Twamley","<i>N</i>-Methylethylenediammonium tetraiodocadmium(II)","Acta Crystallographica Section E","2003","59","9","m790","m791","10.1107/S1600536803013965","","","0.71073","MoKα","","0.0206","0.0191","","","0.0445","0.0451","","","","","","1.163","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202890","11.514","0.002","13.447","0.003","22.449","0.005","90","","97.01","0.03","90","","3449.8","1.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","trans-Bromohydridobis(triphenylphosphine)platinum toluene hemisolvate","","- C39.5 H35 Br P2 Pt -","- C39.5 H31 Br P2 Pt -","- C158 H124 Br4 P8 Pt4 -","4","1","SU6031","Aldridge, Simon; Coombs, Deborah; Jones, Cameron","<i>trans</i>-Bromohydridobis(triphenylphosphine)platinum toluene hemisolvate","Acta Crystallographica Section E","2003","59","8","m584","m585","10.1107/S1600536803014995","","","0.71073","MoKα","","0.0439","0.0315","","","0.0669","0.0711","","","","","","1.017","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202891","19.005","0.007","12.611","0.004","17.986","0.006","90","","115.937","0.005","90","","3877","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(2,6-dichlorophenyl)-spiro[5.3']1'-benzyl-4-piperidone- spiro[5'.3'']1-N-methyl-4-phenyl-pyrrolidine-spiro[2''.3''']oxindole- 4-phenyl-isoxazoline","","- C46 H39 Cl2 N4 O3 -","- C46 H39 Cl2 N4 O3 -","- C184 H156 Cl8 N16 O12 -","4","1","SU6032","Li, Xiao-Fang; Feng, Ya-Qing; Hu, Xiao-Fen; Xu, Mian","1'-Benzyl-3-(2,6-dichlorophenyl)-1''-methyl-4,4''-diphenyloxazole-5(4<i>H</i>)-spiro-3'-piperidine-5'-spiro-3''-pyrrolidine-2''-spiro-3'''-1<i>H</i>-indole-2'''(3'''<i>H</i>),4'-dione benzene hemisolvate","Acta Crystallographica Section E","2003","59","9","o1280","o1282","10.1107/S1600536803015423","","","0.71073","MoKα","","0.1188","0.0471","","","","0.1284","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202892","5.8261","0.0004","8.3209","0.0005","9.6602","0.0006","65.216","0.002","76.823","0.002","84.066","0.003","413.97","0.05","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H9 N O S -","- C8 H9 N O S -","- C16 H18 N2 O2 S2 -","2","1","SU6033","Lai, Chian Sing; Ho, Soo Yei; Tiekink, Edward R. T.","<i>O</i>-Methyl <i>N</i>-phenylthiocarbamate","Acta Crystallographica Section E","2003","59","8","o1155","o1156","10.1107/S1600536803015435","","","0.71069","MoKα","","0.041","0.038","","","0.105","0.108","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202893","11.339","0.003","7.444","0.002","24.546","0.004","90","","97.61","0.01","90","","2053.6","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-[(2RS,3RS)-4-Acetyl-2-hydroxy-3-(5-methoxy-4-methyl-3-phenylpyrazol-1- ylamino)-2,5-dimethyl-2,3-dihydro-furan-3-yl]ethanone","","- C21 H25 N3 O5 -","- C21 H25 N3 O5 -","- C84 H100 N12 O20 -","4","1","SU6034","Angela Celli; Donato Donati; Fabio Ponticelli","1-[(2<i>RS</i>,3<i>RS</i>)-4-Acetyl-2-hydroxy-3-(5-methoxy-4-methyl-3-phenylpyrazol-1-ylamino)-2,5-dimethyl-2,3-dihydrofuran-3-yl]ethanone","Acta Crystallographica Section E","2003","59","8","o1170","o1172","10.1107/S1600536803015514","","","0.71073","MoKα","","","0.056","","","","0.1392","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202894","7.299","0.001","10.039","0.001","10.096","0.001","67.03","0.01","69.32","0.01","88.43","0.01","631.98","0.14","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","N'-(2-Chlorobenzoyl)-N-(pyrrolidin-1-yl)thiourea","","- C12 H13 Cl N2 O S -","- C12 H13 Cl N2 O S -","- C24 H26 Cl2 N4 O2 S2 -","2","1","SU6035","Emen, Fatih Mehmet; Flörke, Ulrich; Külcü, Nevzat; Arslan, Hakan","<i>N</i>'-(2-Chlorobenzoyl)-<i>N</i>-(pyrrolidin-1-yl)thiourea","Acta Crystallographica Section E","2003","59","8","o1159","o1160","10.1107/S1600536803015526","","","0.71073","MoKα","","0.0857","0.049","","","0.0934","0.1067","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202895","6.833","0.002","12.526","0.004","12.786","0.004","104.903","0.005","93.392","0.005","94.425","0.005","1050.8","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-aminobenzothiazole‒N-benzyl-2-oxo-2H-1-benzopyran-3-carboxamide (1/1)","","- C24 H19 N3 O3 S -","- C24 H19 N3 O3 S -","- C48 H38 N6 O6 S2 -","2","1","SU6036","Francisco J. Martínez-Martínez; Efrén V. García-Báez; Herbert Höpfl; Itzia I. Padilla-Martínez","The 2-aminobenzothiazole‒<i>N</i>-benzyl-2-oxo-2<i>H</i>-1-benzopyran-3-carboxamide (1/1) donor‒acceptor complex","Acta Crystallographica Section E","2003","59","11","o1628","o1630","10.1107/S160053680302155X","","","0.71073","MoKα","","0.1133","0.051","","","0.1331","0.1496","","","","","","0.987","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202896","9.245","0.002","10.015","0.003","11.245","0.003","112.38","0.02","92.78","0.02","109.51","0.02","888.8","0.5","173","1","173","1","","","","","","","","4","P -1","-P 1","2","2-(1-Benzyl-1H-indol-3-ylmethylene)-1-aza-bicyclo[2.2.2]octan-3-one","2-(1-Benzyl-1H-indol-3-ylmethylene)-1-aza-bicyclo[2.2.2]octan-3-one","","- C23 H22 N2 O -","- C23 H22 N2 O -","- C46 H44 N4 O2 -","2","1","SU6038","Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.","2-(1-Benzyl-1<i>H</i>-indol-3-ylmethylene)-1-azabicyclo[2.2.2]octan-3-one","Acta Crystallographica Section E","2003","59","10","o1478","o1480","10.1107/S1600536803019809","","","0.71073","MoKα","","0.0893","0.0572","","","0.1104","0.121","","","","","","1.084","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202897","9.427","0.006","11.692","0.007","13.501","0.008","90","","90","","90","","1488.1","1.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-(2-Hydroxynaphthylmethyl)-(L)-proline Methyl Ester","","- C17 H19 N O3 -","- C17 H19 N O3 -","- C68 H76 N4 O12 -","4","1","SU6039","Zheng, Peng-Wu; Li, Chun-Bao","<i>N</i>-(2-Hydroxynaphthylmethyl)-(<i>S</i>)-proline methyl ester","Acta Crystallographica Section E","2003","59","11","o1621","o1623","10.1107/S1600536803019482","","","0.71073","MoKα","","0.1035","0.0526","","","","0.1191","","","","","","1.099","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202898","9.492","0.007","9.803","0.007","10.002","0.007","115.206","0.009","108.078","0.008","92.793","0.01","782.6","1","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Bis(4-aminopyridine)silver(I) trifluoroacetate","","- C12 H12 Ag F3 N4 O2 -","- C12 H12 Ag F3 N4 O2 -","- C24 H24 Ag2 F6 N8 O4 -","2","1","SU6040","Hai-Liang Zhu; Qing-Fu Zeng; Dong-Sheng Xia; Xiu-Ying Liu; Da-Qi Wang","Bis(4-aminopyridine)silver(I) trifluoroacetate","Acta Crystallographica Section E","2003","59","9","m726","m728","10.1107/S1600536803017422","","","0.71073","MoKα","","0.0543","0.0442","","","0.1251","0.1328","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202899","10.9065","0.0006","9.5339","0.0005","9.8977","0.0005","90","","114.125","0.001","90","","939.28","0.09","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H20 Er2 O22 -","- C6 H12 Er2 O22 -","- C12 H24 Er4 O44 -","2","0.5","SU6041","Kalinina, Irina V.; Guschin, Artem L.; Samsonenko, Denis G.; Gerasimenko, Andrey V.; Sokolov, Maxim N.; Fedin, Vladimir P.","Hexaaquatrioxalatodierbium(III) tetrahydrate: [{Er(H~2~O)~3~}~2~(C~2~O~4~)~3~]·4H~2~O","Acta Crystallographica Section E","2003","59","9","m784","m786","10.1107/S1600536803018129","","","0.71073","MoKα","","0.0323","0.0283","","","0.0685","0.0702","","","","","","1.081","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202900","10.906","0.007","7.796","0.005","20.721","0.013","90","","97.131","0.011","90","","1748.1","1.9","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-Bis{2-[(3- cyclohexylaminopropylimino)methyl]phenolato}dithiocyanatonickel(II)","","- C34 H46 N6 Ni O2 S2 -","- C34 H46 N6 Ni O2 S2 -","- C68 H92 N12 Ni2 O4 S4 -","2","0.5","SU6042","Hai-Liang Zhu; Qing-Fu Zeng; Dong-Sheng Xia; Xiu-Ying Liu; Da-Qi Wang","<i>trans</i>-Bis{2-[(3-cyclohexylaminopropylimino)methyl]phenolato}dithiocyanatonickel(II)","Acta Crystallographica Section E","2003","59","9","m777","m779","10.1107/S1600536803018154","","","0.71073","MoKα","","0.0883","0.0453","","","0.1023","0.1453","","","","","","0.943","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202901","19.021","0.004","7.5084","0.0014","9.4038","0.0016","90","","90","","90","","1343","0.4","146","2","146","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","acetamide","","- C2 H5 N O -","- C2 H5 N O -","- C32 H80 N16 O16 -","16","2","SU6043","Bats, Jan W.; Haberecht, Monika C.; Wagner, Matthias","A new refinement of the orthorhombic polymorph of acetamide","Acta Crystallographica Section E","2003","59","10","o1483","o1485","10.1107/S1600536803019494","","","0.71073","MoKα","","0.1092","0.0582","","","0.1036","0.1159","","","","","","1.111","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202902","8.783","0.004","9.064","0.004","10.575","0.005","75.156","0.005","83.105","0.006","61.848","0.005","717.5","0.6","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","hexakis(1H-imidazole-κN^3^)cobalt(II) dichloride tetrahydrate","","- C18 H32 Cl2 Co N12 O4 -","- C18 H32 Cl2 Co N12 O4 -","- C18 H32 Cl2 Co N12 O4 -","1","0.5","SU6044","Zhu, Hai-Liang; Qiu, Xiao-Yang; Zhong-Duo Xiong; You, Zhong-Lu; Da-Qi Wang","Hexakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)cobalt(II) dichloride tetrahydrate","Acta Crystallographica Section E","2003","59","12","m1089","m1090","10.1107/S1600536803024747","","","0.71073","MoKα","","0.0498","0.044","","","0.1261","0.1313","","","","","","1.234","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202903","9.104","0.004","9.349","0.004","9.7","0.004","87.743","0.005","75.674","0.004","61.248","0.005","698.2","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Hexaquairon(II) dinitrate bis(dihexamethylenetetramine) tetrahydrate","","- C12 H44 Fe N10 O16 -","- C12 H44 Fe N10 O16 -","- C12 H44 Fe N10 O16 -","1","0.5","SU6045","Hai-Liang Zhu; Dong-Sheng Xia; Qing-Fu Zeng; Zao-Gui Wang; Da-Qi Wang","Hexaquairon(II) dinitrate bis(dihexamethylenetetramine) tetrahydrate","Acta Crystallographica Section E","2003","59","11","m1020","m1021","10.1107/S160053680302316X","","","0.71073","MoKα","","0.0454","0.0425","","","0.1141","0.1171","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202904","14.4429","0.0019","6.3787","0.0008","8.8867","0.001","90","","99.26","0.014","90","","808.04","0.18","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C5 H10 O3 S2 -","- C5 H10 O3 S2 -","- C20 H40 O12 S8 -","4","1","SU6046","Özcan, Özlem; Gültekin, Zeynep; Frey, Wolfgang; Hökelek, Tuncer","(1<i>RS</i>,3<i>RS</i>)-2-Methoxymethyl-1,3-dithiolane 1,3-dioxide","Acta Crystallographica Section E","2003","59","10","o1541","o1543","10.1107/S1600536803019500","","","0.71073","MoKα","","0.0475","0.0437","","","0.1238","0.1291","","","","","","1.088","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202905","13.933","0.007","19.401","0.01","11.851","0.006","90","","125.907","0.007","90","","2595","2","150","2","150","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","(20S6-tetraMeOH)silver(I) nitrate","(1,4,7,11,14,17-hexathia-9,9,19,19-tetrahydroxymethylcycloicosane)silver(I) nitrate","","- C18 H36 Ag N O7 S6 -","- C18 H36 Ag N O7 S6 -","- C72 H144 Ag4 N4 O28 S24 -","4","0.5","SU6047","Fainerman-Melnikova, Marina; Lindoy, Leonard F.; McMurtrie, John C.; Setzer, William N.","(1,4,7,11,14,17-Hexathia-9,9,19,19-tetrahydroxymethylcycloicosane)silver(I) nitrate","Acta Crystallographica Section E","2003","59","10","m880","m882","10.1107/S1600536803019561","","","0.71073","MoKα","","0.0512","0.0497","","","0.1222","0.1227","","","","","","1.244","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202906","6.1921","0.0001","11.9609","0.0003","16.5666","0.0003","90","","90","","90","","1226.97","0.04","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","1,3-Di-2-pyridylthiourea monohydrate","","- C11 H12 N4 O S -","- C11 H12 N4 O S -","- C44 H48 N16 O4 S4 -","4","1","SU6048","Zhong, Hui-Ping; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","1,3-Di-2-pyridylthiourea monohydrate","Acta Crystallographica Section E","2003","59","11","o1596","o1598","10.1107/S1600536803021597","","","0.71073","MoKα","","0.049","0.041","","","0.085","0.089","","","","","","0.95","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202907","5.1041","0.0002","20.3859","0.0007","15.3378","0.0005","90","","96.279","0.002","90","","1586.35","0.1","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-Amino-1,3-benzothiazole-2(3H)-thione","","- C7 H6 N2 S2 -","- C7 H6 N2 S2 -","- C56 H48 N16 S16 -","8","2","SU6049","Zhong, Hui-Ping; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","5-Amino-1,3-benzothiazole-2(3<i>H</i>)-thione","Acta Crystallographica Section E","2003","59","11","o1599","o1600","10.1107/S1600536803021603","","","0.71073","MoKα","","0.091","0.056","","","0.111","0.125","","","","","","0.95","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202908","17.3365","0.0002","20.7247","0.0002","17.8135","0.0002","90","","109.969","0.001","90","","6015.48","0.12","150","1","150","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Aqua[N,N',N'',N'''-tetrakis(2-hydroxyethyl)-1,4,7,10- tetrazacyclododecane-κ^4^N]neodymium(III) tris(perchlorate) 1.25-hydrate","","- C16 H40.5 Cl3 N4 Nd O18.25 -","- C16 H40.5 Cl3 N4 Nd O18.25 -","- C128 H324 Cl24 N32 Nd8 O146 -","8","2","SU6052","Richards-Johnson, Roxan U.; Kahwa, Ishenkumba A.; Lough, Alan J.","Aqua[<i>N,N</i>',<i>N</i>'',<i>N</i>'''-tetrakis(2-hydroxyethyl)-1,4,7,10-tetrazacyclododecane-κ^4^<i>N</i>]neodymium(III) tris(perchlorate) 1.25-hydrate","Acta Crystallographica Section E","2003","59","11","m1022","m1024","10.1107/S1600536803023018","","","0.71073","MoKα","","0.0441","0.0328","","","0.0755","0.0817","","","","","","1.053","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2202909","16.9245","0.0003","7.6655","0.0002","19.2417","0.0004","90","","112.672","0.0009","90","","2303.41","0.09","150","1","150","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","μ-chloro-μ-methoxy-bis[chloro(di-2-pyridylamine)copper(II)]","","- C21 H21 Cl3 Cu2 N6 O -","- C21 H21 Cl3 Cu2 N6 O -","- C84 H84 Cl12 Cu8 N24 O4 -","4","0.5","SU6053","Zeng, Xi-Rui; Peng, Shie-Ming; Lee, Gene-Hsiang","The binuclear copper(II) complex μ-chloro-μ-methoxy-bis[chloro(di-2-pyridylamine)copper(II)]","Acta Crystallographica Section E","2003","59","12","m1168","m1170","10.1107/S1600536803026151","","","0.71073","MoKα","","0.0676","0.0422","","","0.0879","0.0958","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202910","10.789","0.005","11.212","0.005","19.071","0.005","96.831","0.005","105.521","0.005","90.594","0.005","2204.9","1.5","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","1,5-Di-tert-butyl-3,3,7,7,10,10-hexaphenyl-2,4,6,8,9,11-hexaoxa-3,7,10- trisila-1,5-digerma-bicyclo[3.3.3]undecane","","- C44 H48 Ge2 O6 Si3 -","- C44 H48 Ge2 O6 Si3 -","- C88 H96 Ge4 O12 Si6 -","2","1","SU6055","Mehmet Akkurt; Sema Öztürk; Tevfik Rıza Kök; Frank W. Heinemann; Sybille Franken; Heinrich Puff","1,5-Di-<i>tert</i>-butyl-3,3,7,7,10,10-hexaphenyl-2,4,6,8,9,11-hexaoxa-3,7,10-trisila-1,5-digermabicyclo[3.3.3]undecane","Acta Crystallographica Section E","2003","59","12","m1146","m1148","10.1107/S1600536803026217","","","0.71073","MoKα","","0.1263","0.0499","","","0.0886","0.1085","","","","","","0.948","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202911","6.44","0.0002","8.9128","0.0003","14.9957","0.0005","99.7048","0.0011","93.1574","0.0012","97.7776","0.0018","837.93","0.05","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H23 As N2 O5 -","- C14 H23 As N2 O5 -","- C28 H46 As2 N4 O10 -","2","1","SU6056","Lee, Clare; Harrison, William T. A.","Bis(benzylammonium) hydrogenarsenate monohydrate","Acta Crystallographica Section E","2003","59","12","m1151","m1153","10.1107/S1600536803026242","","","0.71073","MoKα","","0.0492","0.045","","","0.1085","0.112","","","","","","1.019","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202912","6.2122","0.0007","10.8899","0.0012","13.058","0.0014","84.042","0.008","84.028","0.009","82.499","0.009","867.41","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-[4-(2-Chlorophenyl)piperazinomethyl]-5-methyl-1-benzoxazolin-2(3H)-one","","- C19 H20 Cl N3 O2 -","- C19 H20 Cl N3 O2 -","- C38 H40 Cl2 N6 O4 -","2","1","SU6057","Yavuz Koysal; Şamil Işık; Meriç Köksal; Hakkı Erdog̃an; Nesrin Gökhan","3-[4-(2-Chlorophenyl)piperazinomethyl]-5-methyl-1-benzoxazolin-2(3<i>H</i>)-one","Acta Crystallographica Section E","2003","59","12","o1975","o1976","10.1107/S1600536803026230","","","0.71073","MoKα","","0.0456","0.0402","","","0.1234","0.1275","","","","","","1.128","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202913","7.9294","0.0001","11.3305","0.0001","18.5387","0.0001","90","","98.707","0.001","90","","1646.4","0.03","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(1-Methylimidazole)(N-salicylidene-rac-glutamato)copper(II)","","- C16 H17 Cu N3 O5 -","- C16 H17 Cu N3 O5 -","- C64 H68 Cu4 N12 O20 -","4","1","SU6058","Vratislav Langer; Eva Scholtzová; Dalma Gyepesová; Mária Kohútová; Aladár Valent","(1-Methylimidazole)(<i>N</i>-salicylidene-<i>rac</i>-glutamato)copper(II)","Acta Crystallographica Section E","2003","59","12","m1181","m1183","10.1107/S1600536803026424","","","0.71073","MoKα","","0.0611","0.0409","","","0.1289","0.1444","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202914","10.0967","0.001","21","0.002","27.39","0.003","90","","90","","90","","5807.5","1","294","2","294","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C57 H49 Cl3 N2 O14 P2 -","- C57 H49 Cl3 N2 O14 P2 -","- C228 H196 Cl12 N8 O56 P8 -","4","1","TK6106","Chen,Hua; Wu, Jing; Guo, Rongwei; Yeung, Chihung; Zhou, Zhongyuan","(<i>S</i>)-2,2',6,6'-Tetramethoxy-4,4'-bis(diphenylphosphino)-3,3'-bipyridine‒(2<i>S</i>,3<i>S</i>)-(+)-dibenzoyl-<small>L</small>-tartaric acid‒chloroform (1/1/1)","Acta Crystallographica Section E","2003","59","9","o1254","o1256","10.1107/S1600536803016623","","","0.71073","MoKα","","0.084","0.053","","","0.134","0.147","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","201210","2020-10-21","18:00:00",""
"2202915","5.787","0.001","10.218","0.002","10.501","0.002","109.39","0.02","94.41","0.02","100.04","0.01","570.6","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","N-Ethoxycarbonyl-N'-phenylthiourea","","- C10 H12 N2 O2 S -","- C10 H12 N2 O2 S -","- C20 H24 N4 O4 S2 -","2","1","TK6108","Zhang, You-Ming; Wei, Tai-Bao; Xian, Liang; Lin, Qi; Yu, Kai-Bei","<i>N</i>-Ethoxycarbonyl-<i>N</i>'-phenylthiourea","Acta Crystallographica Section E","2003","59","7","o905","o906","10.1107/S1600536803011607","","","0.71073","MoKα","","0.046","0.036","","","0.092","0.096","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202916","10.2642","0.0014","15.166","0.002","14.2695","0.0019","90","","109.001","0.003","90","","2100.3","0.5","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Dichloro[tris(methylpyridyl)amine]cobalt(III) perchlorate hemihydrate","","","- C18 H18 Cl3 Co N4 O4.5 -","- C18 H19 Cl3 Co N4 O4.5 -","- C72 H76 Cl12 Co4 N16 O18 -","4","1","TK6111","Failes, Timothy W.","Dichloro[tris(methylpyridyl)amine]cobalt(III) perchlorate hemihydrate","Acta Crystallographica Section E","2003","59","8","m616","m617","10.1107/S1600536803014545","","","0.71073","MoKα","","0.031","0.025","","","0.071","0.074","","","","","","1.03","","","","has coordinates,has disorder","189124","2020-10-21","18:00:00",""
"2202917","7.1436","0.0008","8.1394","0.0009","15.2836","0.0017","90","","93.333","0.002","90","","887.16","0.17","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","(8-quinolyl)urea, 8-ureidoquinoline","8-quinolinylurea","","- C10 H9 N3 O -","- C10 H9 N3 O -","- C40 H36 N12 O4 -","4","1","TK6113","Graham Smith; Urs D. Wermuth; Jonathan M. White","8-Quinolinylurea","Acta Crystallographica Section E","2003","59","7","o972","o974","10.1107/S1600536803012479","","","0.71073","MoKα","","0.065","0.044","","","0.09","0.098","","","","","","0.97","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202918","14.391","0.002","11.418","0.001","22.908","0.003","90","","95.08","0.01","90","","3749.4","0.8","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaquabis(4,4'-bipyridine)zinc bis(2,4,6-trinitrophenolate) dihydrate","","- C32 H28 N10 O18 Zn -","- C32 H28 N10 O18 Zn -","- C128 H112 N40 O72 Zn4 -","4","0.5","TK6114","Ng, Seik Weng","Diaquabis(4,4'-bipyridine)zinc bis(2,4,6-trinitrophenolate) dihydrate","Acta Crystallographica Section E","2003","59","7","m452","m453","10.1107/S1600536803012674","","","0.71073","MoKα","","0.131","0.057","","","0.122","0.152","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202919","9.2756","0.0015","27.43","0.004","7.8548","0.0012","90","","90","","90","","1998.5","0.5","295","","295","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","N-Allyl-N-(2-nitrobenzenesulfonyl)-L-phenylalanine methyl ester","","- C19 H20 N2 O6 S -","- C19 H20 N2 O6 S -","- C76 H80 N8 O24 S4 -","4","1","TK6115","Sally-Ann Poulsen; Cassandra L. Noack; Peter C. Healy","<i>N</i>-Allyl-<i>N</i>-(2-nitrobenzenesulfonyl)-<small>L</small>-phenylalanine methyl ester","Acta Crystallographica Section E","2003","59","7","o967","o968","10.1107/S160053680301256X","","","0.7107","MoKα","","0.064","0.04","","","0.111","0.123","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202920","10.619","0.002","10.63","0.002","13.586","0.003","95.19","0.03","95.56","0.03","104.94","0.03","1464.1","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H30 Cd N4 O10 -","- C28 H30 Cd N4 O10 -","- C56 H60 Cd2 N8 O20 -","2","1","TK6116","Jin Yang; Jian-Fang Ma; Li Li; Jing-Fu Liu","An aquacadmium(II) complex of 1,10-phenanthroline with a fumarate counter-ion","Acta Crystallographica Section E","2003","59","8","m568","m570","10.1107/S1600536803014624","","","0.71073","MoKα","","0.038","0.032","","","0.096","0.107","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202921","6.5888","0.0009","7.4342","0.001","15.303","0.002","90","","90","","90","","749.58","0.17","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1R*,5S*,6S*,7R*)-6,7-Dihydroxy-6-hydroxymethyl-2-oxabicyclo[3.2.0]heptan-3-one","","- C7 H10 O5 -","- C7 H10 O5 -","- C28 H40 O20 -","4","1","TK6117","Caddy, Judy; Williams, D. Bradley G.; Roodt, Andreas; Muller, Alfred","(1<i>R</i>*,5<i>S</i>*,6<i>S</i>*,7<i>R</i>*)-6,7-Dihydroxy-6-hydroxymethyl-2-oxabicyclo[3.2.0]heptan-3-one","Acta Crystallographica Section E","2003","59","8","o1095","o1097","10.1107/S1600536803014557","","","0.71073","MoKα","","0.043","0.03","","","0.068","0.072","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202922","9.892","0.005","31.185","0.005","10.524","0.005","90","","102.188","0.005","90","","3173","2","180","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H40 N6 O -","- C36 H40 N6 O -","- C144 H160 N24 O4 -","4","1","TK6119","Bjernemose, Jens K.; McKenzie, Christine J.","2,6-Bis[bis(pyridin-2-ylmethyl)aminomethyl]-4-<i>tert</i>-butylphenol","Acta Crystallographica Section E","2003","59","9","o1275","o1276","10.1107/S1600536803016386","","","0.71069","MoKα","","","0.051","","","","0.138","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202923","19.0401","0.0004","14.6334","0.0004","21.249","0.0005","90","","90.5609","0.0012","90","","5920.1","0.2","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C50 H58 Br2 F12 N12 O2 P2 Ru2 -","- C44 H44 Br2 F12 N10 P2 Ru2 -","- C176 H176 Br8 F48 N40 P8 Ru8 -","4","0.5","TK6120","Mirza, Hameed. A; Farah, Abdiaziz A; Stynes, Dennis. V; Lever, A. B. P","Binuclear <i>trans</i>-μ-pyrazine-bis[bromotetrapyridineruthenium(II)] dihexafluorophosphate dimethylformamide disolvate","Acta Crystallographica Section E","2003","59","8","m679","m680","10.1107/S1600536803016398","","","0.71073","MoKα","","0.055","0.042","","","0.108","0.115","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202924","8.5423","0.0002","8.8892","0.0002","10.6486","0.0002","90","","90","","90","","808.59","0.03","123","2","","","","","","","","","","3","P 2 21 21","P 2bc 2","18","","","","- C18 H28 N2 -","- C18 H28 N2 -","- C36 H56 N4 -","2","0.5","TK6121","Fallon, Gary D.; Illesinghe, Jayamini; Campi, Eva M.; Jackson, W. Roy; Robinson, Andrea J.","1,2-Bis[(2<i>R</i>,5<i>R</i>)-2,5-dimethylpyrrolidin-1-yl]benzene","Acta Crystallographica Section E","2003","59","8","o1163","o1164","10.1107/S160053680301537X","","","0.71073","MoKα","","","0.033","","","","0.084","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202925","7.904","0.002","9.166","0.003","16.963","0.005","102.18","0.005","93.697","0.005","94.789","0.005","1192.8","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","4-(2-Chlorophenyl)-3-(2,6-dichlorophenyl)spiroisoxazoline-5,2'- benzo[4,5]imidazo[2,1-b]thiazol-3'-one dioxane hemisolvate","","- C25 H16 Cl3 N3 O3 S -","- C25 H16 Cl3 N3 O3 S -","- C50 H32 Cl6 N6 O6 S2 -","2","1","TK6122","Chen, Hong-Liang; Feng, Ya-Qing; Li, Xiao-Fang; Wang, Guan","4-(2-Chlorophenyl)-3-(2,6-dichlorophenyl)spiroisoxazoline-5,2'-benzo[4,5]imidazo[2,1-<i>b</i>]thiazol-3'-one dioxane hemisolvate","Acta Crystallographica Section E","2003","59","8","o1128","o1129","10.1107/S1600536803015009","","","0.71073","MoKα","","0.079","0.049","","","","0.142","","","","","","1.08","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202926","7.4359","0.001","14.0883","0.0019","17.042","0.002","90","","92.048","0.002","90","","1784.2","0.4","164","2","164","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","η^5^-bis(1,2-(4-nitrophenyl)cyclopentadiene- η^5^cyclopentadieneiron","","- C22 H16 Fe N2 O4 -","- C22 H16 Fe N2 O4 -","- C88 H64 Fe4 N8 O16 -","4","1","TK6123","McAdam, C. John; Robinson, Brian H.; Simpson, Jim","[η^5^-1,2-Bis(4-nitrophenyl)cyclopentadienyl](η^5^-cyclopentadienyl)iron","Acta Crystallographica Section E","2003","59","8","m687","m689","10.1107/S160053680301599X","","","0.71073","MoKα","","0.036","0.027","","","0.074","0.076","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202927","13.4","0.0019","13.4","0.0019","8.2","0.0016","90","","90","","90","","1472.4","0.4","293","2","293","2","","","","","","","","3","P -4 21 c","P -4 2n","114","","Tetrakis(3,5-dimethylphenyl)tin(IV)","","- C32 H36 Sn -","- C32 H36 Sn -","- C64 H72 Sn2 -","2","0.25","TK6124","I. Wharf; Francine Bélanger-Gariépy","Tetrakis(3,5-dimethylphenyl)tin(IV)","Acta Crystallographica Section E","2003","59","8","m661","m663","10.1107/S1600536803016167","","","1.54178","CuKα","","0.043","0.038","","0.102","","0.099","","","1.13","","","1.19","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202928","18.547","0.011","5.539","0.003","15.303","0.009","90","","105.328","0.008","90","","1516.2","1.5","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","1,4-bis(pyridine-2-aminomethyl)benzene","","- C18 H18 N4 -","- C18 H18 N4 -","- C72 H72 N16 -","4","0.5","TK6125","Ru-Yi Zou; Feng-Bo Xu; Qing-Shan Li; Hai-Bin Song; Hui Lv; Zheng-Zhi Zhang","1,4-Bis(pyridine-2-aminomethyl)benzene","Acta Crystallographica Section E","2003","59","9","o1312","o1313","10.1107/S1600536803017598","","","0.71073","MoKα","","0.071","0.044","","","0.098","0.111","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202929","10.0023","0.001","23.2203","0.0017","9.2977","0.001","90","","102.368","0.012","90","","2109.3","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Aqua(η^4^‒1,5-cyclooctadiene)[1-(2-methoxyethoxymethyl)- 3,5-dimethylpyrazole]rhodium(I) tetrafluoroborate","","- C17 H30 B F4 N2 O3 Rh -","- C17 H30 B F4 N2 O3 Rh -","- C68 H120 B4 F16 N8 O12 Rh4 -","4","1","TK6126","Boixassa, Anna; Mathieu, Rene; Lugan, Noël; Pons, Josefina; Ros, Josep","Aqua(η^4^-1,5-cyclooctadiene)[1-(2-methoxyethoxymethyl)-3,5-dimethylpyrazole]rhodium(I) tetrafluoroborate","Acta Crystallographica Section E","2003","59","8","m658","m660","10.1107/S1600536803016155","","","0.71073","MoKα","","0.048","0.043","","","0.113","0.117","","","","","","0.99","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202930","8.194","0.002","8.308","0.002","5.463","0.003","106.12","0.03","101.98","0.03","95.69","0.02","344.6","0.2","295","2","293","2","","","","","","","","4","P 1","P 1","1","2-Methoxyphenylhydrazone Dehydroascorbic Acid","(3Z)-5-(1,2-dihydroxyethyl) -2,3,4(5H)-furantrione 3-[(2-methoxyphenyl)hydrazone]","","- C13 H14 N2 O6 -","- C13 H14 N2 O6 -","- C13 H14 N2 O6 -","1","1","TK6128","Tokiko Imai; Yokoyama Yoshihiro; Akiko Sekine; Hidediro Uekusa; Yuji Ohashi","The 2-methoxyphenylhydrazone derivative of dehydroascorbic acid","Acta Crystallographica Section E","2003","59","9","o1241","o1243","10.1107/S1600536803016660","","","0.71069","MoKα","","0.129","0.073","","","0.204","0.221","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202931","24.861","0.008","11.908","0.003","18.139","0.004","90","","100.16","0.02","90","","5286","2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Tetrakis(3,5-dichlorophenyl)tin(IV)","","- C24 H12 Cl8 Sn -","- C24 H12 Cl8 Sn -","- C192 H96 Cl64 Sn8 -","8","1","TK6129","I. Wharf; A.-M. Lebuis","Tetrakis(3,5-dichlorophenyl)tin(IV)","Acta Crystallographica Section E","2003","59","9","m794","m796","10.1107/S1600536803018439","","","0.71069","MoKα","","0.086","0.05","","0.14","","0.123","","","1.06","","","1.13","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202932","11.657","0.003","22.436","0.017","11.209","0.004","90","","115.98","0.02","90","","2635","2","295","","295","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","(bis (diphenylphosphino)methane monoxide)gold(I) bromide","Bromo[(diphenylphosphino-κP)(diphenylphosphinoyl)methane]gold(I) acetonitrile solvate","","- C27 H25 Au Br N O P2 -","- C27 H25 Au Br N O P2 -","- C108 H100 Au4 Br4 N4 O4 P8 -","4","1","TK6130","Michael L. Williams; Sue E. Boyd; Samuel P. C. Dunstan; Deborah L. Slade; Peter C. Healy","Bromo[(diphenylphosphino-κ<i>P</i>)(diphenylphosphinoyl)methane]gold(I) acetonitrile solvate","Acta Crystallographica Section E","2003","59","9","m768","m770","10.1107/S1600536803017732","","","0.7107","MoKα","","0.056","0.03","","","0.072","0.079","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202933","25.3587","0.0002","11.9729","0.0002","15.601","0.0002","90","","127.582","0.001","90","","3753.77","0.1","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H26 N4 O2 S -","- C18 H26 N4 O2 S -","- C144 H208 N32 O16 S8 -","8","1","TK6132","Capuano, Ben; Crosby, Ian T.; Fallon, Gary D.; Lloyd, Edward J.; Yuriev, Elizabeth","2-Methyl-4-(4-methylpiperazin-1-yl)-10<i>H</i>-thieno[2,3-<i>b</i>][1,5]benzodiazepine methanol solvate monohydrate","Acta Crystallographica Section E","2003","59","9","o1367","o1369","10.1107/S1600536803017744","","","0.71073","MoKα","","0.065","0.044","","","0.086","0.092","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202934","10.736","0.004","10.903","0.003","14.802","0.005","86.68","0.03","86.27","0.03","72.46","0.03","1647.2","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H72 N8 Ni2 O26 -","- C56 H72 N8 Ni2 O26 -","- C56 H72 N8 Ni2 O26 -","1","0.5","TK6133","Jian-Fang Ma; Jin Yang; Jing-Fu Liu","A nickel(II) fumarate complex with <i>o</i>-phenanthroline","Acta Crystallographica Section E","2003","59","10","m900","m902","10.1107/S1600536803019408","","","0.71073","MoKα","","0.11","0.057","","","0.125","0.143","","","","","","0.88","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202935","4.7744","0.0003","11.8425","0.0008","8.2904","0.0006","90","","93.142","0.002","90","","468.04","0.05","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Tetra-aqua-bis(acetato-O)-cobalt(II)","","","- C4 H14 Co O8 -","- C4 H14 Co O8 -","- C8 H28 Co2 O16 -","2","0.5","TK6134","Alexandre N. Sobolev; Elguja B. Miminoshvili; Ketevan E. Miminoshvili; Tamara N. Sakvarelidze","Cobalt diacetate tetrahydrate","Acta Crystallographica Section E","2003","59","10","m836","m837","10.1107/S1600536803019093","","","0.71073","MoKα","","0.021","0.018","","","0.046","0.047","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202936","14.968","0.001","8.45","0.001","14.084","0.001","90","","115.19","0.05","90","","1611.9","0.7","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(4-pyridylthioacetato)zinc(II)","","- C14 H12 N2 O4 S2 Zn -","- C14 H12 N2 O4 S2 Zn -","- C56 H48 N8 O16 S8 Zn4 -","4","0.5","TK6144","Zhang, Xian-Ming; Fang, Rui-Qin; Wu, Hai-Shun; Ng, Seik Weng","<i>catena</i>-Poly[bis(4-pyridylthioacetato)zinc(II)]","Acta Crystallographica Section E","2003","59","12","m1194","m1195","10.1107/S1600536803026928","","","0.71073","MoKα","","0.059","0.046","","","0.104","0.109","","","","","","0.83","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2202937","8.5384","0.0019","9.477","0.002","10.42","0.002","97.115","0.017","96.38","0.017","95.024","0.017","827.1","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","(4-Chloromethyl-4-hydroxymethyl-3-phenylthiazolidin-2-ylidene)ammonium chloride acetone solvate","","- C13 H18 Cl2 N2 O2 S -","- C13 H18 Cl2 N2 O2 S -","- C26 H36 Cl4 N4 O4 S2 -","2","1","WK6000","Jonathan D. Crane; Amanda E. Sparke","(4-Chloromethyl-4-hydroxy-3-phenylthiazolidin-2-ylidene)ammonium chloride acetone solvate","Acta Crystallographica Section E","2003","59","11","o1840","o1842","10.1107/S1600536803024346","","","0.71073","MoKα","","0.0895","0.0426","","","0.0982","0.1085","","","","","","0.831","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202938","10.549","0.0008","10.9773","0.0009","11.4134","0.0009","78.991","0.001","71.723","0.001","77.354","0.001","1213.83","0.17","297","2","297","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-trans-2-butenoato-κ^3^O,O,O'-di-μ-trans-2-butenoato-κ^2^O,O'- bis[(trans-2-butenoato-κ^2^O,O')(1,10-phenanthroline- κ^2^N,N')dysprosium(III)] dihydrate","","- C48 H50 Dy2 N4 O14 -","- C48 H46 Dy2 N4 O14 -","- C48 H46 Dy2 N4 O14 -","1","0.5","WK6001","Ricardo Baggio; Perec, Mireille; Garland, Maria Teresa","Di-μ-<i>trans</i>-2-butenoato-κ^3^<i>O,O,O</i>'-di-μ-<i>trans</i>-2-butenoato-κ^2^<i>O,O</i>'-bis[(<i>trans</i>-2-butenoato-κ^2^<i>O,O</i>')(1,10-phenanthroline-κ^2^<i>N,N</i>')dysprosium(III)] dihydrate","Acta Crystallographica Section E","2003","59","12","m1121","m1123","10.1107/S1600536803025352","","","0.71073","MoKα","","0.042","0.0357","","","0.0886","0.0918","","","","","","1.018","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202939","7.948","0.001","10.384","0.002","11.625","0.002","111.707","0.002","96.514","0.002","109.965","0.002","805.6","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Bis[μ-3-phosphonopropionato(2-)]bis[aqua(1,10-phenanthroline)copper(II)]","","- C30 H30 Cu2 N4 O12 P2 -","- C30 H30 Cu2 N4 O12 P2 -","- C30 H30 Cu2 N4 O12 P2 -","1","0.5","WK6004","Zhang, Xian-Ming; Fang, Rui-Qin; Wu, Hai-Shun; Ng, Seik Weng","Bis[μ-3-phosphonopropionato(2‒)]bis[aqua(1,10-phenanthroline)copper(II)]","Acta Crystallographica Section E","2003","59","12","m1149","m1150","10.1107/S1600536803026370","","","0.71073","MoKα","","0.06","0.048","","","0.124","0.133","","","","","","1.05","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2202940","9.818","0.0003","5.676","0.0003","13.006","0.0007","90","","104.22","0.003","90","","702.58","0.06","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Ca K2 O7 P2 -","- Ca K2 O7 P2 -","- Ca4 K8 O28 P8 -","4","1","","Malin Sandström; Andreas Fischer; Dan Boström","CaK~2~P~2~O~7~","Acta Crystallographica, Section E","2003","59","","i139","i141","10.1107/S1600536803021287","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2202941","12.205","0.0016","12.205","0.0016","5.3588","0.0007","90","","90","","90","","798.26","0.18","100","","100","","","","","","","","","6","P -4 21 c","P -4 2n","114","","Diammonium tetrathiocyanatocobaltate(II) tetrahydrate","","- C4 H8 Co N6 O4 S4 -","- C4 H16 Co N6 O4 S4 -","- C8 H32 Co2 N12 O8 S8 -","2","0.25","WM6002","Becker, Steffi; Lerner, Hans-Wolfram; Bolte, Michael","Diammonium tetrathiocyanatocobaltate(II) tetrahydrate","Acta Crystallographica Section E","2003","59","12","i156","i157","10.1107/S1600536803025029","","","0.71073","MoKα","","0.0616","0.0541","","","0.1726","0.1772","","","","","","1.044","","","","has coordinates,has Fobs","189064","2020-10-21","18:00:00",""
"2202942","10.6426","0.0013","7.3564","0.0008","18.467","0.002","90","","101.409","0.009","90","","1417.2","0.3","173","2","173","2","","","","","","","","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","WN6158","Abourichaa, Said; Benchat, Noureddine; Anaflous, Abderahlmane; Melhaoui, Amina; Ben-Hadda, Taibi; Oussaid, Boualem; El Bali, Brahim; Bolte, Michael","5-(2-Chlorobenzyl)-2-(2-hydroxyethyl)-6-methylpyridazin-3(2<i>H</i>)-one","Acta Crystallographica Section E","2003","59","7","o1041","o1042","10.1107/S1600536803011462","","","0.71073","MoKα","","0.0652","0.0362","","","0.0717","0.0782","","","","","","0.876","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202943","10.5125","0.0008","8.3836","0.0005","11.2817","0.0009","90","","90","","90","","994.29","0.12","110","2","110","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C8 H10 Br2 O4 -","- C8 H10 Br2 O4 -","- C32 H40 Br8 O16 -","4","0.5","WN6160","Echeverría, Gustavo A.; Goeta, Andrés; Barón, Máximo; Punte, Graciela","<i>trans</i>-1,4-Dibromocyclohexane-1,4-dicarboxylic acid","Acta Crystallographica Section E","2003","59","7","o959","o961","10.1107/S160053680301239X","","","0.71073","MoKα","","0.0363","0.0265","","","0.0709","0.0773","","","","","","1.061","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202944","6.748","0.004","7.87","0.004","11.474","0.007","99.23","0.04","103","0.05","102.69","0.03","564.9","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C11 H16 O S2 -","- C11 H16 O S2 -","- C22 H32 O2 S4 -","2","1","WN6163","Gültekin, Zeynep; Adams, Harry; Hökelek, Tuncer","(1<i>RS</i>,4<i>RS</i>)-1-Methoxyspiro[bicyclo[2.2.2]oct-5-ene-2,2'-[1',3']dithiolane]","Acta Crystallographica Section E","2003","59","7","o926","o928","10.1107/S1600536803012005","","","0.71073","MoKα","","0.0754","0.0545","","","0.114","0.1267","","","","","","0.995","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202945","5.7016","0.001","11.4864","0.0015","11.5542","0.0017","67.953","0.011","81.158","0.013","79.379","0.015","686.37","0.19","293","2","293","2","","","","","","","","4","P 1","P 1","1","","","","- C13 H15 N O6 -","- C13 H15 N O6 -","- C26 H30 N2 O12 -","2","2","WN6164","M.Alagar; R.V. Krishnakumar; K.Rajagopal; M. Subha Nandhini; S.Natarajan","<small>L</small>-Phenylalanine fumaric acid","Acta Crystallographica Section E","2003","59","7","o952","o954","10.1107/S1600536803011942","","","0.71073","MoKα","","0.0429","0.0318","","","0.0798","0.0851","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202946","12.7838","0.0007","14.8194","0.0008","13.8905","0.0008","90","","109.677","0.01","90","","2477.9","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","dichlorobis[2-(phenyliminomethyl)pyridine]iron(II) acetonitrile solvate","","- C26 H23 Cl2 Fe N5 -","- C26 H23 Cl2 Fe N5 -","- C104 H92 Cl8 Fe4 N20 -","4","1","WN6165","Rajinder K. Chaggar; John Fawcett; Gregory A. Solan","Dichlorobis(2-formylpyridineanil)iron(II) acetonitrile solvate","Acta Crystallographica Section E","2003","59","7","m462","m463","10.1107/S1600536803012467","","","0.71073","MoKα","","0.0378","0.0325","","","0.0809","0.0834","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202947","35.857","0.006","7.4806","0.0008","7.6783","0.0012","90","","93.192","0.018","90","","2056.4","0.5","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","L-Histidinium hemihydrochloride tartrate tartaric acid dihydrate","","- C14 H25.5 Cl0.5 N3 O16 -","- C14 H25 Cl0.5 N3 O16 -","- C56 H100 Cl2 N12 O64 -","4","1","WN6166","K. Rajagopal; R. V. Krishnakumar; M. Subha Nandhini; S. Natarajan","<small>L</small>-Histidinium hemihydrochloride tartrate tartaric acid dihydrate","Acta Crystallographica Section E","2003","59","7","o955","o958","10.1107/S1600536803012686","","","1.5418","CuKα","","0.0391","0.0383","","","0.1079","0.1092","","","","","","0.948","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202948","6.3488","0.0003","11.3392","0.0005","11.5436","0.0005","90","","103.118","0.0001","90","","809.34","0.06","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H18 Cl4 Co N8 O4 -","- C4 H18 Cl4 Co N8 O4 -","- C8 H36 Cl8 Co2 N16 O8 -","2","0.5","WN6167","Bremner, Colin A.; Harrison, William T. A.","Bis(1-carbamoylguanidinium) diaquatetrachlorocobaltate(II)","Acta Crystallographica Section E","2003","59","7","m467","m469","10.1107/S1600536803012406","","","0.71073","MoKα","","0.0428","0.0268","","","0.0636","0.0683","","","","","","0.956","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202949","10.174","0.004","12.653","0.003","19.559","0.009","90","","90","","90","","2517.9","1.6","298","2","298","2","","","","","","","","4","P c 21 n","P -2n -2ac","33","","","","- C27 H22 Cr O7 -","- C27 H22 Cr O7 -","- C108 H88 Cr4 O28 -","4","1","WN6168","Hansen, Lars Kr.","Pentacarbonyl[ethoxy(2-ethoxy-4,5-diphenyl-1,3-cyclopentadienyl)carbene]chromium(0)","Acta Crystallographica Section E","2003","59","9","m703","m704","10.1107/S1600536803017082","","","0.71069","MoKα","","0.0624","0.0382","","","0.1015","0.1132","","","","","","0.999","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202950","10.575","0.0006","12.8709","0.0007","11.0612","0.0006","90","","103.071","0.001","90","","1466.53","0.14","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1-(4-Hydroxyphenyl)-3-(3,4-dimethoxyphenyl)prop-2-en-1-one","","- C17 H16 O4 -","- C17 H16 O4 -","- C68 H64 O16 -","4","1","WN6169","T. Ravishankar; K.Chinnakali; S. Nanjundan; C. S. Jone Selvamalar; Akilan Ramnathan; Anwar Usman; Hoong-Kun Fun","3-(3,4-Dimethoxyphenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2003","59","8","o1143","o1145","10.1107/S1600536803015186","","","0.71073","MoKα","","0.048","0.0397","","","0.1107","0.119","","","","","","1.049","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202951","13.856","0.002","8.8243","0.0013","24.775","0.004","90","","97.63","0.003","90","","3002.4","0.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1-(4-Aminophenyl)-3-(3,4-dimethoxyphenyl)prop-2-en-1-one","","- C17 H17 N O3 -","- C17 H17 N O3 -","- C136 H136 N8 O24 -","8","1","WN6170","M. Thamarai Selvi; K. Chinnakali; S. Nanjundan; C. S. Jone Selvamalar; Anwar Usman; Hoong-Kun Fun","1-(4-Aminophenyl)-3-(3,4-dimethoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2003","59","8","o1146","o1148","10.1107/S1600536803015198","","","0.71073","MoKα","","0.1164","0.0882","","","0.201","0.2173","","","","","","1.204","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202952","16.682","0.004","10.083","0.003","11.1718","0.0017","90","","108.907","0.002","90","","1777.8","0.7","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H16 N4 O8 S2 Zn -","- C10 H14 N4 O8 S2 Zn -","- C40 H56 N16 O32 S8 Zn4 -","4","1","WN6171","Hong Li; Yue Luo; Duan-Jun Xu; Jing-Yun Wu; Michael Y. Chiang","Aqua(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^<i>N,N</i>')(oxydiacetato-κ^3^<i>O,O</i>',<i>O</i>'')zinc(II) dihydrate","Acta Crystallographica Section E","2003","59","8","m622","m624","10.1107/S1600536803015630","","","0.71069","MoKα","","0.164","0.054","","","0.144","0.189","","","","","","1.012","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202953","22.677","0.004","9.3735","0.0017","26.415","0.005","90","","105.176","0.017","90","","5419","1.8","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tris(2-ammonioethyl)amine tris({2-[(2,6-dichlorophenyl)amino]phenyl}acetate) hexahydrate","","- C48 H63 Cl6 N7 O12 -","- C48 H53 Cl6 N7 O12 -","- C192 H212 Cl24 N28 O48 -","4","1","WN6172","Daniel E. Lynch; Ajmer S. Bening; Simon Parsons","Tris(2-ammonioethyl)amine tris({2-[(2,6-dichlorophenyl)amino]phenyl}acetate) hexahydrate","Acta Crystallographica Section E","2003","59","9","o1314","o1317","10.1107/S1600536803017926","","","0.71073","MoKα","","0.1225","0.0699","","","0.1882","0.2224","","","","","","1.023","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202954","15.3121","0.0011","14.0064","0.001","15.773","0.0011","90","","105.39","0.001","90","","3261.5","0.4","293","","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,2-Diphenyl-1,3,2-dithiagermole-4,5-dicarbonitrile","","- C16 H10 Ge N2 S2 -","- C16 H10 Ge N2 S2 -","- C128 H80 Ge8 N16 S16 -","8","2","WN6173","Mehmet Akkurt; Sema Öztürk; Tevfik Rıza Kök; Hoong-Kun Fun","2,2-Diphenyl-1,3,2-dithiagermole-4,5-dicarbonitrile","Acta Crystallographica Section E","2003","59","8","m664","m665","10.1107/S1600536803016325","","","0.71073","MoKα","","0.1094","0.0449","","","0.0811","0.0999","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202955","9.3947","0.0018","14.195","0.003","11.7723","0.0011","90","","99.213","0.012","90","","1549.7","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H21 N O5 -","- C16 H21 N O5 -","- C64 H84 N4 O20 -","4","1","WN6174","Tuncer Hökelek; Ayşe Uzgören; Yavuz Ergün; Nazan Tunoğlu; Gürol Okay","Dimethyl 7-oxo-3-(pyrrolidin-1-yl)cycloocta-2,8-diene-1,2-dicarboxylate","Acta Crystallographica Section E","2003","59","8","o1220","o1222","10.1107/S1600536803016301","","","0.71073","MoKα","","0.1764","0.0441","","","0.072","0.0989","","","","","","0.914","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202956","6.198","0.005","19.476","0.013","12.273","0.01","90","","94.21","0.06","90","","1478","2","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Dicarbonyl(η^2^-cis-cyclooctene)(η^5^-methylcyclopentadienyl)manganese(I)","","- C16 H21 Mn O2 -","- C16 H21 Mn O2 -","- C64 H84 Mn4 O8 -","4","1","WN6175","Crocock, Barry; Long, Conor; Howie, R. Alan","Dicarbonyl(η^2^-<i>cis</i>-cyclooctene)(η^5^-methylcyclopentadienyl)manganese(I)","Acta Crystallographica Section E","2003","59","8","m676","m678","10.1107/S160053680301626X","","","0.71073","MoKα","","0.0681","0.0469","","","0.1219","0.1325","","","","","","1.049","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202957","7.8972","0.0009","14.627","0.002","9.5192","0.001","90","","108.739","0.008","90","","1041.3","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C7 H14 O5 S2 -","- C7 H14 O5 S2 -","- C28 H56 O20 S8 -","4","1","WN6177","Gültekin, Zeynep; Frey, Wolfgang; Hökelek, Tuncer","2-Methoxymethyl-1,3-dithiepane 1,1,3,3-tetraoxide","Acta Crystallographica Section E","2003","59","9","o1251","o1253","10.1107/S1600536803016684","","","0.71073","MoKα","","0.0692","0.0347","","","0.0584","0.0678","","","","","","0.99","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202958","7.169","0.001","8.049","0.001","11.858","0.001","89.06","0.01","83.36","0.01","87.22","0.01","678.82","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","ethyl 5-oxotricyclo[4.3.1.1^3,8^]undecane-4-carboxylate difluoroborate","","- C14 H19 B F2 O3 -","- C14 H19 B F2 O3 -","- C28 H38 B2 F4 O6 -","2","1","WN6178","Argay, Gyula; Kálmán, Alajos; Bernáth, Gábor; Cs. Gyarmati, Zsuzsanna","Ethyl (<i>O</i>‒<i>B</i>)-5-(difluoroboryloxy)tricyclo[4.3.1.1^3,8^]undecane-4-carboxylate","Acta Crystallographica Section E","2003","59","10","o1554","o1555","10.1107/S160053680302066X","","","0.7107","MoKα","","0.0893","0.0494","","","0.1583","0.17","","","","","","1.102","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202959","9.846","0.002","10.564","0.002","16.34","0.003","90","","113.023","0.002","90","","1564.2","0.5","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","trans-3-Acetyl-5-benzoyl-2-methyl-4-phenyl-4,5-dihydrofuran","","- C20 H18 O3 -","- C20 H18 O3 -","- C80 H72 O12 -","4","1","WN6179","M. Subha Nandhini; R. V. Krishnakumar; A. Mostad; S. Renuga; S. Selvaraj; S. Perumal; S. Natarajan","<i>trans</i>-3-Acetyl-5-benzoyl-2-methyl-4-phenyl-4,5-dihydrofuran at 150K","Acta Crystallographica Section E","2003","59","9","o1321","o1323","10.1107/S1600536803017938","","","0.71073","MoKα","","0.068","0.051","","","0.1373","0.1493","","","","","","1.082","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202960","11.9","0.005","4.13","0.005","14.085","0.005","90","","105.562","0.005","90","","666.9","0.9","293","","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Amino-4-methyl-thiophene-3-carbonitrile","","- C6 H6 N2 S -","- C6 H6 N2 S -","- C24 H24 N8 S4 -","4","1","WN6180","Çoruh, Ufuk; Ustabaş, Reşat; Tümer, Ferhan; García-Granda, Santiago; Demir, Ümit; Ekinci, Duygu; Yavuz, Metin","2-Amino-4-methylthiophene-3-carbonitrile","Acta Crystallographica Section E","2003","59","9","o1339","o1341","10.1107/S1600536803017549","","","0.71069","MoKα","","0.0765","0.0523","","","0.1413","0.1538","","","","","","1.003","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202961","8.7466","0.001","8.8637","0.001","20.72","0.003","90","","90","","90","","1606.4","0.3","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1,3-dibenzylthymine","","- C19 H18 N2 O2 -","- C19 H18 N2 O2 -","- C76 H72 N8 O8 -","4","1","WN6181","Jin-Chang Ding; Miao-Chang Liu; Hong-Ping Xiao; Mao-Lin Hu","1,3-Dibenzylthymine","Acta Crystallographica Section E","2003","59","10","o1488","o1489","10.1107/S160053680301986X","","","0.71073","MoKα","","0.0545","0.0388","","","0.0909","0.0977","","","","","","0.969","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202962","6.798","0.0006","10.9084","0.0009","25.331","0.002","90","","90","","90","","1878.4","0.3","296","1","296","1","","","","","","","","4","C 2 2 21","C 2c 2","20","","(S,S)-1,2-bis(1-hydrobenzimidazol-2-yl)-1,2-ethanediol","","- C20 H22 N4 O2 -","- C20 H22 N4 O2 -","- C80 H88 N16 O8 -","4","0.5","WN6182","Robert T. Stibrany; Harvey J. Schugar; Joseph A. Potenza","(<i>S,S</i>)-1,2-Bis(1-methylbenzimidazol-2-yl)-1',2'-bis(methoxy)ethane","Acta Crystallographica Section E","2003","59","10","o1448","o1450","10.1107/S1600536803019184","","","0.71073","MoKα","","0.0706","0.0484","","","0.11","0.1201","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202963","13.754","0.002","21.026","0.007","9.1287","0.001","90","","90","","90","","2639.9","1","297","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C29 H40 O7 -","- C29 H40 O7 -","- C116 H160 O28 -","4","1","WN6183","Ohba, Shigeru; Chinen, Ayako; Matsumoto, Yuki; Chida, Noritaka","(+)-(1<i>S</i>,2<i>S</i>,4<i>S</i>,4a<i>R</i>,5<i>R</i>,6<i>S</i>,9<i>S</i>,10<i>S</i>)-4-Benzyloxy-9,10-(carbonyldioxy)-1-methoxymethoxy-4a,6,8,8-tetramethyl-7-methylenedodecahydro-6,9-ethanobenzocyclooctene-5-ol","Acta Crystallographica Section E","2003","59","10","o1476","o1477","10.1107/S1600536803019871","","","0.7107","MoKα","","","0.0422","","","","0.1258","","","","","","1.017","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202964","9.6306","0.0006","15.3825","0.0008","10.8903","0.0006","90","","107.456","0.002","90","","1539.02","0.15","173","","173","","","","","","","","","4","P 1 21 1","P 2yb","4","","trans-2-{[(R)-(+)-1-Phenylethylamino]carbonyl}cyclohexanecarboxylic acid","","- C16 H21 N O3 -","- C16 H21 N O3 -","- C64 H84 N4 O12 -","4","2","WN6184","Kazuyuki Takahashi; Taka-aki Okamura; Hitoshi Yamamoto; Norikazu Ueyama","A 1:1 diastereoisomeric complex of <i>trans</i>-2-{[(<i>R</i>)-(+)-1-phenylethylamino]carbonyl}cyclohexanecarboxylic acid","Acta Crystallographica Section E","2003","59","12","o1953","o1955","10.1107/S160053680302573X","","","0.71069","MoKα","","0.0483","0.0399","","","0.0998","0.1031","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202965","9.068","0.007","8.352","0.003","12.253","0.005","90","","94.15","0.04","90","","925.6","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2,6-dimethylquinolin-4(1H)-one","2,6-dimethylquinolin-4(1H)-one","","- C11 H11 N O -","- C11 H11 N O -","- C44 H44 N4 O4 -","4","1","WN6185","Rajnikant; Dinesh; M.B. Deshmukh; Kamni","2,6-Dimethylquinolin-4(1<i>H</i>)-one","Acta Crystallographica Section E","2003","59","11","o1768","o1769","10.1107/S1600536803023249","","","0.71073","MoKα","","0.055","0.0427","","","0.1215","0.1345","","","","","","1.086","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202966","11.322","0.006","19.903","0.009","25.828","0.016","90","","90","","90","","5820","5","173.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","tert-butoxycarbonyl-L-leucyl-L-alanine ethyl ester","","- C16 H30 N2 O5 -","- C16 H30 N2 O5 -","- C192 H360 N24 O60 -","12","3","WN6186","Oku, Hiroyuki; Yamada, Keiichi; Katakai, Ryoichi","N—H···O=C hydrogen bonding and O···O=C repulsive interactions in <i>tert</i>-butoxycarbonyl-<small>L</small>-leucyl-<small>L</small>-alanine ethyl ester (Boc-<small>L</small>-Leu-<small>L</small>-Ala-OEt)","Acta Crystallographica Section E","2003","59","10","o1581","o1583","10.1107/S1600536803020889","","","1.5418","CuKα","","","0.067","","","","0.159","","","","","","1.431","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202967","5.987","0.004","12.604","0.008","24.469","0.015","90","","90","","90","","1846","2","293","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-tert-Butyl-4-methyl-6-(1-piperidiniomethyl)phenol bromide","","- C17 H28 Br N O -","- C17 H28 Br N O -","- C68 H112 Br4 N4 O4 -","4","1","WN6187","Miao Du; Xiao-Jun Zhao","2-<i>tert</i>-Butyl-4-methyl-6-(1-piperidiniomethyl)phenol bromide","Acta Crystallographica Section E","2003","59","10","o1586","o1588","10.1107/S1600536803021299","","","0.71073","MoKα","","0.133","0.0634","","","0.0987","0.1224","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202968","3.7879","0.0007","10.624","0.002","14.674","0.003","90","","97.416","0.003","90","","585.6","0.2","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Pyridylcarboxylate N-oxide","","- C6 H5 N O3 -","- C6 H5 N O3 -","- C24 H20 N4 O12 -","4","1","WN6188","Miao Du; Xiao-Jun Zhao","3-Carboxypyridine <i>N</i>-oxide: supramolecular aggregation through O—H···O and C—H···O interactions","Acta Crystallographica Section E","2003","59","11","o1645","o1647","10.1107/S1600536803021858","","","0.71073","MoKα","","0.0492","0.0446","","","0.1315","0.1355","","","","","","1.057","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202969","6.0284","0.0004","10.85","0.002","26.921","0.003","90","","90","","90","","1760.9","0.4","293","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H29 F O3 -","- C20 H29 F O3 -","- C80 H116 F4 O12 -","4","1","WN6189","Guilardi, Silvana; Resende, Jackson Antônio Lamounier Camargos; Gambardella, Maria Teresa do Prado; Demuner, Antonio Jacinto; Barbosa, Luis Claudio de Almeida; Piló-Veloso, Dorila","21α-Fluoro-7-nor-12,13,15,16-tetrahydrovouacapane-17β,21α-lactone","Acta Crystallographica Section E","2003","59","12","o1935","o1937","10.1107/S1600536803023997","","","0.71073","MoKα","","","0.0429","","","","0.1073","","","","","","0.999","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202970","20.326","0.004","6.958","0.001","19.219","0.004","90","","117.19","0.03","90","","2417.7","1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Calcium ferron trihydrate","Diaquabis(μ-8-hydroxy-7-iodoquinoline-5-sulfonato)calcium(II) monohydrate","","- C18 H16 Ca I2 N2 O11 S2 -","- C18 H16 Ca I2 N2 O11 S2 -","- C72 H64 Ca4 I8 N8 O44 S8 -","4","1","WN6190","Savarimuthu Francis; Packianathan Thomas Muthiah; Rychlewska, Urszula; Warżajtis, Beata","Interplay of hydrogen bonding and coordination modes in diaquabis(8-hydroxy-7-iodoquinoline-5-sulfonato)calcium(II) monohydrate","Acta Crystallographica Section E","2003","59","12","m1160","m1163","10.1107/S1600536803024000","","","0.71073","MoKα","","0.0722","0.0657","","","0.1009","0.1034","","","","","","1.36","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2202971","11.4561","0.0005","15.1588","0.0007","11.6819","0.0005","90","","116.493","0.001","90","","1815.65","0.14","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-(3-Bromo-1-phenylsulfonyl-1H-indol-2-ylmethyl)-pyrrolidine-2,5-dione","","- C19 H15 Br N2 O4 S -","- C19 H15 Br N2 O4 S -","- C76 H60 Br4 N8 O16 S4 -","4","1","WN6191","T. Ravishankar; K. Chinnakali; N. Arumugam; P. C. Srinivasan; Anwar Usman; Hoong-Kun Fun","1-(3-Bromo-1-phenylsulfonyl-1<i>H</i>-indol-2-ylmethyl)pyrrolidine-2,5-dione","Acta Crystallographica Section E","2003","59","12","o1903","o1906","10.1107/S1600536803024954","","","0.71073","MoKα","","0.0319","0.0255","","","0.0686","0.0713","","","","","","1.052","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202972","7.1114","0.0007","8.3052","0.0008","13.825","0.0013","77.338","0.002","81.395","0.002","65.793","0.002","724.98","0.12","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2a,8a-Dichloro-2a,8a-dihydro-1-phenyldichlorocyclobuta[b]naphthalene-3,8-dione","","- C18 H10 Cl2 O2 -","- C18 H10 Cl2 O2 -","- C36 H20 Cl4 O4 -","2","1","WN6192","Hou-Guang Shi; Xue-Mei Li; Jian-Hua Xu; Shu-Sheng Zhang; Hoong-Kun Fun","2a,8a-Dichloro-2a,8a-dihydro-1-phenyldichlorocyclobuta[<i>b</i>]naphthalene-3,8-dione","Acta Crystallographica Section E","2003","59","11","o1824","o1826","10.1107/S1600536803024012","","","0.71073","MoKα","","0.0608","0.0471","","","0.113","0.128","","","","","","1.151","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202973","10.125","0.005","15.518","0.005","11.398","0.005","90","","95.727","0.005","90","","1781.9","1.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-benzoyl-1-n-butyl-4-phenylpyrimidin-2(1H)-one","","- C21 H20 N2 O2 -","- C21 H20 N2 O2 -","- C84 H80 N8 O8 -","4","1","WN6194","Sevim Türktekin; Mehmet Akkurt; Ísmail Yıldırım; Özen Özgen; Engin Kendi; Yunus Akçamur","5-Benzoyl-1-<i>n</i>-butyl-4-phenylpyrimidin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2003","59","12","o1949","o1950","10.1107/S1600536803025686","","","0.71069","MoKα","","0.1445","0.0616","","","0.1577","0.1969","","","","","","1.001","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202974","10.533","0.0018","5.145","0.003","13.607","0.003","90","","106.018","0.015","90","","708.8","0.5","293","2","","","","","","","","","","3","P 1 21 1","P 2yb","4","","8-Methoxy-4-(4-methoxyphenyl)isochroman-3-ol","","- C17 H18 O4 -","- C17 H18 O4 -","- C34 H36 O8 -","2","1","WN6195","Palusiak, Marcin; Grabowski, Sławomir J.; Epsztajn, Jan; Kowalska, Justyna A.","8-Methoxy-4-(4-methoxyphenyl)isochroman-3-ol","Acta Crystallographica Section E","2003","59","12","o2000","o2002","10.1107/S1600536803026102","","","1.54178","CuKα","","","0.069","","","","0.185","","","","","","1.091","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202975","9.419","0.002","12.97","0.003","13.525","0.003","102.08","0.03","108.64","0.03","109.65","0.03","1378.4","0.8","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","Sperminium tri-tert-butoxysilanethiolate‒2-propanol (1/2)","","- C20 H49 N2 O4 S Si -","- C20 H49 N2 O4 S Si -","- C40 H98 N4 O8 S2 Si2 -","2","1","WN6197","Katarzyna Baranowska; Jaroslaw Chojnacki; Wieslaw Wojnowski; Barbara Becker","Sperminium bis(tri-<i>tert</i>-butoxysilanethiolate)‒2-propanol (1/2)","Acta Crystallographica Section E","2003","59","12","o2022","o2024","10.1107/S1600536803026722","","","0.71073","MoKα","","0.079","0.035","","","0.101","0.131","","","","","","1.004","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202976","5.8866","0.0007","10.8186","0.0012","20.898","0.002","75.096","0.009","85.572","0.01","78.964","0.01","1261.8","0.2","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","8-(4-Methoxyphenyl)-3,5-bis[(E)-1-(4-methoxyphenyl)methylidene]- 1,2,3,5,6,7-hexahydrodicyclopenta[b,e]pyridine","","- C34 H31 N O3 -","- C34 H31 N O3 -","- C68 H62 N2 O6 -","2","1","WN6199","Jonathan D. Crane; John Crompton","8-(4-Methoxyphenyl)-3,5-bis[(<i>E</i>)-1-(4-methoxyphenyl)methylidene]-1,2,3,5,6,7-hexahydrodicyclopenta[<i>b</i>,<i>e</i>]pyridine","Acta Crystallographica Section E","2003","59","12","o2003","o2004","10.1107/S1600536803026758","","","0.71073","MoKα","","0.109","0.0546","","","0.1333","0.1443","","","","","","0.92","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202977","6.2061","0.0001","14.0232","0.0003","15.8208","0.0004","90","","101.051","0.001","90","","1351.34","0.05","90","0.2","90","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Z)-2-(2,4-Dimethoxybenzylidene)-1-aza-bicyclo[2.2.2]octan-3-ol","","- C16 H21 N O3 -","- C16 H21 N O3 -","- C64 H84 N4 O12 -","4","1","WN6200","Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.","(<i>Z</i>)-2-(2,4-Dimethoxybenzylidene)-1-azabicyclo[2.2.2]octan-3-ol","Acta Crystallographica Section E","2003","59","12","o2010","o2012","10.1107/S1600536803026825","","","0.71073","MoKα","","0.0715","0.0474","","","0.1181","0.1303","","","","","","1.486","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202978","10.1385","0.0001","22.5901","0.0005","21.0672","0.0005","90","","94.86","0.001","90","","4807.67","0.16","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48 H48 F6 N8 O2 Ru2 Sb -","- C48 H44 F6 N8 O2 Ru2 Sb -","- C192 H176 F24 N32 O8 Ru8 Sb4 -","4","1","WW6071","Gao, LiBin; Zhang, Liyi; Chen, Zhongning","Tetrakis(μ~2~-anilinopyridinato-κ^2^<i>N</i>:<i>N</i>')aquadiruthenium(II,III) hexafluoroantimonate diethyl ether solvate","Acta Crystallographica Section E","2003","59","7","m419","m420","10.1107/S1600536803011760","","","0.71073","MoKα","","0.1343","0.0862","","","0.1676","0.1991","","","","","","1.167","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2202979","10.5127","0.0002","23.6279","0.0005","13.775","0.0002","90","","108.019","0.0003","90","","3253.8","0.1","223.2","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C36 H24 Cl2 F6 Ir N4 P -","- C36 H24 Cl2 F6 Ir N4 P -","- C144 H96 Cl8 F24 Ir4 N16 P4 -","4","1","WW6089","Naokazu Yoshikawa; Jun Sakamoto; Nobuko Kanehisa; Yasushi Kai; Takeko Matsumura-Inoue; Hiroshi Takashima; Keiichi Tsukahara","<i>cis</i>-Dichlorobis(2,2'-biquinoline)iridium(III) hexafluorophosphate","Acta Crystallographica Section E","2003","59","7","m551","m552","10.1107/S1600536803014235","","","0.7107","MoKα","","","0.0364","","","","0.0972","","","","","","1.302","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202980","18.835","0.0018","9.3507","0.0009","11.643","0.002","90","","94.653","0.011","90","","2043.8","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","1,2-bis(3-methylbenzothien-2-yl)perfluorocyclopentene","3,3,4,4,5,5-Hexafluoro-1,2-bis(3-methylbenzo[b]-2-thienyl)cyclopentene","","- C23 H14 F6 S2 -","- C23 H14 F6 S2 -","- C92 H56 F24 S8 -","4","0.5","WW6092","Sun, Fan; Zhang, Fushi; Wang, Ruji; Zhao, Fuqun; Pu, Shouzhi","3,3,4,4,5,5-Hexafluoro-1,2-bis(3-methylbenzo[<i>b</i>]-2-thienyl)cyclopentene","Acta Crystallographica Section E","2003","59","7","o981","o982","10.1107/S1600536803013126","","","0.71073","MoKα","","0.0803","0.0614","","","0.1095","0.1189","","","","","","1.001","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202981","6.067","0.002","14.099","0.005","7.733","0.003","90","","97.101","0.006","90","","656.4","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1,4-Bis(thiazol-2-ylsulfanyl)butane","2,2'-[(1,4-Butanediyl)dithio]dithiazole","","- C10 H12 N2 S4 -","- C10 H12 N2 S4 -","- C20 H24 N4 S8 -","2","0.5","WW6095","Xin, Ying; Liu, Hui-Min; Zhang, Wei; Zhang, Wen-Qin","2,2'-(1,4-Butanediyldithio)-1,3-dithiazole","Acta Crystallographica Section E","2003","59","8","o1153","o1154","10.1107/S1600536803015204","","","0.71073","MoKα","","0.0448","0.0303","","","","0.0764","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202982","12.216","0.004","17.801","0.005","12.528","0.004","90","","93.42","0.006","90","","2719.4","1.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,4,6-Trimethyl-1,3,5-tris(4-methylthiazol-2-ylsulfanylmethyl)benzene","","- C24 H27 N3 S6 -","- C24 H27 N3 S6 -","- C96 H108 N12 S24 -","4","1","WW6097","Liu, Hui-Min; Zhang, Wei; Zhang, Wen-Qin","2,4,6-Trimethyl-1,3,5-tris(4-methylthiazol-2-ylsulfanylmethyl)benzene","Acta Crystallographica Section E","2003","59","9","o1249","o1250","10.1107/S1600536803016829","","","0.71073","MoKα","","0.1471","0.0589","","","0.0905","0.114","","","","","","1.002","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202983","6.546","0.0006","9.4402","0.0008","15.684","0.0014","87.438","0.002","88.035","0.002","81.046","0.002","956.07","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H16 Cl Cu N3 O4 -","- C20 H16 Cl Cu N3 O4 -","- C40 H32 Cl2 Cu2 N6 O8 -","2","1","WW6098","Zhou, Yi-Li; He, Hong-Yin; Zhang, Yan; Zhu, Long-Guan","Aquachloro(4-cyanobenzoato-κ<i>O</i>)(1,10-phenanthroline-κ^2^<i>N,N</i>')copper(II) monohydrate","Acta Crystallographica Section E","2003","59","8","m605","m607","10.1107/S1600536803015605","","","0.71073","MoKα","","0.0388","0.0341","","","0.0856","0.0877","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202984","10.036","0.002","11.435","0.003","11.989","0.003","105.586","0.004","105.443","0.004","90.646","0.004","1272.3","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(N-cyclohexyl-N-ethyldithiocarbamato)triphenyltin(IV)","","- C27 H31 N S2 Sn -","- C27 H31 N S2 Sn -","- C54 H62 N2 S4 Sn2 -","2","1","WW6099","Normah Awang; Ibrahim Baba; M. Sukeri M. Yusof; Bohari M. Yamin","(<i>N</i>-Cyclohexyl-<i>N</i>-ethyldithiocarbamato)triphenyltin(IV)","Acta Crystallographica Section E","2003","59","8","m594","m595","10.1107/S1600536803015277","","","0.71073","MoKα","","0.027","0.025","","","0.07","0.071","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202985","15.4858","0.0006","9.7359","0.0004","14.7769","0.0008","90","","90","","90","","2227.89","0.17","223","2","223","2","","","","","","","","5","I b a 2","I 2 -2c","45","","","","- C24 H16 Co N11 O3 -","- C24 H16 Co N11 O3 -","- C96 H64 Co4 N44 O12 -","4","0.5","WW6100","Zhao, Qihua; Wang, Xiaofeng; Fang, Ruibin; Tiekink, Edward R. T.","Diazidobis(1,10-phenathroline)cobalt(III) nitrate","Acta Crystallographica Section E","2003","59","8","m690","m691","10.1107/S1600536803016489","","","0.71069","MoKα","","0.038","0.033","","","0.08","0.082","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202986","7.814","0.005","10.085","0.005","15.124","0.005","90","0.005","90.178","0.005","90","0.005","1191.8","1","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","anhydrofulvic acid","7,8-Dihydroxy-3-methyl-10-oxo-1H,10H-pyrano[4,3-b]chromene-9-carboxylic acid","","- C14 H10 O7 -","- C14 H10 O7 -","- C56 H40 O28 -","4","1","WW6101","Wang, Jian-Feng; Zhang, Yong-Jie; Fang, Mei-Juan; Huang, Yao-Jian; Wei, Zan-Bin; Zheng, Zhong-Hui; Su, Wen-Jin; Zhao, Yu-Fen","7,8-Dihydroxy-3-methyl-10-oxo-1<i>H</i>,10<i>H</i>-pyrano[4,3-<i>b</i>]chromene-9-carboxylic acid","Acta Crystallographica Section E","2003","59","9","o1244","o1245","10.1107/S1600536803016714","","","0.71069","MoKα","","0.0437","0.0368","","","0.1134","0.1185","","","","","","1.092","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202987","9.959","0.005","10.77","0.005","13.407","0.007","98.34","0.011","104.132","0.012","105.691","0.012","1307.8","1.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3,3'-(1,4-Naphthalenedimethylene)bis(1-ethylimidazolium) diiodide methanol solvate","","- C23 H30 I2 N4 O -","- C23 H30 I2 N4 O -","- C46 H60 I4 N8 O2 -","2","1","WW6102","Zou, Ru-Yi; Xu, Feng-Bo; Li, Qing-Shan; Zhang, Zheng-Zhi","3,3'-(1,4-Naphthalenedimethylene)bis(1-ethylimidazolium) diiodide methanol solvate","Acta Crystallographica Section E","2003","59","10","o1451","o1452","10.1107/S1600536803016933","","","0.71073","MoKα","","0.1215","0.0681","","","0.1537","0.1843","","","","","","0.953","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202988","6.963","0.001","8.957","0.002","13.594","0.003","90.16","0.02","103.11","0.02","109.6","0.02","775","0.3","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","4-(3,4-methylenedioxyphenyl)-7,7-dimethyl-5-oxo-3,4,5,6,7,8-hexahydrocoumarin","","- C18 H18 O5 -","- C18 H18 O5 -","- C36 H36 O10 -","2","1","WW6104","Wu, Hui; Shi, Daqing; Chen, Jing; Wang, Xiangshan; Zhuang, Qiya; Hu, Hongwen","4-(3,4-Methylenedioxyphenyl)-7,7-dimethyl-5-oxo-3,4,5,6,7,8-hexahydrocoumarin","Acta Crystallographica Section E","2003","59","9","o1265","o1266","10.1107/S1600536803016945","","","0.71073","MoKα","","0.0569","0.0382","","","0.0949","0.1015","","","","","","1.025","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2202989","8.538","0.003","9.488","0.003","14.227","0.005","86.206","0.006","73.315","0.006","64.091","0.005","990.7","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H20 N4 O2 S -","- C22 H20 N4 O2 S -","- C44 H40 N8 O4 S2 -","2","1","WW6106","Li, Xiao-Fang; Feng, Ya-Qing; Shi,Da-Xin; Li, Gang","1'-Methyl-5'-phenyl-2'',3'',5'',6''-tetrahydroindoline-3-spiro-3'-pyrrolidine-4'-spiro-2''-imidazo[2,1-<i>b</i>]thiazole-2,3''-dione","Acta Crystallographica Section E","2003","59","9","o1288","o1289","10.1107/S160053680301746X","","","0.71073","MoKα","","0.0587","0.0408","","","","0.101","","","","","","1.029","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202990","17.5517","0.0006","9.3166","0.0006","7.171","0.0004","90","","110.86","0.002","90","","1095.76","0.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-poly[[(2,2'-bipyridine)cadmium(II)]-di-μ-chloro]","","- C10 H8 Cd Cl2 N2 -","- C10 H8 Cd Cl2 N2 -","- C40 H32 Cd4 Cl8 N8 -","4","0.5","WW6107","Zhou, You-Fu; Xu, Ying; Yuan, Da-Qiang; Hong, Mao-Chun","The chain structure of <i>catena</i>-poly[[(2,2'-bipyridine)cadmium(II)]-di-μ-chloro]","Acta Crystallographica Section E","2003","59","9","m821","m823","10.1107/S1600536803018622","","","0.71073","MoKα","","","0.025","","","0.062","0.065","","","","","","1.121","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202991","10.085","0.003","29.272","0.009","8.561","0.003","90","","99.287","0.006","90","","2494.2","1.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H23 Cl N4 O3 S -","- C28 H23 Cl N4 O3 S -","- C112 H92 Cl4 N16 O12 S4 -","4","1","WW6108","Li, Xiao-Fang; Feng, Ya-Qing; Li, Gang; Wang, Guan","5'-(2-Chlorophenyl)-1'-methyl-2'',3''-dihydroindoline-3-spiro-3'-pyrrolidine-4'-spiro-2''-(1,3-benzimidazo[2,1-<i>b</i>]thiazole)-2,3''-dione dioxane hemisolvate","Acta Crystallographica Section E","2003","59","9","o1307","o1308","10.1107/S1600536803017471","","","0.71073","MoKα","","0.1263","0.0571","","","","0.1043","","","","","","1.024","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2202992","9.286","0.0001","19.433","0.0003","13.698","0.0002","90","","104.238","0.001","90","","2395.94","0.06","150","2","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C52 H70 N2 P2 Pt -","- C52 H70 N2 P2 Pt -","- C104 H140 N4 P4 Pt2 -","2","0.5","WW6109","Khan, Muhammad S.; Al-Saadi, Rahma K. M.; Male, Louise; Raithby, Paul R.; Bjernemose, Jens","<i>trans</i>-Bis(carbazol-3-ylethynyl)bis(tri-<i>n</i>-butylphosphine)platinum(II)","Acta Crystallographica Section E","2003","59","9","m774","m776","10.1107/S1600536803017872","","","0.71073","MoKα","","","0.0243","","","","0.0615","","","","","","1.034","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202993","33.402","0.003","5.8135","0.0004","22.8511","0.0017","90","","98.394","0.002","90","","4389.8","0.6","150","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H17 N Si -","- C17 H17 N Si -","- C204 H204 N12 Si12 -","12","3","WW6110","Khan, Muhammad S.; Male, Louise; Raithby, Paul R.; Teat, Simon J.; Bond, Andrew D.","3-(Trimethylsilylethynyl)carbazole","Acta Crystallographica Section E","2003","59","9","o1342","o1344","10.1107/S1600536803017963","","","0.688","Synchrotron","","","0.0813","","","","0.1866","","","","","","1.135","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202994","9.802","0.005","24.879","0.013","10.425","0.006","90","","115.849","0.007","90","","2288","2","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(N-(2-(2-hydroxyethylamino)ethyl)salicylideneimine)cobalt(III) chloride","","- C22 H30 Cl Co N4 O4 -","- C22 H30 Cl Co N4 O4 -","- C88 H120 Cl4 Co4 N16 O16 -","4","1","WW6111","Zhu, Hai-Liang; Lin, Yong-Shan; Meng, Fan-Jin; Zou, Ying; Wang, Da-Qi","Bis(<i>N</i>-(2-(2-hydroxyethylamino)ethyl)salicylideneimine)cobalt(III) chloride","Acta Crystallographica Section E","2003","59","10","m878","m879","10.1107/S160053680301955X","","","0.71073","MoKα","","0.0685","0.0407","","","0.0921","0.1134","","","","","","0.966","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202995","14.144","0.002","10.6484","0.0015","12.2202","0.0019","90","","101.356","0.003","90","","1804.5","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H16 Mn N4 O10 -","- C12 H16 Mn N4 O10 -","- C48 H64 Mn4 N16 O40 -","4","0.5","WW6112","Wang, Wenguo; Ma, Chengbing; Chen, Feng; Chen,Changneng; Liu, Qiutian","Tetraaqua(1,10-phenanthroline-<i>N,N</i>')manganese(II) dinitrate","Acta Crystallographica Section E","2003","59","10","m908","m910","10.1107/S1600536803019767","","","0.71073","MoKα","","","0.0574","","","0.1064","0.1314","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2202996","22.329","0.002","6.9918","0.0019","11.3456","0.0008","90","","92.646","0.007","90","","1769.4","0.5","295","2","295","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","guanidinium 8-hydroxy-7-iodoquinoline-5-sulfonate hydrate","","","- C11 H18 I N7 O5 S -","- C11 H18 I N7 O5 S -","- C44 H72 I4 N28 O20 S4 -","4","1","WW6113","Smith, Graham; Wermuth, Urs D.; Healy, Peter C.","Guanidinium 8-hydroxy-7-iodoquinoline-5-sulfonate monohydrate","Acta Crystallographica Section E","2003","59","10","o1455","o1457","10.1107/S1600536803019275","","","0.7107","MoKα","","0.0408","0.0336","","","0.0911","0.0954","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202997","13.507","0.003","18.359","0.004","17.968","0.004","90","","95.409","0.005","90","","4435.8","1.7","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[(μ-9,10-bis(N-(n-propyl)aminomethyl)anthracene) tetra(2-(diphenyl phosphino)-6-chloro pyridine) dicopper(I)] diperchlorate","","- C90 H80 Cl6 Cu2 N6 O8 P4 -","- C90 H76 Cl6 Cu2 N6 O8 P4 -","- C180 H152 Cl12 Cu4 N12 O16 P8 -","2","0.5","WW6114","Xu, Feng-Bo; Xu, Hu; Leng, Xue-Bing; Song, Hai-Bin; Li, Qing-Shan; Zou, Ru-Yi; Zhang, Zheng-Zhi","{μ-9,10-Bis[(<i>n</i>-propylamino)methyl]anthracene-κ^2^<i>N</i>:<i>N</i>'}bis{bis[6-chloro-2-(diphenylphosphino)pyridine-κ<i>P</i>]copper(I)} diperchlorate","Acta Crystallographica Section E","2003","59","11","m1044","m1045","10.1107/S1600536803022104","","","0.71073","MoKα","","0.1364","0.0589","","","0.1173","0.1364","","","","","","1.048","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2202998","8.955","0.001","17.568","0.002","13.075","0.002","90","","90.26","0.01","90","","2057","0.5","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-Chloro-5,5-dimethyl-2,3-diphenyl-2,3-dihydroimidazo[1,2-c]quinazoline","","- C24 H20 Cl N3 -","- C24 H20 Cl N3 -","- C96 H80 Cl4 N12 -","4","1","WW6118","Shi, Daqing; Wang, Juxian; Shi, Chunling; Rong, Liangce; Wang, Xiangshan; Hu, Hongwen","9-Chloro-5,5-dimethyl-2,3-diphenyl-2,3-dihydroimidazo[1,2-<i>c</i>]quinazoline","Acta Crystallographica Section E","2003","59","11","o1661","o1662","10.1107/S1600536803021925","","","0.71073","MoKα","","0.0753","0.0404","","","0.1003","0.1092","","","","","","0.881","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2202999","10.194","0.002","13.112","0.003","13.173","0.003","113.67","0.03","105.12","0.03","96.2","0.03","1511.1","0.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Bis(2-aminopyrimidine)silver(I) trifluoromethylsulfonate hemihydrate","","- C9 H11 Ag F3 N6 O3.5 S -","- C9 H11 Ag F3 N6 O3.5 S -","- C36 H44 Ag4 F12 N24 O14 S4 -","4","2","WW6119","Zhu, Hai-Liang; Yang, Song; Ma, Ji-Long; Qiu, Xiao-Yang; Sun, Lin; Shao, Si-Chang","Bis(2-aminopyrimidine)silver(I) trifluoromethanesulfonate hemihydrate","Acta Crystallographica Section E","2003","59","11","m1046","m1047","10.1107/S1600536803022141","","","0.71073","MoKα","","0.0768","0.0571","","","0.1134","0.1222","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203000","7.806","0.002","10.371","0.002","13.234","0.003","90","","105.74","0.03","90","","1031.2","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-Poly[[silver(I)-μ-1,4-diaminobutane-κ^2^N:N'] hexafluoroarsenate]","","- C4 H12 Ag As F6 N2 -","- C4 H12 Ag As F6 N2 -","- C16 H48 Ag4 As4 F24 N8 -","4","1","WW6121","Zhu, Hai-Liang; Ma, Ji-Long; Qiu, Xiao-Yang; Shao, Si-Chang; Yang, Song; Sun, Lin","<i>catena</i>-Poly[[silver(I)-μ-1,4-diaminobutane-κ^2^<i>N</i>:<i>N</i>'] hexafluoroarsenate]","Acta Crystallographica Section E","2003","59","11","m1048","m1049","10.1107/S1600536803023298","","","0.71073","MoKα","","0.0466","0.0418","","","0.1136","0.1166","","","","","","1.081","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203001","16.34","0.001","12.679","0.001","12.987","0.0008","90","","103.321","0.002","90","","2618.2","0.3","200.2","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C24 H16 Cl2 F6 Ir N4 P -","- C24 H16 Cl2 F6 Ir N4 P -","- C96 H64 Cl8 F24 Ir4 N16 P4 -","4","0.5","WW6123","Yoshikawa, Naokazu; Sakamoto, Jun; Kanehisa, Nobuko; Kai, Yasushi; Matsumura, Keiko; Takashima, Hiroshi; Tsukahara, Keiichi","<i>cis</i>-Dichlorobis(1,10-phenanthroline)iridium(III) hexafluorophosphate","Acta Crystallographica Section E","2003","59","11","m972","m974","10.1107/S1600536803021755","","","0.7107","MoKα","","","0.0401","","","","0.0913","","","","","","1.2","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2203002","13.645","0.005","8.293","0.004","14.112","0.005","90","","104.4","0.02","90","","1546.7","1.1","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 O6 -","- C17 H16 O6 -","- C68 H64 O24 -","4","1","WW6125","Patrick, Vincent A.; Skelton, Brian W.; White, Allan H.","(4α,4aβ,9aβ)-4a-Acetoxy-4-methoxy-3,4,4a,9a-tetrahydro-1<i>H</i>-anthracene-2,9,10-trione","Acta Crystallographica Section E","2003","59","11","o1634","o1635","10.1107/S1600536803021688","","","0.71073","MoKα","","0.059","0.052","","0.055","","0.054","","","1.035","","","1.067","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203003","14.585","0.003","8.3893","0.0019","24.881","0.006","90","","98.507","0.004","90","","3010.9","1.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,7,12-Tris(2-bromoethoxy)-3,8,13-trimethoxy-10,15-dihydro-5H- tribenzo[a,d,g]cyclononaene","","- C30 H33 Br3 O6 -","- C30 H33 Br3 O6 -","- C120 H132 Br12 O24 -","4","1","WW6126","Wang, Song-Qing; Zeng, Guo; Zheng, Xiu-Fang; Zhao, Kang","2,7,12-Tris(2-bromoethoxy)-3,8,13-trimethoxy-10,15-dihydro-5<i>H</i>-tribenzo[<i>a,d,g</i>]cyclononaene","Acta Crystallographica Section E","2003","59","12","o1862","o1863","10.1107/S1600536803024619","","","0.71073","MoKα","","0.121","0.0632","","","","0.1642","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203004","16.048","0.003","10.611","0.003","4.4588","0.0016","90","","94.95","0.02","90","","756.4","0.4","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","indole-3-carboxylic acid","1H-indole-3-carboxylic acid","","- C9 H7 N O2 -","- C9 H7 N O2 -","- C36 H28 N4 O8 -","4","1","WW6128","Smith, Graham; Wermuth, Urs D.; Healy, Peter C.","Indole-3-carboxylic acid","Acta Crystallographica Section E","2003","59","11","o1766","o1767","10.1107/S1600536803022670","","","0.71069","MoKα","","0.0799","0.0426","","","0.1235","0.1522","","","","","","0.934","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203005","24.818","0.006","20.677","0.004","14.473","0.005","90","","124.59","0.02","90","","6114","3","298","","298","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","10,10'-Dibromo-9,9'-bianthryl","","- C28 H16 Br2 -","- C28 H16 Br2 -","- C336 H192 Br24 -","12","1.5","WW6131","Sarkar, Moloy; Samanta, Anunay","10,10'-Dibromo-9,9'-bianthryl","Acta Crystallographica Section E","2003","59","11","o1764","o1765","10.1107/S1600536803022566","","","0.71073","MoKα","","0.1261","0.0642","","","0.1429","0.1748","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203006","4.1169","0.0004","8.4929","0.0008","17.1626","0.0016","90","","90.788","0.002","90","","600.02","0.1","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","4-bromo-2-thenaldehye","4-bromothiophene-2-carboxaldehyde","","- C5 H3 Br O S -","- C5 H3 Br O S -","- C20 H12 Br4 O4 S4 -","4","1","WW6132","Stacy, Vanessa L.; Crundwell, Guy; Updegraff III, James B.; Zeller, Matthias; Hunter, Allen D.","4-Bromothiophene-2-carboxaldehyde","Acta Crystallographica Section E","2003","59","11","o1812","o1813","10.1107/S1600536803023419","","","0.71073","MoKα","","0.021","0.0193","","","0.0466","0.0474","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203007","7.866","0.003","6.71","0.003","15.959","0.007","90","","90","","90","","842.3","0.6","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Ethyl 5-cyano-1H-pyrrole-2-carboxylate","","- C8 H8 N2 O2 -","- C8 H8 N2 O2 -","- C32 H32 N8 O8 -","4","0.5","WW6137","Zhang, Yan-Hua; Yin, Zhenming; Li, Xiao-Fang; Cheng, Jin-Pei","Ethyl 5-cyano-1<i>H</i>-pyrrole-2-carboxylate","Acta Crystallographica Section E","2003","59","12","o1881","o1882","10.1107/S1600536803024607","","","0.71073","MoKα","","0.0735","0.0526","","","","0.1585","","","","","","1.118","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203008","7.5177","0.0008","9.6277","0.001","11.1566","0.0012","89.008","0.002","79.373","0.002","87.054","0.002","792.57","0.15","293","2","293","2","","","","","","","","4","P 1","P 1","1","(S)-(-)-α-methylbenzylaminium 3,5-dinitrosalicylate","(S)-(-)-1-phenylethylaminium 3,5-dinitrosalicylate","","- C15 H15 N3 O7 -","- C15 H15 N3 O7 -","- C30 H30 N6 O14 -","2","2","WW6138","Smith, Graham; Wermuth, Urs D.; White, Jonathan M.","(<i>S</i>)-(‒)-1-Phenylethylaminium 3,5-dinitrosalicylate","Acta Crystallographica Section E","2003","59","12","o1977","o1979","10.1107/S1600536803024668","","","0.71073","MoKα","","0.0625","0.0447","","","0.0979","0.1074","","","","","","0.93","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203009","20.4621","0.0014","8.6575","0.0006","20.9787","0.0014","90","","102.342","0.001","90","","3630.5","0.4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C43 H34 Fe O5 P2 -","- C43 H34 Fe O5 P2 -","- C172 H136 Fe4 O20 P8 -","4","0.5","YA6158","Cui Da-Jun; Zeng Xianshun; Leng Xuebing; Xu Fengbo; Zhang Zhengzhi","<i>trans</i>-Tricarbonylbis[diphenyl(benzoylmethyl)phosphine]iron(0)","Acta Crystallographica Section E","2003","59","7","m546","m547","10.1107/S1600536803012091","","","0.71073","MoKα","","0.037","0.029","","","0.079","0.083","","","","","","1.06","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203010","5.8468","0.0001","29.241","0.0004","8.7228","0.0001","90","","92.1651","0.0008","90","","1490.24","0.04","299","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C8 H8 O3 -","- C8 H8 O3 -","- C64 H64 O24 -","8","2","YA6160","Andreas Fischer; Veronica M. Profir","A metastable modification of (<i>RS</i>)-mandelic acid","Acta Crystallographica Section E","2003","59","8","o1113","o1116","10.1107/S1600536803014697","","","1.5418","CuKα","","0.065","0.049","","","0.136","0.149","","","","","","1.06","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203011","8.0088","0.0011","14.3163","0.0016","22.103","0.003","90","","90","","90","","2534.3","0.6","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H12 O3 S -","- C14 H12 O3 S -","- C112 H96 O24 S8 -","8","1","YA6162","Kazak, Canan; Göker, Hakan; Íde, Semra","2-Acetylphenyl 5-methylthiophene-2-carboxylate","Acta Crystallographica Section E","2003","59","9","o1362","o1363","10.1107/S160053680301167X","","","0.71073","MoKα","","0.16","0.043","","","0.085","0.112","","","","","","0.98","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203012","16.61","0.003","10.222","0.002","11.237","0.002","90","","119.22","0.03","90","","1665.1","0.7","298","2","298","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","poly[μ~2~-terephthalato-μ~4~-terephthalato-bis[(μ~2~-4,4'- bipyridine)nickel(II)]]","","- C18 H12 N2 Ni O4 -","- C18 H12 N2 Ni O4 -","- C72 H48 N8 Ni4 O16 -","4","0.5","YA6163","Yang, Shi-Yao; Long, La-Sheng; Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","Poly[nickel(II)-μ-4,4'-bipyridine-μ-terephthalato]","Acta Crystallographica Section E","2003","59","7","m454","m455","10.1107/S1600536803012704","","","0.71073","MoKα","","0.081","0.055","","","0.122","0.135","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203013","6.7086","0.0002","10.5746","0.0003","20.9333","0.0005","90","","98.678","0.001","90","","1468.02","0.07","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Disodium μ-triethylenetetraaminehexaacetatodi[oxovanadate(IV)] hexahydrate","","- C18 H36 N4 Na2 O20 V2 -","- C18 H36 N4 Na2 O20 V2 -","- C36 H72 N8 Na4 O40 V4 -","2","0.5","YA6164","Long, La-Sheng; Ren, Yan-Ping; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","Disodium μ-triethylenetetraaminehexaacetato-bis[oxovanadate(IV)] hexahydrate","Acta Crystallographica Section E","2003","59","7","m456","m458","10.1107/S1600536803012054","","","0.71073","MoKα","","0.082","0.067","","","0.141","0.151","","","","","","1.21","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203014","18.5885","0.0008","8.8265","0.0004","21.7607","0.0009","90","","113.408","0.001","90","","3276.5","0.2","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Poly[[aqua(1-aza-4-azoniabicyclo[2.2.2]octane)cadmate(II)]-μ-5- sulfoisophthalato]","","- C14 H18 Cd N2 O8 S -","- C14 H18 Cd N2 O8 S -","- C112 H144 Cd8 N16 O64 S8 -","8","1","YA6165","Tao, Jun; Yin, Xin; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","Poly[[aqua(1-aza-4-azoniabicyclo[2.2.2]octane)cadmate(II)]-μ-5-sulfatoisophthalato]","Acta Crystallographica Section E","2003","59","7","m473","m475","10.1107/S1600536803013230","","","0.71073","MoKα","","0.031","0.025","","","0.055","0.056","","","","","","0.93","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203015","13.525","0.004","7.383","0.002","8.094","0.003","90","","112.399","0.005","90","","747.2","0.4","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","catena-poly[bis(μ-1,5-dicyanamido)-bis(N,N-dimethylformamide)cobalt(II)]","","- C10 H14 Co N8 O2 -","- C10 H14 Co N8 O2 -","- C20 H28 Co2 N16 O4 -","2","0.25","YA6166","Tong, Ming-Liang; Zhou, Ai-Ju; Hu, Sheng; Chen, Xiao-Ming; Ng, Seik Weng","<i>catena</i>-Poly[[bis(<i>N,N</i>-dimethylformamide)cobalt(II)]-di-μ-1,5-dicyanamido]","Acta Crystallographica Section E","2003","59","7","m405","m407","10.1107/S1600536803012042","","","0.71073","MoKα","","0.03","0.029","","","0.086","0.087","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203016","15.42","0.003","7.22","0.001","6.95","0.001","90","","112.94","0.03","90","","712.6","0.3","298","2","298","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","catena-poly[[bis(2-pyrrolidone-κO)cobalt(II)]-di-μ-1,5-dicyanamido- κ^4^N^1^:N^5^]","","- C12 H14 Co N8 O2 -","- C12 H14 Co N8 O2 -","- C24 H28 Co2 N16 O4 -","2","0.25","YA6167","Ng, Seik Weng","Rerefinement of <i>catena</i>-poly[[bis(2-pyrrolidone-κ<i>O</i>)cobalt(II)]-di-μ-1,5-dicyanamido-κ^4^<i>N</i>^1^:<i>N</i>^5^] in the centrosymmetric space group <i>C</i>2/<i>m</i>","Acta Crystallographica Section E","2003","59","7","m530","m531","10.1107/S160053680301362X","","","0.71073","MoKα","","0.032","0.03","","","0.081","0.082","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203017","7.1819","0.001","7.4204","0.0009","14.3295","0.0019","88.224","0.01","80.974","0.011","72.945","0.01","720.94","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-(m-Chlorobenzylamino)-3-phenyl-4,5-dihydro-1H-1,2,4-triazol-5-one","","- C15 H13 Cl N4 O -","- C15 H13 Cl N4 O -","- C30 H26 Cl2 N8 O2 -","2","1","YA6168","Özdemir, Namık; Dinçer, Muharrem; Kahveci, Bahittin; Ağar, Erbil; Şaşmaz, Selami","4-(<i>m</i>-Chlorobenzylamino)-3-phenyl-4,5-dihydro-1<i>H</i>-1,2,4-triazol-5-one","Acta Crystallographica Section E","2003","59","8","o1223","o1225","10.1107/S1600536803015988","","","0.71073","MoKα","","0.044","0.039","","","0.122","0.126","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203018","9.6895","0.0002","18.9619","0.0003","12.8905","0.0002","90","","109.743","0.001","90","","2229.17","0.07","220","2","220","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H42 Cl4 P2 Pd2 -","- C48 H42 Cl4 P2 Pd2 -","- C96 H84 Cl8 P4 Pd4 -","2","0.5","YA6169","Sui-Seng, Christine; Bélanger-Gariépy, Francine; Zargarian, Davit","<i>trans</i>-Di-μ-chloro-bis[chloro(triphenylphosphine)palladium] benzene disolvate","Acta Crystallographica Section E","2003","59","8","m618","m619","10.1107/S1600536803015502","","","1.54178","CuKα","","0.037","0.034","","0.09","","0.089","","","1.05","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203019","14.964","0.001","18.492","0.001","36.26","0.002","90","","92.04","0.01","90","","10027.3","1","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","[5,15-Diphenyl-2,8,12,18-tetra-n-hexyl-3,7,13,17- tetramethylporphyrinato]nickel(II)","","- C60 H76 N4 Ni -","- C60 H76 N4 Ni -","- C480 H608 N32 Ni8 -","8","2","YA6170","Bond, Andrew D.; Feeder, Neil; Redman, James E.; Teat, Simon J.; Sanders, Jeremy K. M.","Synchrotron X-ray study of [5,15-diphenyl-2,8,12,18-tetra-<i>n</i>-hexyl-3,7,13,17-tetramethylporphyrinato]nickel(II)","Acta Crystallographica Section E","2003","59","9","m818","m820","10.1107/S1600536803018853","","","0.6891","synchrotron","","0.088","0.052","","","0.121","0.129","","","","","","0.95","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203020","6.97","0.0011","8.0438","0.001","11.8063","0.0013","87.91","0.002","79.862","0.004","81.879","0.003","645.01","0.15","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H14 N4 O4 -","- C12 H14 N4 O4 -","- C24 H28 N8 O8 -","2","1","YA6171","Shang Shan; Duan-Jun Xu; Wei-Xiao Hu","Cyclohexanone 2,4-dinitrophenylhydrazone","Acta Crystallographica Section E","2003","59","8","o1173","o1174","10.1107/S1600536803015666","","","0.71073","MoKα","","0.076","0.047","","","0.112","0.123","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203021","11.132","0.003","22.785","0.007","12.515","0.004","90","","112.477","0.005","90","","2933.2","1.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","4'-(4-Chlorophenyl)-3''-ethyl-1'-methyl-1H-indole-3-spiro-2'-pyrrolidine- 3'-spiro-5''-[1,3]thiazole-2(3H),2''(3''H),4''(5''H)-trione benzene sesquisolvate","","- C31 H29 Cl N3 O3 S -","- C31 H29 Cl N3 O3 S -","- C124 H116 Cl4 N12 O12 S4 -","4","1","YA6172","Li, Xiao-Fang; Feng, Ya-Qing; Shi, Da-Xin; Chen, Hong-Liang","4'-(4-Chlorophenyl)-3''-ethyl-1'-methyl-1<i>H</i>-indole-3-spiro-2'-pyrrolidine-3'-spiro-5''-[1,3]thiazole-2(3<i>H</i>),2''(3''<i>H</i>),4''(5''<i>H</i>)-trione benzene sesquisolvate","Acta Crystallographica Section E","2003","59","9","o1420","o1422","10.1107/S1600536803018804","","","0.71073","MoKα","","0.125","0.057","","","","0.155","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203022","6.91","0.001","7.389","0.001","8.223","0.001","90.08","0.07","109.83","0.08","93.37","0.07","394.2","0.2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","catena-[μ~6~-1,2,4,5-Benzenetetracarboxylato-tetraaqua-dinickel(II)] dihydrate","","- C10 H14 Ni2 O14 -","- C10 H10 Ni2 O14 -","- C10 H10 Ni2 O14 -","1","0.5","YA6173","Yang, Shi-Yao; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","<i>catena</i>-[μ~6~-1,2,4,5-Benzenetetracarboxylato-tetraaqua-dinickel(II)] dihydrate","Acta Crystallographica Section E","2003","59","10","m849","m850","10.1107/S1600536803019196","","","0.71073","MoKα","","0.082","0.046","","","0.094","0.108","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203023","7.9109","0.0013","8.386","0.003","16.4898","0.0016","90","","93.645","0.012","90","","1091.7","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl 3-(2-oxobenzothiazoline-3-yl)propanoate","","- C11 H11 N O3 S -","- C11 H11 N O3 S -","- C44 H44 N4 O12 S4 -","4","1","YA6174","Ersanlı, Cem Cüneyt; Dündar, Yasemin; Sarı, Uǧur; Noyanalpan, Ningur; Odabas̨oǧlu, Mustafa; Erdönmez, Ahmet","Methyl 3-(2-oxobenzothiazolin-3-yl)propanoate","Acta Crystallographica Section E","2003","59","11","o1604","o1606","10.1107/S1600536803021147","","","0.71069","MoKα","","0.073","0.039","","","0.109","0.126","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203024","11.8945","0.0003","19.2698","0.0004","27.0279","0.0006","90","","90","","90","","6194.9","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-Benzoyl-3-cyclohexyl-4-(p-methoxyphenyl)-5-phenylpyrrolidine-3-spiro- 3'-chroman-4'-one","","- C38 H37 N O4 -","- C38 H37 N O4 -","- C304 H296 N8 O32 -","8","2","YA6175","G. Usha; S. Selvanayagam; M. Yogavel; D. Velmurugan; A. Amalraj; R. Raghunathan; S. Shanmuga Sundara Raj; H.-K. Fun","2-Benzoyl-3-cyclohexyl-4-(<i>p</i>-methoxyphenyl)-5-phenylpyrrolidine-3-spiro-3'-chroman-4'-one","Acta Crystallographica Section E","2003","59","10","o1572","o1574","10.1107/S1600536803020944","","","0.71073","MoKα","","0.069","0.047","","","0.117","0.137","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203025","10.3304","0.0013","10.6065","0.0013","6.8638","0.0008","90","","105.931","0.002","90","","723.18","0.15","93","2","93","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3,3-bis(difluoroaminomethyl)oxetane","","- C5 H8 F4 N2 O -","- C5 H8 F4 N2 O -","- C20 H32 F16 N8 O4 -","4","0.5","YA6177","Gilardi, Richard; Evans, Robin N.; Manser, Gerald E.","3,3-Bis(difluoroaminomethyl)oxetane, a promising new energetic material","Acta Crystallographica Section E","2003","59","12","o2032","o2034","10.1107/S1600536803027016","","","0.71073","MoKα","","0.038","0.036","","","0.101","0.102","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203026","6.8359","0.001","9.3875","0.0013","16.5518","0.0014","90","","90","","90","","1062.2","0.2","295","2","295","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C6 H8 Na2 O10 Zn -","- C6 H8 Na2 O10 Zn -","- C24 H32 Na8 O40 Zn4 -","4","0.5","YA6178","Dong-Dong Lin; Li Zhang; Duan-Jun Xu","Poly[disodium bis(μ-malonato)zincate(II) dihydrate]","Acta Crystallographica Section E","2003","59","11","m1010","m1012","10.1107/S1600536803022153","","","0.71073","MoKα","","0.026","0.023","","","0.055","0.056","","","","","","1.17","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203027","11.948","0.004","12.066","0.004","15.674","0.005","97.542","0.005","92.617","0.005","111","0.005","2080.8","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","13-Benzyl-4,11-bis-(4-chlorophenyl)-3,10-bis(2,6-dichlorophenyl)-1,8-dioxa- 2,9,13-triazadispiro[4.1.4.3]tetradeca-2,9-dien-6-one chloroform solvate","","- C41 H28 Cl9 N3 O3 -","- C41 H28 Cl9 N3 O3 -","- C82 H56 Cl18 N6 O6 -","2","1","YA6179","Li, Xiao-Fang; Feng, Ya-Qing; Gao, Bo; Li, Nan","13-Benzyl-4,11-bis-(4-chlorophenyl)-3,10-bis(2,6-dichlorophenyl)-1,8-dioxa-2,9,13-triazadispiro[4.1.4.3]tetradeca-2,9-dien-6-one chloroform solvate","Acta Crystallographica Section E","2003","59","11","o1814","o1816","10.1107/S1600536803023791","","","0.71073","MoKα","","0.085","0.048","","","","0.132","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203028","31.4","0.006","6.97","0.0014","33.76","0.007","90","","111.5","0.03","90","","6875","3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H11 Br N5 Ni S4 -","- C20 H11 Br N5 Ni S4 -","- C240 H132 Br12 N60 Ni12 S48 -","12","3","YA6181","Xiao-Ming Ren; Jing-Li Xie; Yiz-Hi Li; Qing-Jin Meng","1-(2-Bromobenzyl)pyridinium bis(maleodinitriledithiolato)nickelate(III)","Acta Crystallographica Section E","2003","59","12","m1115","m1117","10.1107/S1600536803025182","","","0.71073","MoKα","","0.096","0.047","","","0.11","0.12","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203029","8.883","0.003","9.446","0.003","13.466","0.004","88.416","0.005","83.527","0.004","74.129","0.004","1079.9","0.6","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","4-[2-(1-Naphthyl)vinyl]-N,N-diphenylaniline","","- C30 H23 N -","- C30 H23 N -","- C60 H46 N2 -","2","1","YA6182","Cao, Xiao-Dan; Liu, Dong-Zhi; Zhou, Xue-Qin","4-[2-(1-Naphthyl)vinyl]-<i>N,N</i>-diphenylaniline","Acta Crystallographica Section E","2003","59","12","o2018","o2019","10.1107/S1600536803025200","","","0.71073","MoKα","","0.085","0.044","","","0.1","0.121","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203030","8.0057","0.0006","11.7864","0.0009","13.6991","0.0011","109.164","0.001","102.19","0.001","96.484","0.001","1169.98","0.16","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2'-p-Chlorobenzoyl-1',2, 2',3,4',5',6',6a'-octahydro-1H-indan-2-spiro-3'- (3'H-pyrrolizine)-1'-spiro-3""-1H-indoline-1, 2"",3-trione.","","- C29 H21 Cl N2 O4 -","- C29 H21 Cl N2 O4 -","- C58 H42 Cl2 N4 O8 -","2","1","AC6067","P. R. Seshadri; S. Selvanayagam; D. Velmurugan; K. Ravikumar; A. R. Sureshbabu; R. Raghunathan","2'-(<i>p</i>-Chlorobenzoyl)-2,2',3,3',4',5',6',6a'-octahydro-1<i>H</i>-indan-2-spiro-3'-(1<i>H</i>-pyrrolizine)-1'-spiro-3''-indoline-1,2'',3-trione","Acta Crystallographica Section E","2004","60","1","o126","o128","10.1107/S1600536803025170","","","0.71073","MoKα","","0.071","0.0509","","","0.1289","0.1437","","","","","","1.007","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203031","15.98","0.002","5.9373","0.0006","11.795","0.001","90","","113.842","0.002","90","","1023.59","0.19","100","2","100","2","","","","","","","","5","C 1 c 1","C -2yc","9","","cis-Dichlorobis(N,N,N',N'-tetramethyl-1,2-diaminoethane)palladium(II)","","- C6 H16 Cl2 N2 Pd -","- C6 H16 Cl2 N2 Pd -","- C24 H64 Cl8 N8 Pd4 -","4","1","AC6071","Boyle, Robert C.; Mague, Joel T.; Fink, Mark J.","<i>cis</i>-Dichloro(<i>N,N,N</i>'<i>,N</i>'-tetramethyl-1,2-diaminoethane)palladium(II)","Acta Crystallographica Section E","2004","60","1","m40","m41","10.1107/S1600536803027739","","","0.71073","MoKα","","0.0271","0.0258","","","0.0601","0.0607","","","","","","1.12","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203032","15.5111","0.0014","11.0313","0.0009","12.7192","0.0012","90","","90","","90","","2176.4","0.3","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","Tetra-μ-chloro-chloro(N,N,N',N'-tetramethylethane-1,2-diamine)(1,1,3- trimethyl-2-imidazolium)dicopper(I)copper(II)","","- C12 H29 Cl5 Cu3 N4 -","- C12 H29 Cl5 Cu3 N4 -","- C48 H116 Cl20 Cu12 N16 -","4","1","AC6072","Butcher, Ray J.; George, C.; Purdy, Andrew P.","Tetra-μ-chloro-chloro(<i>N,N,N</i>',<i>N</i>'-tetramethylethane-1,2-diamine)(1,1,3-trimethyl-2-imidazolium)dicopper(I)copper(II)","Acta Crystallographica Section E","2004","60","1","m102","m104","10.1107/S1600536803027752","","","0.71073","MoKα","","0.0434","0.0342","","","0.0726","0.0766","","","","","","1.059","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203033","6.8962","0.001","8.8884","0.0011","9.8343","0.0013","91.449","0.011","91.639","0.011","92.858","0.011","601.59","0.14","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4-(Benzyloxy)phthalonitrile","","- C15 H10 N2 O -","- C15 H10 N2 O -","- C30 H20 N4 O2 -","2","1","AC6073","Dinçer, Muharrem; Ağar, Ayşen; Akdemir, Nesuhi; Ağar, Erbil; Özdemir, Namık","4-(Benzyloxy)phthalonitrile","Acta Crystallographica Section E","2004","60","1","o79","o80","10.1107/S1600536803027764","","","0.71073","MoKα","","0.0627","0.0394","","","0.0998","0.1071","","","","","","0.958","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203034","11.235","0.006","4.038","0.005","17.057","0.008","90","","118.66","0.03","90","","679","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-bromo-5-hydroxybenzaldehyde","","- C7 H5 Br O2 -","- C7 H5 Br O2 -","- C28 H20 Br4 O8 -","4","1","AC6074","Ramos Silva, Manuela; Paixão, Jose A.; Matos Beja, Ana; Sobral, Abilio J. F. N.; Rocha Gonsalves, A. M. d'A.","A new polymorph of 2-bromo-5-hydroxybenzaldehyde","Acta Crystallographica Section E","2004","60","1","o84","o85","10.1107/S1600536803028083","","","0.71073","MoKα","","0.0567","0.0302","","","0.0718","0.0825","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203035","7.1865","0.0011","14.609","0.002","16.197","0.002","90","","90","","90","","1700.5","0.4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Dichloromethyl[1-(2-pyridyl)ethanone benzoylhydrazonato]tin(IV)","","- C15 H15 Cl2 N3 O Sn -","- C15 H15 Cl2 N3 O Sn -","- C60 H60 Cl8 N12 O4 Sn4 -","4","1","AC6075","Affan, M. A.; Shamsuddin, Mustaffa. B.; M. Sukeri M. Yusof; Yamin, Bohari. M.","Dichloromethyl[1-(2-pyridyl)ethanone benzoylhydrazonato]tin(IV)","Acta Crystallographica Section E","2004","60","1","m126","m128","10.1107/S1600536803028976","","","0.71073","MoKα","","0.021","0.02","","","0.052","0.052","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203036","6.699","0.001","9.4253","0.0015","16.492","0.003","106.227","0.002","91.189","0.002","105.43","0.002","958.7","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-p-toluenesulfonamide","","- C19 H24 B N O4 S -","- C19 H24 B N O4 S -","- C38 H48 B2 N2 O8 S2 -","2","1","AC6076","Steve A. Westcott; Xiao-Feng He; Christopher M. Vogels; Andreas Decken","A sulfanilamide derivative containing a boronate ester group","Acta Crystallographica Section E","2004","60","1","o115","o116","10.1107/S1600536803028885","","","0.71073","MoKα","","0.0417","0.0398","","","0.1008","0.1022","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203037","4.9412","0.001","5.7963","0.0012","18.362","0.004","96.94","0.03","94.82","0.03","97.91","0.03","514.4","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Tetraaqua[(3-carboxyphenoxy)acetato]nickel(II)","","- C18 H22 Ni O14 -","- C18 H22 Ni O14 -","- C18 H22 Ni O14 -","1","0.5","BR6128","Shan Gao; Jian-Rong Li; Ji-Wei Liu; Chang-Sheng Gu; Li-Hua Huo","Tetraaqua[(3-carboxyphenoxy)acetato]nickel(II)","Acta Crystallographica Section E","2004","60","1","m22","m23","10.1107/S1600536803027442","","","0.71073","MoKα","","0.0378","0.0337","","","0.0821","0.084","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203038","10.676","0.002","6.716","0.001","12.812","0.002","90","","103.77","0.01","90","","892.2","0.3","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","tetrasodium pentanickel arsenic-phosphorus (2.67/3.35) twentytwooxide","","- As2.64 Na4 Ni5 O22 P3.36 -","- As2.64 Na4 Ni5 O22 P3.36 -","- As5.28 Na8 Ni10 O44 P6.72 -","2","0.5","BR6129","Ben Smail, Ridha; Jouini, Tahar","Na~4~Ni~5~[(As~1{-~<i>x</i>}P~<i>x~</i>)O~4~]~2~[(As~2<i>y~</i>P~2{-~2<i>y</i>})O~7~]~2~ (<i>x</i> = 0.27 and <i>y</i> = 0.295)","Acta Crystallographica Section E","2004","60","1","i1","i2","10.1107/S1600536803027375","","","0.71073","MoKα","","0.0325","0.0241","","","0.0622","0.0652","","","","","","1.095","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203039","16.8535","0.0007","14.8719","0.0006","26.0014","0.0011","90","","106.567","0.001","90","","6246.5","0.4","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","(Pentafluoropropionato){tris[2-(dimethylaminomethyl)phenyl]phosphine}silver(I)","","- C30 H36 Ag F5 N3 O2 P -","- C30 H36 Ag F5 N3 O2 P -","- C240 H288 Ag8 F40 N24 O16 P8 -","8","2","BR6130","Yingzhong Shen; Hans Pritzkow; Bernhard Walfort; Tobias Rüffer; Heinrich Lang","P(C~6~H~4~CH~2~NMe~2~-2)~3~-stabilized mononuclear pentafluoropropionatosilver(I)","Acta Crystallographica Section E","2004","60","1","m91","m93","10.1107/S1600536803028320","","","0.71073","MoKα","","0.046","0.033","","","0.0731","0.0804","","","","","","1.091","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203040","20.352","0.003","6.607","0.0016","15.501","0.002","90","","105.58","0.012","90","","2007.8","0.6","122","2","122","2","","","","","","","","4","C 1 2 1","C 2y","5","Quininium (R,R)-tartrate hydrate","Quininium (R,R)-tartrate hydrate","","- C44 H56 N4 O11 -","- C44 H50 N4 O11 -","- C88 H100 N8 O22 -","2","0.5","BT6358","Ryttersgaard, Carsten; Larsen, Sine","Bis(quininium) (<i>R</i>,<i>R</i>)-tartrate monohydrate","Acta Crystallographica Section E","2004","60","1","o4","o5","10.1107/S1600536803026849","","","0.71073","MoKα","","0.0789","0.0567","","","0.1389","0.154","","","","","","1.094","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203041","7.8394","0.0006","11.676","0.0009","11.8628","0.001","85.657","0.001","89.752","0.001","83.726","0.002","1076.22","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-N-methyl-Spiro-[2 -3'] oxindole-spiro-[3-2""] indan-1"",3""dione 4-[2""'- chlorophenyl] pyrrolidine","","- C26 H19 Cl N2 O3 -","- C26 H19 Cl N2 O3 -","- C52 H38 Cl2 N4 O6 -","2","1","BT6385","P. R. Seshadri; S. Selvanayagam; D. Velmurugan; K. Ravikumar; A. R. Sureshbabu; R. Raghunathan","4'-(3-Chlorophenyl)-1-methyl-1<i>H</i>-indole-3-spiro-2'-pyrrolidine-3'-spiro-2''-indan-2,1'',3''-trione","Acta Crystallographica Section E","2004","60","1","o51","o53","10.1107/S1600536803027302","","","0.71073","MoKα","","0.0751","0.0556","","","0.1566","0.1715","","","","","","1.088","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203042","27.347","0.003","15.4675","0.001","15.5745","0.0017","90","","119.093","0.007","90","","5756.7","1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4,5-Bis(4-methylphenylsulfanyl)phthalonitrile","","- C22 H16 N2 S2 -","- C22 H16 N2 S2 -","- C264 H192 N24 S24 -","12","1.5","BT6387","Ocak, Nazan; Çoruh, Ufuk; Akdemir, Nesuhi; Kantar, Cihan; Aǧar, Erbil; Erdönmez, Ahmet","4,5-Bis(4-methylphenylsulfanyl)phthalonitrile","Acta Crystallographica Section E","2004","60","1","o33","o34","10.1107/S1600536803026710","","","0.71073","MoKα","","0.1379","0.04","","","0.0473","0.0599","","","","","","0.733","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203043","16.89","0.003","42.101","0.008","17.393","0.004","90","","101.66","0.03","90","","12113","4","180","2","180","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tris(hydroxonium) μ~12~-phosphato-tetracosa-μ~2~-oxo-dodecaoxododecatungsten hexakis(benzo-15-crown-5)‒methanol‒water (1/1/1)","","- C85 H135 O75 P W12 -","- C85 H124 O75 P W12 -","- C340 H496 O300 P4 W48 -","4","1","CF6294","Almeida Paz, Filipe A.; Sousa, Filipa L.; Soares-Santos, Paula C. R.; Cavaleiro, Ana M. V.; Nogueira, Helena I. S.; Klinowski, Jacek; Trindade, Tito","A novel supramolecular organic‒inorganic adduct containing α-Keggin-type [PW~12~O~40~]^3{-^} anions and benzo-15-crown-5 molecules","Acta Crystallographica Section E","2004","60","1","m1","m5","10.1107/S1600536803024310","","","0.71073","MoKα","","0.0553","0.0388","","","0.0779","0.0834","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203044","10.256","0.003","15.738","0.005","20.98","0.006","90","","90","","90","","3386.4","1.8","145","2","145","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","[Pt(ttp)Cl]ClO4","[Bis(3-diphenylphosphinopropyl)phenylphosphine-κ^3^P,P',P'']chloroplatinum(II) perchlorate","","- C36 H37 Cl2 O4 P3 Pt -","- C36 H37 Cl2 O4 P3 Pt -","- C144 H148 Cl8 O16 P12 Pt4 -","4","1","CF6302","Klint, Søren T.; Simonsen, Ole; Andreasen, Lars V.; Bond, Andrew D.; Wernberg, Ole","[Bis(3-diphenylphosphinopropyl)phenylphosphine-κ^3^<i>P,P</i>',<i>P</i>'']chloroplatinum(II) perchlorate","Acta Crystallographica Section E","2004","60","1","m17","m19","10.1107/S160053680302720X","","","1.5418","CuKα","","0.0929","0.0921","","","0.2198","0.2212","","","","","","1.134","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203045","15.0923","0.0011","8.051","0.0005","26.928","0.002","90","","97.535","0.008","90","","3243.7","0.4","295","2","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H21 N O3 -","- C18 H21 N O3 -","- C144 H168 N8 O24 -","8","1","CF6303","Kaynak, F. Betül; Özbey, Süheyla; Uludağ, Nesimi; Patır, Süleyman","Ethyl (3-ethyl-1-oxo-1,2,3,4-tetrahydrocarbazol-2-yl)acetate","Acta Crystallographica Section E","2004","60","1","o120","o122","10.1107/S1600536803028721","","","0.71073","MoKα","","","0.0469","","","","0.1454","","","","","","0.994","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203046","14.693","0.003","6.0684","0.0012","15.266","0.003","90","","90.58","0.03","90","","1361.1","0.5","291","1","291","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H18 O2 -","- C16 H18 O2 -","- C64 H72 O8 -","4","1","CF6306","Kolev, Tsonko; Berends, Thorsten; Preut, Hans; Spiteller, Michael","3-(4-Hydroxystyryl)-1,1-dimethylcyclohex-3-en-5-one","Acta Crystallographica Section E","2004","60","1","o31","o32","10.1107/S1600536803027211","","","0.71073","MoKα","","0.1759","0.032","","","0.0681","0.1078","","","","","","0.958","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203047","7.7363","0.0007","9.526","0.0008","11.8422","0.001","90","","96.134","0.002","90","","867.73","0.13","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","Teuscordin","15-hydroxy-15,16-epoxy-6α-neo-cleroda-3,13(16),14-triene-18,19:20,12-diolide","","- C20 H22 O6 -","- C20 H22 O6 -","- C40 H44 O12 -","2","1","CF6307","S. Soundarya Devi; R. Malathi; S. S. Rajan; S. Aravind; G. N. Krishnakumari; K. Ravikumar","A neo-clerodane diterpene from <i>Teucrium tomentosum</i>","Acta Crystallographica Section E","2004","60","1","o117","o119","10.1107/S1600536803028745","","","0.71073","MoKα","","0.0453","0.0414","","","0.1079","0.1113","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203048","4.922","0.001","5.755","0.001","18.432","0.004","94.13","0.03","91.95","0.03","96.13","0.03","517.32","0.18","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Tetraaquabis(4-carboxyphenoxyacetato)magnesium(II)","","- C18 H22 Mg O14 -","- C18 H22 Mg O14 -","- C18 H22 Mg O14 -","1","0.5","CF6309","Shan Gao; Jian-Rong Li; Li-Hua Huo; Ji-Wei Liu; Chang-Sheng Gu","Tetraaquabis(4-carboxyphenoxyacetato)magnesium(II)","Acta Crystallographica Section E","2004","60","1","m100","m101","10.1107/S1600536803028757","","","0.71073","MoKα","","0.0797","0.0538","","","0.1272","0.1393","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203049","5.2319","0.0001","16.2576","0.0003","9.6044","0.0001","90","","96.53","0.001","90","","811.63","0.02","183","2","183","2","","","","","","","","5","P 1 c 1","P -2yc","7","","(N-Salicylidene-DL-glutamato)(2-methylimidazole)copper(II)","","- C16 H17 Cu N3 O5 -","- C16 H17 Cu N3 O5 -","- C32 H34 Cu2 N6 O10 -","2","1","CF6312","Vratislav Langer; Eva Scholtzová; Dalma Gyepesová; Mária Kohútová; Aladár Valent","(<i>N</i>-Salicylidene-<small>D</small>,<small>L</small>-glutamato)(2-methylimidazole)copper(II)","Acta Crystallographica Section E","2004","60","1","m129","m132","10.1107/S1600536803028769","","","0.71073","MoKα","","0.0575","0.0458","","","0.1016","0.108","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203050","6.3367","0.0008","6.8936","0.0009","9.1801","0.0012","99.396","0.002","105.286","0.002","108.178","0.002","354.09","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","trans-Diaquabis(pyridine-4-carboxylato)cobalt(II) dihydrate","","- C12 H16 Co N2 O8 -","- C12 H16 Co N2 O8 -","- C12 H16 Co N2 O8 -","1","0.5","CF6313","Ze-Qun Yan","<i>trans</i>-Diaquabis(pyridine-4-carboxylato)cobalt(II) dihydrate","Acta Crystallographica Section E","2004","60","1","m116","m117","10.1107/S160053680302885X","","","0.71073","MoKα","","0.0499","0.0436","","","0.1084","0.1139","","","","","","1.071","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203051","6.922","0.0008","10.131","0.0012","10.963","0.0013","76.013","0.002","74.869","0.002","85.318","0.002","720","0.15","93","2","93","2","","","","","","","","7","P -1","-P 1","2","Cadmium ferron tetrahydrate","Diaqua(μ-8-hydroxy-7-iodoquinoline-5-sulfonato)cadmium(II) dihydrate","","- C9 H12 Cd I N O8 S -","- C9 H11 Cd I N O8 S -","- C18 H22 Cd2 I2 N2 O16 S2 -","2","1","CI6309","Savarimuthu Francis; Packianathan Thomas Muthiah; Ray J. Butcher","A supramolecular ladder in diaqua(μ-8-hydroxy-7-iodoquinoline-5-sulfonato-κ^4^<i>N,O,O</i>',<i>O</i>'')cadmium(II) dihydrate","Acta Crystallographica Section E","2004","60","1","m62","m64","10.1107/S1600536803027818","","","0.71073","MoKα","","0.0658","0.0551","","","0.1541","0.1611","","","","","","1.043","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203052","16.387","0.0016","9.5645","0.0012","11.3393","0.0019","90","","82.044","0.01","90","","1760.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Diethyl 7-oxo-3-(pyrrolidin-1-yl)cycloocta-2,8-diene-1,2-dicarboxylate","","- C18 H25 N O5 -","- C18 H25 N O5 -","- C72 H100 N4 O20 -","4","1","CI6310","Tuncer Hökelek; Ayşe Uzgören; Yavuz Ergün; Nazan Tunoğlu; Gürol Okay","Diethyl 7-oxo-3-(pyrrolidin-1-yl)cycloocta-2,8-diene-1,2-dicarboxylate","Acta Crystallographica Section E","2004","60","1","o48","o50","10.1107/S1600536803027132","","","0.71073","MoKα","","0.0864","0.0418","","","0.0985","0.1166","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203053","5.882","0.002","12.187","0.005","24.553","0.01","90","","90","","90","","1760.1","1.2","293","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-tert-Butyl-4-methyl-6-(1-piperidiniomethyl)phenol chloride","","- C17 H28 Cl N O -","- C17 H28 Cl N O -","- C68 H112 Cl4 N4 O4 -","4","1","CI6311","Miao Du; Xiao-Jun Zhao; Ying Wang","2-<i>tert</i>-Butyl-4-methyl-6-(1-piperidiniomethyl)phenol chloride","Acta Crystallographica Section E","2004","60","1","o37","o39","10.1107/S1600536803027314","","","0.71073","MoKα","","0.0706","0.0441","","","0.0949","0.1048","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203054","11.951","0.004","7.639","0.002","11.507","0.004","90","","110.711","0.004","90","","982.6","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C5 H11 Co N O7 S -","- C5 H11 Co N O7 S -","- C20 H44 Co4 N4 O28 S4 -","4","1","CI6312","Yu-Xia Zhang","A one-dimensional coordination polymer: <i>catena</i>-poly[[triaquapyridinecobalt(II)]-μ-sulfato]","Acta Crystallographica Section E","2004","60","1","m30","m31","10.1107/S1600536803027545","","","0.71073","MoKα","","0.0301","0.0225","","","0.0507","0.0531","","","","","","1.035","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203055","9.473","0.001","10.694","0.001","17.9","0.002","79.413","0.002","86.879","0.003","64.923","0.002","1613.9","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[bis[(2,2'-bipyridine-κ^2^N,N')manganese(II)]-di-μ-4- hydroxyisophthalato]","","- C36 H24 Mn2 N4 O10 -","- C36 H24 Mn2 N4 O10 -","- C72 H48 Mn4 N8 O20 -","2","1","CI6313","Zhang, Xian-Ming; Fang, Rui-Qin; Wu, Hai-Shun; Ng, Seik Weng","<i>catena</i>-Poly[bis[(2,2'-bipyridine-κ^2^<i>N,N</i>')manganese(II)]-di-μ-4-hydroxyisophthalato]","Acta Crystallographica Section E","2004","60","1","m50","m52","10.1107/S1600536803027685","","","0.71073","MoKα","","0.054","0.039","","","0.108","0.118","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203056","10.8119","0.0007","12.1443","0.0008","12.2344","0.0008","63.679","0.001","68.124","0.001","79.095","0.001","1335.63","0.15","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","μ-Oxo-bis{diethoxy[salicylaldoximato(2-)]niobium(V)}","","- C22 H30 N2 Nb2 O9 -","- C22 H30 N2 Nb2 O9 -","- C44 H60 N4 Nb4 O18 -","2","1","CI6314","Amini, Mostafa M.; Mirzaee, Mehdi; Ng, Seik Weng","μ-Oxo-bis{diethoxy[salicylaldoximato(2‒)]niobium(V)}","Acta Crystallographica Section E","2004","60","1","m53","m55","10.1107/S1600536803027673","","","0.71073","MoKα","","0.025","0.021","","","0.05","0.06","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203057","12.0073","0.0011","8.453","0.0009","15.0167","0.0015","90","","94.188","0.008","90","","1520.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-Hydroxy-N'-(1-naphthyl)-2-phenylacetamidin-2-one","","- C18 H14 N2 O2 -","- C18 H14 N2 O2 -","- C72 H56 N8 O8 -","4","1","CI6316","Hökelek, Tuncer; Büyükgüngör, Orhan; Taş, Murat; Batı, Hümeyra","<i>N</i>-Hydroxy-<i>N</i>'-(1-naphthyl)-2-phenylacetamidin-2-one","Acta Crystallographica Section E","2004","60","1","o109","o111","10.1107/S1600536803028617","","","0.71073","MoKα","","0.1023","0.0397","","","0.0759","0.0884","","","","","","0.864","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203058","8.2395","0.0006","9.4931","0.0007","11.9704","0.0009","98.313","0.002","94.589","0.002","106.191","0.003","882.56","0.11","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H15 Cl3 Co N2 -","- C18 H15 Cl3 Co N2 -","- C36 H30 Cl6 Co2 N4 -","2","1","CV6252","Tian-Tian Pan; Duan-Jun Xu","Quinolinium trichloro(quinoline-κ<i>N</i>)cobaltate(II)","Acta Crystallographica Section E","2004","60","1","m56","m58","10.1107/S1600536803028149","","","0.71073","MoKα","","0.038","0.032","","","0.076","0.079","","","","","","1.071","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203059","10.29","0.002","16.117","0.003","17.173","0.003","90","","105.47","0.03","90","","2744.9","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","{2,6-Bis[(diphenylphosphino)methyl]phenyl}chloroplatinum(II)","","- C32 H27 Cl P2 Pt -","- C32 H27 Cl P2 Pt -","- C128 H108 Cl4 P8 Pt4 -","4","1","CV6253","Steffen Fischer; Ola F. Wendt","{2,6-Bis[(diphenylphosphino)methyl]phenyl}chloroplatinum(II)","Acta Crystallographica Section E","2004","60","1","m69","m70","10.1107/S1600536803028162","","","0.71073","MoKα","","0.0573","0.0267","","","0.0403","0.0409","","","","","","0.911","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203060","12.489","0.001","20.4936","0.0016","8.4365","0.0006","90","","122.191","0.001","90","","1827.3","0.2","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H26 N4 Ni O7 -","- C12 H26 N4 Ni O7 -","- C48 H104 N16 Ni4 O28 -","4","0.5","CV6254","Shiu, Kom-Bei; Yen, Chia-Hung; Liao, Fen-Ling; Wang, Sue-Lein","<i>cis</i>-Diaquabis(ethylenediamine)nickel(II) benzene-1,4-dicarboxylate monohydrate","Acta Crystallographica Section E","2004","60","1","m121","m122","10.1107/S1600536803028988","","","0.71073","MoKα","","0.0366","0.033","","","0.0955","0.0973","","","","","","1.073","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203061","7.1736","0.0007","8.7391","0.0009","21.301","0.002","90","","90","","90","","1335.4","0.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Furodysinin lactone","","- C15 H20 O3 -","- C15 H20 O3 -","- C60 H80 O12 -","4","1","CV6255","K. Ravikumar; S. Selvanayagam; T. Venkateshwar Goud; P. Krishnaiah; Y. Venkateswarlu","A furodysinin lactone derivative from the marine sponge <i>Dysidea fragilis</i>","Acta Crystallographica Section E","2004","60","1","o139","o141","10.1107/S1600536803029143","","","0.71073","MoKα","","0.0424","0.0397","","","0.1022","0.1041","","","","","","1.126","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203062","14.6497","0.0014","5.6976","0.0003","21.965","0.002","90","","109.095","0.007","90","","1732.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-[2-Hydroxyimino-2-(3-methyl-3-phenylcyclobutyl)ethyl]isoindole-1,3-dione","","- C21 H20 N2 O3 -","- C21 H20 N2 O3 -","- C84 H80 N8 O12 -","4","1","DN6109","Özdemir, Namık; Dinçer, Muharrem; Yılmaz, İbrahim; Çukurovalı, Alaaddin","2-[2-Hydroxyimino-2-(3-methyl-3-phenylcyclobutyl)ethyl]isoindole-1,3-dione","Acta Crystallographica Section E","2004","60","1","o145","o147","10.1107/S1600536803029246","","","0.71073","MoKα","","0.0957","0.0545","","","0.1239","0.1337","","","","","","1.006","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203063","10.093","0.003","7.123","0.002","12.27","0.003","90","","110.4","0.01","90","","826.8","0.4","299","2","299","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-Methoxy-2-phenylacetic acid","","- C9 H10 O3 -","- C9 H10 O3 -","- C36 H40 O12 -","4","1","FL6069","Hartung, Jens; Špehar, Kristina; Svoboda, Ingrid; Fuess, Hartmut","2-Methoxy-2-phenylacetic acid","Acta Crystallographica Section E","2004","60","1","o95","o96","10.1107/S1600536803028228","","","0.71073","MoKα","","0.1055","0.0552","","","0.1369","0.1743","","","","","","0.883","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203064","7.2608","0.0002","5.0643","0.0002","19.9397","0.0006","90","","92.89","0.01","90","","732.27","0.04","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Methyl (R*,S*)-2-(2'-methylenecyclopropyl)hydroxyacetate","","- C7 H10 O3 -","- C7 H10 O3 -","- C28 H40 O12 -","4","1","FL6071","Yufit, Dmitrii S.; Bagutski, Viktor; Howard, Judith A.K.; de Meijere, Armin","(<i>R</i>*,<i>S</i>*)-Methyl 2-(2'-methylenecyclopropyl)hydroxyacetate","Acta Crystallographica Section E","2004","60","1","o40","o42","10.1107/S1600536803027430","","","0.71073","MoKα","","0.0374","0.0346","","","0.0999","0.1035","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203065","12.523","0.003","14.768","0.003","17.601","0.004","90","","96.35","0.03","90","","3235.2","1.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Triaqua-1κO,2κO,3κO-hexakis-μ-monochloroacetato- 1:2κ^4^O:O';2:3κ^4^O:O';1:3κ^4^O:O'-μ~3~-oxo-triiron(III) nitrate trihydrate","","- C12 H24 Cl6 Fe3 N O22 -","- C12 H24 Cl6 Fe3 N O22 -","- C48 H96 Cl24 Fe12 N4 O88 -","4","1","HB6001","Ren, X. M.; Okudera, H.; Kremer, R. K.","Triaqua-1κ<i>O</i>,2κ<i>O</i>,3κ<i>O</i>-hexakis-μ-chloroacetato-1:2κ^4^<i>O</i>:<i>O</i>';2:3κ^4^<i>O</i>:<i>O</i>';1:3κ^4^<i>O</i>:<i>O</i>'-μ~3~-oxo-triiron(III) nitrate trihydrate","Acta Crystallographica Section E","2004","60","1","m14","m16","10.1107/S1600536803026400","","","0.71073","MoKα","","0.045","0.035","","","0.096","0.099","","","","","","1.056","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203066","19.003","0.004","6.7188","0.0013","9.2156","0.0018","90","","99.37","0.03","90","","1160.9","0.4","296","2","296","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","[2-A-4,6-DMPyH]CuI2","(2-Amino-4,6-dimethylpyridinium)diiodocopper(I)","","- C7 H11 Cu I2 N2 -","- C7 H11 Cu I2 N2 -","- C28 H44 Cu4 I8 N8 -","4","0.5","HB6003","Haddad, Salim F.; AlDamen, Murad A.; Willett, Roger D.; Twamley, Brendan","A copper(I) iodide chain with the 2-amino-4,6-dimethylpyridine cation","Acta Crystallographica Section E","2004","60","1","m76","m78","10.1107/S1600536803027715","","","0.71073","MoKα","","0.0305","0.028","","","0.0729","0.075","","","","","","1.058","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203067","21.682","0.003","10.3815","0.0019","15.177","0.004","90","","120.03","0.03","90","","2957.6","1.4","293","2","","","","","","","","","","6","C 1 2 1","C 2y","5","","Tetra-μ-alpha-isoleucine-bis[tetraaquasamarium(III)] hexaperchlorate","","- C24 H68 Cl6 N4 O40 Sm2 -","- C24 H52 Cl5.998 N4 O39.992 Sm2 -","- C48 H104 Cl11.996 N8 O79.984 Sm4 -","2","0.5","HB6004","Jinping Wang; Chunji Niu; Ninghai Hu; Jiazuan Ni","Tetra-μ-<small>L</small>-isoleucine-bis[tetraaquasamarium(III)] hexaperchlorate","Acta Crystallographica Section E","2004","60","1","m32","m34","10.1107/S1600536803027557","","","0.71073","MoKα","","0.0571","0.052","","","0.1354","0.1392","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2203068","20.0943","0.0018","7.609","0.0006","12.1268","0.001","90","","121.708","0.003","90","","1577.4","0.2","133","2","133","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","cis-Diaquabis[2-(hydroxymethyl)pyridine]nickel(II) dichloride","","- C12 H18 Cl2 N2 Ni O4 -","- C12 H18 Cl2 N2 Ni O4 -","- C48 H72 Cl8 N8 Ni4 O16 -","4","0.5","HB6005","Hamamci, S.; Yilmaz, Veysel T.; Thöne, Carsten","<i>cis</i>-Diaquabis[2-(hydroxymethyl)pyridine]nickel(II) dichloride","Acta Crystallographica Section E","2004","60","1","m6","m8","10.1107/S1600536803026862","","","0.71073","MoKα","","0.0208","0.0193","","","0.0542","0.0549","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203069","16.596","0.001","16.596","0.001","11.996","0.002","90","","90","","90","","3304","0.6","293","2","","","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","","Bis(μ-1,2,4-triazole-κ^2^N^1^:N^2^)bis[aqua(oxalato-κ^2^O,O')copper(II)]","","- C8 H14 Cu2 N6 O12 -","- C8 H14 Cu2 N6 O12 -","- C64 H112 Cu16 N48 O96 -","8","0.25","HB6006","Castillo, Oscar; García-Couceiro, Urko; Luque, Antonio; García-Terán, Juan P.; Román, Pascual","Bis(μ-1,2,4-triazole-κ^2^<i>N</i>^1^:<i>N</i>^2^)bis[diaqua(oxalato-κ^2^<i>O,O</i>')copper(II)]","Acta Crystallographica Section E","2004","60","1","m9","m11","10.1107/S1600536803027119","","","0.71073","MoKα","","0.1029","0.0408","","","0.0993","0.1156","","","","","","0.977","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203070","17.1047","0.0011","16.8652","0.0011","18.9828","0.0012","90","","90","","90","","5476","0.6","130","0.2","130","0.2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C46 H51 B F24 N2 Si2 -","- C46 H51 B F24 N2 Si2 -","- C184 H204 B4 F96 N8 Si8 -","4","0.5","HG6001","Kathryn Hassall; Jonathan White","Dimethyl(2-trimethylsilylethyl)[(2-trimethylsilylethyl)dimethylammonio]ammonium tetrakis[3,5-bis(trifluoromethyl)phenyl]borate at 130K","Acta Crystallographica Section E","2004","60","1","o107","o108","10.1107/S1600536803025455","","","0.71073","MoKα","","0.0577","0.0464","","","0.1196","0.1261","","","","","","1.041","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203071","12.3829","0.0003","12.8139","0.0002","13.2413","0.0003","68.0725","0.0009","89.2421","0.0009","65.829","0.001","1753.78","0.07","291","1","291","1","","","","","","","","3","P -1","-P 1","2","","Ethyl rac-(1R,11S,12R)-12-hydroxy-15-oxobicyclo[9.3.1]pentadecane-1-carboxylate","","- C18 H30 O4 -","- C18 H30 O4 -","- C72 H120 O16 -","4","2","HG6009","Fresu, Sonia; Schürmann, Markus; Preut, Hans; Eilbracht, Peter","<i>rac</i>-(1<i>R</i>,11<i>S</i>,12<i>R</i>)-Ethyl 12-hydroxy-15-oxobicyclo[9.3.1]pentadecane-1-carboxylate","Acta Crystallographica Section E","2004","60","1","o22","o24","10.1107/S160053680302717X","","","0.71073","MoKα","","0.1879","0.0435","","","0.0769","0.0918","","","","","","0.861","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203072","20.736","0.004","8.4331","0.0017","14.106","0.003","90","","90.971","0.003","90","","2466.3","0.9","130","2","130","0.2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H13 N O4 S -","- C12 H13 N O4 S -","- C96 H104 N8 O32 S8 -","8","1","HG6012","Laura Andrau; Jonathan White","Low-temperature 4-thiacyclohexyl <i>m</i>-nitrobenzoate","Acta Crystallographica Section E","2004","60","1","o134","o136","10.1107/S1600536803029040","","","0.71073","MoKα","","0.0573","0.0474","","","0.1265","0.1322","","","","","","0.993","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203073","9.688","0.002","9.331","0.002","12.034","0.002","90","","102.04","0.03","90","","1063.9","0.4","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[CuBr~2~(C~12~H~8~N~2~)~2~]","Trans-dibromobis(phenazine)copper(II)","","- C24 H16 Br2 Cu N4 -","- C24 H16 Br2 Cu N4 -","- C48 H32 Br4 Cu2 N8 -","2","0.5","HG6013","Maniukiewicz, Waldemar; Bukowska-Strzyżewska, Maria; Sadowska, Maja","<i>trans</i>-Dibromobis(phenazine)copper(II)","Acta Crystallographica Section E","2004","60","1","m73","m75","10.1107/S1600536803027703","","","0.71073","MoKα","","0.0372","0.0307","","","0.0736","0.0771","","","","","","1.121","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203074","9.1755","0.0009","9.4488","0.0007","19.7807","0.0018","90","","90","","90","","1714.9","0.3","293","2","293","2","","","","","","","","4","P 21 n b","P -2bc 2a","33","","1-Methyl-1-phenyl-3-(phthalimidoacetyl)cyclobutane","","- C21 H19 N O3 -","- C21 H19 N O3 -","- C84 H76 N4 O12 -","4","1","LH6137","Özdemir, Namık; Dinçer, Muharrem; Yılmaz, İbrahim; Çukurovalı, Alaaddin","1-Methyl-1-phenyl-3-(phthalimidoacetyl)cyclobutane","Acta Crystallographica Section E","2004","60","1","o14","o16","10.1107/S1600536803026497","","","0.71073","MoKα","","0.0448","0.0325","","","0.0647","0.0672","","","","","","1.008","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203075","21.345","0.004","5.387","0.001","11.787","0.002","90","","90.48","0.01","90","","1355.3","0.4","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H14 N4 Ni O S -","- C13 H14 N4 Ni O S -","- C52 H56 N16 Ni4 O4 S4 -","4","1","LH6143","Valdés Martínez, Jesús; Hernández-Ortega, Simón; Bautista Jimenez, Victor","Hydrogen bonding in coordinated thiosemicarbazones: ammine[2-hydroxy-1-naphthaldehyde 4-methylthiosemicarbazonato]nickel(II)","Acta Crystallographica Section E","2004","60","1","m42","m44","10.1107/S1600536803027971","","","0.71073","MoKα","","0.0511","0.0344","","","0.076","0.0804","","","","","","0.896","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203076","24.975","0.002","9.714","0.001","6.5213","0.0004","90","","95.327","0.001","90","","1575.3","0.2","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","Diaqua(diethylenetriamine-κ^3^N)(perchlorato-κO)copper(II) hydrogenmaleate","","- C8 H20 Cl Cu N3 O10 -","- C8 H20 Cl Cu N3 O10 -","- C32 H80 Cl4 Cu4 N12 O40 -","4","0.5","LH6145","Valdés-Martínez, Jesús; Toscano, Rubén A.; Del Río-Ramírez, Marisa","Diaqua(diethylenetriamine-κ^3^<i>N</i>)(perchlorato-κ<i>O</i>)copper(II) hydrogenmaleate","Acta Crystallographica Section E","2004","60","1","m45","m47","10.1107/S160053680302779X","","","0.71073","MoKα","","0.048","0.0429","","","0.111","0.1147","","","","","","1.071","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203077","13.827","0.006","29.9","0.014","4.244","0.002","90","","90","","90","","1754.6","1.4","150","2","150","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C20 H20 O8 -","- C20 H20 O8 -","- C80 H80 O32 -","4","1","LH6146","Dachriyanus; Rizal Fahmi; Sargent, Melvyn V.; Skelton, Brian W.; White, Allan H.","5-Hydroxy-3,3',4',5',7-pentamethoxyflavone (combretol)","Acta Crystallographica Section E","2004","60","1","o86","o88","10.1107/S1600536803027880","","","0.71073","MoKα","","0.106","0.053","","0.072","","0.059","","","1.062","","","1.136","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203078","11.9275","0.0006","13.8407","0.0008","8.4595","0.0003","90","","99.192","0.003","90","","1378.6","0.12","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Diethyl 2-(4-nitrophenyl)malonate","","- C13 H15 N O6 -","- C13 H15 N O6 -","- C52 H60 N4 O24 -","4","1","LH6149","Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Wardell, James L.","Diethyl 2-(4-nitrophenyl)malonate forms a hydrogen-bonded chain of rings","Acta Crystallographica Section E","2004","60","1","o60","o62","10.1107/S1600536803027478","","","0.71073","MoKα","","0.0923","0.0479","","","0.1078","0.1254","","","","","","1.003","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203079","13.403","0.002","15.5692","0.001","17.235","0.002","90","","90","","90","","3596.5","0.7","93","2","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C46 H38 O6 -","- C46 H38 O6 -","- C184 H152 O24 -","4","1","LH6152","Kawanami, Toshio; Ishizuka, Kentaro; Furuno, Hiroshi; Inanaga, Junji","Unique hydrogen bonding in the acetone-mediated helical structure of (<i>R</i>,<i>R</i>)-3,3'-bisBINOL","Acta Crystallographica Section E","2004","60","1","o97","o98","10.1107/S1600536803028538","","","0.7107","MoKα","","0.0396","0.0369","","","0.0884","0.0996","","","","","","1.087","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203080","9.8563","0.0014","11.3662","0.0015","32.868","0.003","90","","91.124","0.013","90","","3681.5","0.8","294","1","294","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H35 As O2 Si2 -","- C42 H35 As O2 Si2 -","- C168 H140 As4 O8 Si8 -","4","1","LH6153","Ferguson, George; O'Leary, Brian J.; Spalding, Trevor R.","Bis(triphenylsilyl)phenylarsenite, PhAs(OSiPh~3~)~2~","Acta Crystallographica Section E","2004","60","1","m118","m120","10.1107/S1600536803028447","","","0.71073","MoKα","","0.2156","0.0604","","","0.1493","0.1852","","","","","","0.878","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203081","9.449","0.0019","11.291","0.002","13.637","0.003","111.7","0.03","94.33","0.03","90.97","0.03","1346.4","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H22 Cl2 N6 O2 Zn -","- C28 H22 Cl2 N6 O2 Zn -","- C56 H44 Cl4 N12 O4 Zn2 -","2","1","NA6269","Fangfang Jian; Hailian Xiao; Pingping Sun","Bis(1-acetophenone-1<i>H</i>-benzotriazole-κ<i>N</i>^3^)dichlorozinc(II)","Acta Crystallographica Section E","2004","60","1","m38","m39","10.1107/S1600536803027570","","","0.71073","MoKα","","0.1188","0.0453","","","0.0918","0.1096","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203082","10.8456","0.0006","14.1502","0.0008","15.2068","0.0009","90","","92.053","0.001","90","","2332.3","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-(2-Cholorophenyl)-1H-indan-2-spiro-2'-pyrrolizidine-3'-spiro-3''- 1H-indole-1,3,2''(2H,3''H)-trione","","- C28 H21 Cl N2 O3 -","- C28 H21 Cl N2 O3 -","- C112 H84 Cl4 N8 O12 -","4","1","NA6271","M. M. Govind; S. Selvanayagam; D. Velmurugan; K. Ravikumar; A. R. Sureshbabu; R.Raghunathan","1-(2-Chlorophenyl)-1<i>H</i>-indan-2-spiro-2'-pyrrolizidine-3'-spiro-3''-1<i>H</i>-indole-1,3,2''(2<i>H</i>,3''<i>H</i>)-trione","Acta Crystallographica Section E","2004","60","1","o54","o56","10.1107/S1600536803027284","","","0.71073","MoKα","","0.0799","0.0581","","","0.1621","0.1783","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203083","11.5085","0.0009","9.5986","0.0008","23.0306","0.0018","90","","91.232","0.001","90","","2543.5","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-Benzoyl-acenaphthylene-1-spiro-3'-pyrrolizidine-2'-spiro-3''- 1H-indole-2,2''(1H,3''H)-dione","","- C32 H23 Cl N2 O3 -","- C32 H23 Cl N2 O3 -","- C128 H92 Cl4 N8 O12 -","4","1","NA6272","M. M. Govind; S. Selvanayagam; D. Velmurugan; K. Ravikumar; A. R. Sureshbabu; R. Raghunathan","1-Benzoylacenaphthylene-1-spiro-3'-pyrrolizidine-2'-spiro-3''-1<i>H</i>-indole-2,2''(1<i>H</i>,3''<i>H</i>)-dione","Acta Crystallographica Section E","2004","60","1","o57","o59","10.1107/S1600536803027296","","","0.71073","MoKα","","0.0679","0.0513","","","0.1451","0.1599","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203084","7.836","0.003","7.8011","0.0014","17.923","0.007","90","","95.48","0.03","90","","1090.6","0.6","153","2","153","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(+)-pinoresinol‒dioxane (1/1)","","- C24 H30 O8 -","- C24 H30 O8 -","- C48 H60 O16 -","2","1","NA6275","Stomberg, Rolf; Langer, Vratislav; Lundquist, Knut","A second polymorph of (+)-pinoresinol‒dioxane (1/1)","Acta Crystallographica Section E","2004","60","1","o81","o83","10.1107/S1600536803027806","","","0.71069","MoKα","","0.0741","0.0426","","","0.1254","0.1772","","","","","","1.169","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203085","9.6583","0.0004","12.0849","0.0005","14.9557","0.0007","90","","101.47","0.001","90","","1710.76","0.13","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H24 Cl4 N2 Zn -","- C10 H24 Cl4 N2 Zn -","- C40 H96 Cl16 N8 Zn4 -","4","1","NA6277","Fowkes, Adrian; Harrison, William T. A.","Bis(piperidinium) tetrachlorozincate","Acta Crystallographica Section E","2004","60","1","m59","m61","10.1107/S1600536803027661","","","0.71073","MoKα","","0.049","0.0298","","","0.0664","0.0719","","","","","","0.965","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203086","11.9569","0.0011","12.0716","0.0017","12.1417","0.0017","104.944","0.012","105.414","0.01","116.683","0.01","1357.1","0.4","152","2","152","2","","","","","","","","6","P -1","-P 1","2","","diaqua(1,5-cyclooctadiene)rhodium(I) triflate","","- C9 H16 F3 O5 Rh S -","- C9 H16 F3 O5 Rh S -","- C36 H64 F12 O20 Rh4 S4 -","4","2","NA6278","Bats, Jan W.; Rivas Nass, Andreas; Hashmi, A. Stephen K.","Low-temperature phase of diaqua(1,5-cyclooctadiene)rhodium(I) trifluoromethanesulfonate","Acta Crystallographica Section E","2004","60","1","m85","m87","10.1107/S160053680302823X","","","0.71073","MoKα","","0.059","0.0552","","","0.1345","0.1402","","","","","","1.083","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2203087","17.209","0.0017","8.9038","0.0006","19.9334","0.0019","90","","99.084","0.008","90","","3016","0.5","293","","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-[N-(p-Hydroxyphenyl)aminomethylidene]naphthalen-2(1H)-one‒propan-1-ol (2/1)","","- C37 H34 N2 O5 -","- C37 H34 N2 O5 -","- C148 H136 N8 O20 -","4","1","NA6281","Odabas̨oǧlu, Mustafa; Albayrak, Çiǧdem; Büyükgüngör, Orhan","1-[<i>N</i>-(<i>p</i>-Hydroxyphenyl)aminomethylidene]naphthalen-2(1<i>H</i>)-one propan-1-ol hemisolvate","Acta Crystallographica Section E","2004","60","1","o142","o144","10.1107/S1600536803029222","","","0.71073","MoKα","","0.0922","0.0471","","","0.1207","0.1362","","","","","","0.877","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203088","10.1324","0.0007","11.3356","0.0008","12.2","0.0009","104.041","0.001","95.208","0.001","110.685","0.001","1247.48","0.15","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","Bis[bis(1,10-phenanthroline)chlorocopper(II)] benzene-1,2,4,5-tetracarboxylate(2-) dihydrate","","- C58 H40 Cl2 Cu2 N8 O10 -","- C58 H40 Cl2 Cu2 N8 O10 -","- C58 H40 Cl2 Cu2 N8 O10 -","1","0.5","NG6004","Hong-Ping Xiao; Mao-Lin Hu; Xin-Hua Li","Bis[bis(1,10-phenanthroline)chlorocopper(II)] benzene-1,2,4,5-tetracarboxylate(2‒) dihydrate","Acta Crystallographica Section E","2004","60","1","m71","m72","10.1107/S1600536803028101","","","0.71073","MoKα","","0.0353","0.0323","","","0.0896","0.0913","","","","","","1.073","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203089","10.03","0.002","12.078","0.002","12.858","0.003","62.13","0.03","84.36","0.03","73.23","0.03","1317.2","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis[aquachlorobis(1,10-phenanthroline)manganese(II)] benzene-1,4-dioxyacetate dihydrate","","- C58 H48 Cl2 Mn2 N8 O10 -","- C58 H48 Cl2 Mn2 N8 O10 -","- C58 H48 Cl2 Mn2 N8 O10 -","1","0.5","NG6005","Shan Gao; Ji-Wei Liu; Li-Hua Huo; Hui Zhao; Jing-Gui Zhao","Bis[aquachlorobis(1,10-phenanthroline)manganese(II)] benzene-1,4-dioxyacetate dihydrate","Acta Crystallographica Section E","2004","60","1","m113","m115","10.1107/S1600536803028782","","","0.71073","MoKα","","0.058","0.0393","","","0.0932","0.0985","","","","","","1.014","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203090","13.195","0.003","6.668","0.001","9.666","0.002","90","","92.14","0.03","90","","849.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Hexaaquacobalt(II) 1,5-naphthalenedisulfonate","","- C10 H18 Co O12 S2 -","- C10 H18 Co O12 S2 -","- C20 H36 Co2 O24 S4 -","2","0.5","NG6006","An, Dao-Li; Gao, Shan; Zhu, Zhi-Biao; Huo, Li-Hua; Zhao, Hui","Hexaaquacobalt(II) 1,5-naphthalenedisulfonate","Acta Crystallographica Section E","2004","60","1","m111","m112","10.1107/S1600536803028794","","","0.71073","MoKα","","0.0262","0.0245","","","0.0677","0.0686","","","","","","1.073","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203091","8.8608","0.0005","10.9102","0.0004","12.2876","0.0005","90","","106.018","0.002","90","","1141.76","0.09","296.2","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H28 I2 N2 O -","- C21 H28 I2 N2 O -","- C42 H56 I4 N4 O2 -","2","1","OB6320","Naokazu Yoshikawa; Keiko Takemoto; Jun Sakamoto; Nobuko Kanehisa; Yasushi Kai; Hiroshi Takashima; Keiichi Tsukahara","(11<i>S</i>)-(+)-<i>N,N</i>'-Dimethylcinchoninium diiodide","Acta Crystallographica Section E","2004","60","1","o17","o18","10.1107/S1600536803027181","","","0.7107","MoKα","","","0.0493","","","","0.107","","","","","","1.483","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203092","8.14","0.001","18.522","0.002","12.963","0.002","90","","94.32","0.01","90","","1948.9","0.4","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","5,5-dimethyl-8,9-methylenedioxyl-2,3-diphenyl- 5,6-dihydroimidazo[1,2-c]quinazoline","","- C24 H21 N3 -","- C24 H21 N3 -","- C96 H84 N12 -","4","1","OB6321","Hui Wu; Daqing Shi; Chunling Shi; Juxian Wang; Xiangshan Wang; Hongwen Hu; Kaibei Yu","5,5-Dimethyl-2,3-diphenyl-5,6-dihydroimidazo[1,2-<i>c</i>]quinazoline","Acta Crystallographica Section E","2004","60","1","o9","o11","10.1107/S1600536803027089","","","0.71073","MoKα","","0.0697","0.0388","","","0.1014","0.1082","","","","","","0.962","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203093","8.258","0.006","11.615","0.008","12.873","0.009","108.694","0.011","99.9","0.012","98.089","0.013","1126.5","1.4","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Hexaaquacobalt(II) trans-bis(η^3^-pyridine-2,6- dicarboxylato-κ^3^O,N,O')cobaltate(II) dihydrate","","- C14 H22 Co2 N2 O16 -","- C14 H22 Co2 N2 O16 -","- C28 H44 Co4 N4 O32 -","2","1","OB6327","Shiu, Kom-Bei; Yen, Chia-Hung; Liao, Fen-Ling; Wang, Sue-Lein","Hexaaquacobalt(II) <i>trans</i>-bis(η^3^-pyridine-2,6-dicarboxylato-κ^3^<i>O,N,O</i>')cobaltate(II) dihydrate","Acta Crystallographica Section E","2004","60","1","m35","m37","10.1107/S1600536803027491","","","0.71073","MoKα","","0.1887","0.0936","","","0.1968","0.2278","","","","","","1.056","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203094","10.3841","0.0013","10.0409","0.0013","21.911","0.003","90","","90","","90","","2284.6","0.5","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","2-(2-pyridyl)benzo[1,2-d-4,5-d']diimidazole","","- C13 H9 N5 -","- C13 H9 N5 -","- C104 H72 N40 -","8","1","OB6328","Lin, Xiao-Ju; Li, Yi-Zhi; Xu, Hai-Jun; Liu, Sheng-Gui; Xu, Li; Shen, Zhen; You, Xiao-Zeng","2-(2-Pyridyl)benzo[1,2-<i>d</i>;4,5-<i>d</i>']diimidazole","Acta Crystallographica Section E","2004","60","1","o77","o78","10.1107/S1600536803028113","","","0.71073","MoKα","","0.1052","0.0615","","","0.1313","0.1461","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203095","10.1557","0.0006","14.5963","0.0008","15.5209","0.0009","74.354","0.001","84.621","0.001","85.052","0.001","2201.3","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Bis{di-μ-isobutyrato-bis[cis-diammineplatinum(II)]} tetrakis(perchlorate)","","- C16 H52 Cl4 N8 O24 Pt4 -","- C16 H50 Cl4 N8 O24 Pt4 -","- C32 H100 Cl8 N16 O48 Pt8 -","2","1","OB6329","Sakai, Ken; Ishigami, Eri","Bis{di-μ-isobutyrato-bis[<i>cis</i>-diammineplatinum(II)]} tetraperchlorate","Acta Crystallographica Section E","2004","60","1","m65","m68","10.1107/S160053680302782X","","","0.71073","MoKα","","0.0532","0.0431","","","0.0988","0.1017","","","","","","0.963","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203096","7.2972","0.0005","12.7313","0.0008","15.7612","0.001","98.266","0.001","98.963","0.001","105.187","0.001","1369.45","0.15","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Bis(2-aminopyridine)(2,2'-bipyridine)platinum(II) tetracyanoplatinate(II) dihydrate","","- C24 H24 N10 O2 Pt2 -","- C24 H20 N10 O2 Pt2 -","- C48 H40 N20 O4 Pt4 -","2","1","OB6331","Sakai, Ken; Mizota, Mina; Akiyama, Norinobu","Bis(2-aminopyridine)(2,2'-bipyridine)platinum(II) tetracyanoplatinate(II) dihydrate","Acta Crystallographica Section E","2004","60","1","m88","m90","10.1107/S1600536803028332","","","0.71073","MoKα","","0.0565","0.0466","","","0.1253","0.1306","","","","","","1.1","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203097","7.5305","0.001","25.241","0.003","14.49","0.002","90","","98.639","0.003","90","","2723","0.6","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Triphenylphenacylphosphonium picrate","(benzoylmethyl)triphenylphosphonium 2,4,6-trinitrophenolate","","- C32 H24 N3 O8 P -","- C32 H24 N3 O8 P -","- C128 H96 N12 O32 P4 -","4","1","OB6333","Mahimaidoss Baby Mariyatra; Elinor C. Spencer; Krishanaswamy Panchanatheswaran; Judith A. K. Howard","Phenacyltriphenylphosphonium picrate: intra-and interionic C—H···O interactions","Acta Crystallographica Section E","2004","60","1","o123","o125","10.1107/S1600536803028940","","","0.71073","MoKα","","0.0533","0.0411","","","0.1011","0.1083","","","","","","1.014","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203098","5.458","0.002","5.3326","0.0019","30.4527","0.0012","90","","91.102","0.013","90","","886.2","0.5","296","1","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H32 Cl2 -","- C16 H32 Cl2 -","- C32 H64 Cl4 -","2","0.5","OB6334","Naotake Nakamura; Hirotaka Shimizu","1,16-Dichlorohexadecane","Acta Crystallographica Section E","2004","60","1","o131","o133","10.1107/S1600536803029027","","","1.5418","CuKα","","","0.05","","","","0.12","","","","","","1.003","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203099","6.898","0.004","8.904","0.006","11.139","0.007","76.577","0.008","89.075","0.008","71.959","0.007","631.6","0.7","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","1-Methyl-N-(2-{[(1-methyl-4-nitro-1H-pyrrol-2-yl)carbonyl]amino}ethyl)- 4-nitro-1H-pyrrole-2-carboxamide dimethylformamide disolvate","","- C20 H30 N8 O8 -","- C20 H30 N8 O8 -","- C20 H30 N8 O8 -","1","0.5","OM6190","Lu, Li-Ping; Zhu, Miao-Li; Yang, Pin","1-Methyl-<i>N</i>-(2-{[(1-methyl-4-nitro-1<i>H</i>-pyrrol-2-yl)carbonyl]amino}ethyl)-4-nitro-1<i>H</i>-pyrrole-2-carboxamide dimethylformamide disolvate","Acta Crystallographica Section E","2004","60","1","o35","o36","10.1107/S1600536803026291","","","0.71073","MoKα","","0.118","0.097","","","0.212","0.222","","","","","","1.171","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203100","11.6959","0.0009","10.6136","0.0009","15.3474","0.0012","90","","91.638","0.002","90","","1904.4","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Ferrocenylmethyl)trimethylammonium triiodide","","- C14 H20 Fe I3 N -","- C14 H20 Fe I3 N -","- C56 H80 Fe4 I12 N4 -","4","1","OM6194","Blake, Alexander J.; Caltagirone, Claudia; Lippolis, Vito; Schröder, Martin; Wilson, Claire","(Ferrocenylmethyl)trimethylammonium triiodide","Acta Crystallographica Section E","2004","60","1","m20","m21","10.1107/S1600536803026084","","","0.71073","MoKα","","0.03","0.026","","","0.061","0.062","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203101","9.13","0.003","10.321","0.004","10.904","0.004","106.791","0.006","107.621","0.005","104.581","0.005","870.3","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","bis(4-benzoyl-3-methyl-1-phenyl-1H-pyrazol-5-one)diethanolcadmium(II)","","- C38 H38 Cd N4 O6 -","- C38 H38 Cd N4 O6 -","- C38 H38 Cd N4 O6 -","1","0.5","OM6195","Hai-Zhen Xu; You-Quan Zhu; Xin Zhang; Hua-Ling Zhu","Bis(4-benzoyl-3-methyl-1-phenyl-1<i>H</i>-pyrazol-5-onato)diethanolcadmium(II)","Acta Crystallographica Section E","2004","60","1","m96","m97","10.1107/S160053680302854X","","","0.71073","MoKα","","0.0567","0.0409","","","0.0794","0.0837","","","","","","0.982","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203102","9.242","0.002","27.044","0.007","12.722","0.003","90","","92.862","0.004","90","","3175.8","1.3","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,4,6-Trimethyl-1,3,5-tris(4-formylphenoxymethyl)benzene ethyl acetate solvate","","- C37 H38 O8 -","- C37 H38 O8 -","- C148 H152 O32 -","4","1","OM6196","David J. Bray; Leonard F. Lindoy; John C. McMurtrie","1,3,5-Tris(4-formylphenoxymethyl)-2,4,6-trimethylbenzene ethyl acetate solvate","Acta Crystallographica Section E","2004","60","1","o6","o8","10.1107/S160053680302703X","","","0.71073","MoKα","","0.078","0.053","","","0.133","0.1466","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203103","5.644","0.002","8.0547","0.0018","12.716","0.002","75.032","0.013","87.759","0.013","87.079","0.012","557.5","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H20 N6 Ni O10 -","- C20 H20 N6 Ni O10 -","- C20 H20 N6 Ni O10 -","1","0.5","OM6197","Tu-Gen Xu; Duan-Jun Xu","Diaquabis(imidazole-κ<i>N</i>)bis(nitrobenzoato-κ<i>O</i>)nickel(II)","Acta Crystallographica Section E","2004","60","1","m27","m29","10.1107/S160053680302748X","","","0.71069","MoKα","","0.028","0.026","","","0.067","0.068","","","","","","1.091","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203104","9.2127","0.0013","12.9944","0.0019","10.5892","0.0015","90","","93.267","0.002","90","","1265.6","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","p-methylphenyl 3-nitrobenzenesulfonate","4-Methylphenyl 3-nitrobenzenesulfonate","","- C13 H11 N O5 S -","- C13 H11 N O5 S -","- C52 H44 N4 O20 S4 -","4","1","OM6198","Nagarajan Vembu; Maruthai Nallu; Semih Durmus; Mathew Pazner; Jered Garrison; Wiley J. Youngs","4-Methylphenyl 3-nitrobenzenesulfonate","Acta Crystallographica Section E","2004","60","1","o1","o3","10.1107/S1600536803027090","","","0.71073","MoKα","","0.0364","0.0332","","","0.0888","0.0911","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203105","11.2578","0.0005","14.6014","0.0007","15.1903","0.0005","90","","90.212","0.003","90","","2496.96","0.18","277","1","297","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3-diethylbenzimidazolium iodide","","- C11 H15 I N2 -","- C11 H15 I N2 -","- C88 H120 I8 N16 -","8","2","OM6199","Robert T. Stibrany; Harvey J. Schugar; Joseph A. Potenza","1,3-Diethylbenzimidazolium iodide","Acta Crystallographica Section E","2004","60","1","o28","o30","10.1107/S1600536803027168","","","0.71073","MoKα","","0.0577","0.0414","","","0.0985","0.1142","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203106","9.8828","0.0019","5.8836","0.0017","12.5231","0.0012","90","","95.684","0.01","90","","724.6","0.3","296","","296","","","","","","","","","2","P 1 21 1","P 2yb","4","","9-(p-Methylphenyl)fluorene","","- C20 H16 -","- C20 H16 -","- C40 H32 -","2","1","OM6200","McLean, Aaron W.; Meyers, Cal Y.; Robinson, Paul D.","9-(<i>p</i>-Methylphenyl)fluorene","Acta Crystallographica Section E","2004","60","1","o75","o76","10.1107/S1600536803028095","","","0.71069","MoKα","","0.097","0.038","","","0.096","0.117","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203107","8.3541","0.001","13.6308","0.001","15.4932","0.001","90","","90","","90","","1764.3","0.3","293","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H27 N O4 -","- C20 H27 N O4 -","- C80 H108 N4 O16 -","4","1","RN6006","Abrahão-Júnior, Odonirio; Guilardi, Silvana; Maltha, Celia Regina A.; Piló-Veloso, Dorila","6α-Hydroxy-17β-azavouacapane-17,7β-carbolactone","Acta Crystallographica Section E","2004","60","1","o72","o74","10.1107/S1600536803027533","","","0.71073","MoKα","","","0.0416","","","","0.1169","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203108","12.124","0.002","13.464","0.003","17.483","0.004","90","","108.55","0.03","90","","2705.6","1.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H34 Co N6 O10 -","- C22 H34 Co N6 O10 -","- C88 H136 Co4 N24 O40 -","4","0.5","RN6007","Jin Yang; Jian-Fang Ma; Jing-Fu Liu","A coordination polymer of Co^II^ with 1,1'-(1,4-butanediyl)bis(imidazole)","Acta Crystallographica Section E","2004","60","1","m24","m26","10.1107/S1600536803027272","","","0.71073","MoKα","","0.0336","0.0273","","","0.0755","0.0769","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203109","4.503","0.002","21.234","0.008","6.936","0.002","90","","94.36","0.03","90","","661.3","0.4","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C H9 Cl2 N5 -","- C H9 Cl2 N5 -","- C4 H36 Cl8 N20 -","4","1","RN6008","A. van der Lee; M. Barboiu","1-Amino-3-ammonioguanidinium dichloride","Acta Crystallographica Section E","2004","60","1","o89","o91","10.1107/S160053680302840X","","","0.71073","MoKα","","0.0718","0.0524","","0.1072","0.0898","0.0898","","","","","","0.9953","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203110","18.367","0.002","10.201","0.002","20.242","0.002","90","","107.318","0.003","90","","3620.6","0.9","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Bis{μ-2'-[1-(4-chloro-2-oxidophenyl)ethylidene]thiophene-2- carbohydrazidato}bis[pyridinezinc(II)]","","- C36 H28 Cl2 N6 O4 S2 Zn2 -","- C36 H28 Cl2 N6 O4 S2 Zn2 -","- C144 H112 Cl8 N24 O16 S8 Zn8 -","4","1","RN6010","Hapipah Ali; Mohammad, Mazliza; M. Sukeri. M.Yusof; Bohari. M.Yamin","Bis{μ-2'-[1-(4-chloro-2-oxidophenyl)ethylidene]thiophene-2-carbohydrazidato}bis[pyridinezinc(II)]","Acta Crystallographica Section E","2004","60","1","m123","m125","10.1107/S160053680302909X","","","0.71073","MoKα","","0.06","0.048","","","0.131","0.138","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203111","7.911","0.004","9.84","0.005","21.292","0.01","101.291","0.007","93.077","0.007","92.768","0.007","1620.1","1.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Trans-Bis{2- [(3-cyclohexylaminopropylimino)methyl]phenolato}diazidonickel(II)","","- C32 H48 N10 Ni O2 -","- C32 H48 N10 Ni O2 -","- C64 H96 N20 Ni2 O4 -","2","1","SU6050","You, Zhong-Lu; Xiong, Zhong-Duo; Liu, Wei-Sheng; Tan, Min-Yu; Zhu, Hai-Liang","<i>trans</i>-Diazidobis{2-[(3-cyclohexylaminopropylimino)methyl]phenolato}nickel(II)","Acta Crystallographica Section E","2004","60","1","m79","m81","10.1107/S1600536803027235","","","0.71073","MoKα","","0.0726","0.0429","","","0.0928","0.1034","","","","","","0.855","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203112","9.3973","0.0005","10.876","0.0005","7.6283","0.0004","90","","115.026","0.002","90","","706.45","0.06","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C6 H12 K2 Ni O12 -","- C6 H12 K2 Ni O12 -","- C12 H24 K4 Ni2 O24 -","2","0.25","SU6059","Xunwen Xiao; Wei Xu; Yan Li; Bin Zhang; Daoben Zhu","Dipotassium diaquabis(malonato-κ^2^<i>O,O</i>')nickelate(II) dihydrate","Acta Crystallographica Section E","2004","60","1","m48","m49","10.1107/S1600536803027508","","","0.71073","MoKα","","0.0211","0.0191","","","0.0501","0.0507","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203113","7.6307","0.0007","8.5404","0.0008","9.1204","0.001","71.019","0.009","81.102","0.008","72.999","0.008","536.32","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-Chloromethyl-5-methoxy-4-methoxycarbonyl-3-oxo-2,3-dihydro-[1,3]oxaphosphole monohydrate","","- C7 H12 Cl O6 P -","- C7 H12 Cl O6 P -","- C14 H24 Cl2 O12 P2 -","2","1","SU6060","Ciptadi, Ciptadi; Cristau, Henri Jean; Bekro, Yves Alain; Tillard, Monique; Virieux, David","3-Chloromethyl-5-methoxy-4-methoxycarbonyl-3-oxo-2,3-dihydro-[1,3]oxaphosphole monohydrate","Acta Crystallographica Section E","2004","60","1","o99","o101","10.1107/S1600536803027351","","","0.71073","MoKα","","0.0481","0.0436","","","0.1257","0.1315","","","","","","1.098","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203114","8.629","0.002","10.059","0.002","13.254","0.003","94.48","0.03","95.15","0.03","114.49","0.03","1034.2","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Aqua(1H-imidazole-κN^3^)(triethanolamine-κ^3^O)copper(II) perchlorate benzene-1,4-dioxyacetate hemisolvate","","- C28 H50 Cl2 Cu2 N6 O22 -","- C28 H50 Cl2 Cu2 N6 O22 -","- C28 H50 Cl2 Cu2 N6 O22 -","1","0.5","SU6063","Gao, Shan; Liu, Ji-Wei; Li, Jian-Rong; Huo, Li-Hua; Zhao, Hui","Aqua(1<i>H</i>-imidazole-κ<i>N</i>^3^)(triethanolamine-κ^3^<i>O</i>)copper(II) perchlorate hemi(benzene-1,4-dioxyacetate)","Acta Crystallographica Section E","2004","60","1","m94","m95","10.1107/S1600536803028630","","","0.71073","MoKα","","0.045","0.035","","","0.088","0.092","","","","","","1.06","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2203115","15.5021","0.0015","10.5534","0.0016","11.2637","0.0011","90","","107.294","0.008","90","","1759.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Hydroxy-6-methyl-2-[4-(3-trifluoromethylphenyl)piperazin-1-ylmethyl]- 4H-pyran-4-one","","- C18 H19 F3 N2 O3 -","- C18 H19 F3 N2 O3 -","- C72 H76 F12 N8 O12 -","4","1","SU6064","Köysal, Yavuz; Işık, Şamil; Aytemir, Mutlu","3-Hydroxy-6-methyl-2-[4-(3-trifluoromethylphenyl)piperazin-1-ylmethyl]-4<i>H</i>-pyran-4-one","Acta Crystallographica Section E","2004","60","1","o112","o114","10.1107/S1600536803028642","","","0.71073","MoKα","","0.122","0.05","","","0.107","0.121","","","","","","0.699","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2203116","3.971","0.006","11.238","0.004","16.947","0.007","90","","91.24","0.07","90","","756.1","1.2","120","1","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H8 N2 O -","- C9 H8 N2 O -","- C36 H32 N8 O4 -","4","1","SU6065","Nikolaenko, Igor V.; Munro, Orde Q.","3-Methyl-1<i>H</i>-quinoxalin-2-one","Acta Crystallographica Section E","2004","60","1","o92","o94","10.1107/S1600536803028368","","","0.71073","MoKα","","","0.0579","","","","0.1673","","","","","","0.946","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203117","20.9","0.004","8.8496","0.0018","19.845","0.004","90","","118.26","0.03","90","","3233","1.4","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","Di-iodo-bis(o-chlorophenylbenzoylthiourea-κS)mercury(II)","","- C28 H22 Cl2 Hg I2 N4 O2 S2 -","- C28 H22 Cl2 Hg I2 N4 O2 S2 -","- C112 H88 Cl8 Hg4 I8 N16 O8 S8 -","4","0.5","SU6067","Yusof, M. Sukeri. M.; Yamin, Bohari. M.; Kassim, M. B.","Bis(<i>o</i>-chlorophenylbenzoylthiourea-κ<i>S</i>)diiodomercury(II)","Acta Crystallographica Section E","2004","60","1","m98","m99","10.1107/S1600536803028654","","","0.71073","MoKα","","0.054","0.042","","","0.094","0.098","","","","","","1.073","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203118","8.546","0.004","24.166","0.003","12.057","0.008","90","","104.67","0.02","90","","2409","2","293","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Ethyl 3-{[(2-chlorophenyl)sulfonyl]imino}-2-{[(3,5- dimethoxyphenyl)amino]carbonyl}-3-(methylsulfanyl)propanoate","","- C21 H23 Cl N2 O7 S2 -","- C21 H23 Cl N2 O7 S2 -","- C84 H92 Cl4 N8 O28 S8 -","4","1","TK6140","Colin H. L. Kennard; Helen G. McFadden; Karl A. Byriel","Ethyl 3-{[(2-chlorophenyl)sulfonyl]imino}-2-{[(3,5-dimethoxyphenyl)amino]carbonyl}-3-(methylsulfanyl)propanoate","Acta Crystallographica Section E","2004","60","1","o102","o103","10.1107/S1600536803026369","","","0.71073","Mokα","","0.218","0.043","","","0.098","0.152","","","","","","0.91","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203119","5.0407","0.0007","23.036","0.003","6.6601","0.0009","90","","111.569","0.002","90","","719.2","0.17","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","trans-Diaquabis(1H-imidazole-4,5-dicarboxylato-κ^2^N^3^,O^4^)cadmium(II)","","- C10 H10 Cd N4 O10 -","- C10 H10 Cd N4 O10 -","- C20 H20 Cd2 N8 O20 -","2","0.5","TK6143","Zhang, Xian-Ming; Fang, Rui-Qin; Wu, Hai-Shun; Ng, Seik Weng","<i>trans</i>-Diaquabis(1<i>H</i>-imidazole-4,5-dicarboxylato-κ^2^<i>N</i>^3^,<i>O</i>^4^)cadmium(II)","Acta Crystallographica Section E","2004","60","1","m12","m13","10.1107/S1600536803026916","","","0.71073","MoKα","","0.044","0.03","","","0.05","0.052","","","","","","0.74","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203120","7.648","0.003","8.532","0.002","16.947","0.006","91.41","0.02","92.98","0.02","112.26","0.02","1020.9","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","syn-Bis(2,4,6-trichlorophenyl) 2-ethylmalonate","","- C17 H10 Cl6 O4 -","- C17 H10 Cl6 O4 -","- C34 H20 Cl12 O8 -","2","1","TK6145","Wentrup, Curt; Buchanan, Jeff; Karl A. Byriel; Colin H.L. Kennard","Bis(2,4,6-trichlorophenyl) 2-ethylmalonate","Acta Crystallographica Section E","2004","60","1","o137","o138","10.1107/S1600536803028812","","","0.71073","Mokα","","0.057","0.034","","","0.088","0.103","","","","","","0.94","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203121","7.693","0.0008","8.9579","0.001","18.538","0.002","96.987","0.002","95.358","0.002","102.126","0.002","1230.4","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H20 Co N4 O6 -","- C28 H20 Co N4 O6 -","- C56 H40 Co2 N8 O12 -","2","1","TK6146","Xie, Lin-Ming; He, Hong-Yin; Zhou, Yi-Li; Zhu, Long-Guan","<i>cis</i>-Diaquabis(4-cyanobenzoato)(1,10-phenanthroline)cobalt(II)","Acta Crystallographica Section E","2004","60","1","m105","m107","10.1107/S1600536803028824","","","0.71073","MoKα","","0.071","0.046","","","0.078","0.084","","","","","","0.83","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203122","13.2392","0.001","13.7499","0.0009","14.1126","0.0012","90","","109.268","0.006","90","","2425.1","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(Pyridin-2-yl)thiazol-2-ylamine","","- C8 H7 N3 S -","- C8 H7 N3 S -","- C96 H84 N36 S12 -","12","3","WK6007","Jonathan D Crane; Amanda McLaughlin","4-(Pyridin-2-yl)thiazol-2-ylamine","Acta Crystallographica Section E","2004","60","1","o129","o130","10.1107/S1600536803029180","","","0.71073","MoKα","","0.0483","0.0335","","","0.0803","0.0835","","","","","","0.896","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203123","6.8554","0.0008","7.3124","0.0009","7.561","0.0009","81.012","0.002","72.301","0.002","83.691","0.002","355.87","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Dipotasium nickel bis(dihydrogendiphosphate) dihydrate","","- H8 K2 Ni O16 P4 -","- H8 K2 Ni O16 P4 -","- H8 K2 Ni O16 P4 -","1","0.5","","Alaoui Tahiri, Aziz; Messouri, Ibtissam; Lachkar, Mohammed; Zavalij, Peter Y.; Glaum, Robert; El Bali, Brahim; Ouarsal Rachid","Dipotassium nickel(II) bis(dihydrogendiphosphate) dihydrate, K~2~Ni(H~2~P~2~O~7~)~2~.2H~2~O","Acta Crystallographica, Section E","2004","60","1","i3","i5","10.1107/S1600536803028344","","","0.71073","MoKα","","0.0646","0.0437","","","0.0925","0.0989","","","","","","0.955","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2203124","9.6673","0.0011","11.9122","0.0014","5.8846","0.0007","90","","90","","90","","677.66","0.14","153","2","153","2","","","","","","","","4","C m c 21","C 2c -2","36","","Trisodium vanadium oxide trisulfide","","- Na3 O S3 V -","- Na3 O S3 V -","- Na12 O4 S12 V4 -","4","0.5","","Huang, Fu Qiang; Ibers, James A.","Na~3~VOS~3~","Acta Crystallographica, Section E","2004","60","1","i6","i7","10.1107/S1600536803028939","","","0.71073","MoKα","","0.0172","0.017","","","0.0441","0.0441","","","","","","1.149","","","","has coordinates","277836","2022-09-14","17:02:02",""
"2203125","5.179","0.0007","11.0081","0.0018","21.238","0.003","90","","90.679","0.01","90","","1210.7","0.3","296","1","296","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","1,5-Diaminonaphthalene","1,5-Diaminonaphthalene","","- C10 H10 N2 -","- C10 H10 N2 -","- C60 H60 N12 -","6","1.5","WN6193","Bernès, Sylvain; Rodríguez Pastrana, Modesto; Huerta Sánchez, Enrique; Gutiérrez Pérez, René","1,5-Diaminonaphthalene","Acta Crystallographica Section E","2004","60","1","o45","o47","10.1107/S1600536803026643","","","0.71073","MoKα","","0.081","0.041","","","0.096","0.118","","","","","","1.013","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2203126","6.066","0.003","11.076","0.006","7.797","0.003","90","","91.56","0.04","90","","523.7","0.4","200","","200","","","","","","","","","4","P 1 21 1","P 2yb","4","","5-(tert-Butylamino)-5-oxopentanoic acid","","- C9 H17 N O3 -","- C9 H17 N O3 -","- C18 H34 N2 O6 -","2","1","WN6196","Takahashi, Kazuyuki; Okamura, Taka-aki; Yamamoto, Hitoshi; Ueyama, Norikazu","5-(<i>tert</i>-Butylamino)-5-oxopentanoic acid","Acta Crystallographica Section E","2004","60","1","o19","o21","10.1107/S1600536803026965","","","0.71069","MoKα","","0.038","0.034","","","0.086","0.088","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203127","7.8787","0.001","12.446","0.002","24.501","0.003","90","","90","","90","","2402.5","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","N-(2-Benzyloxyethyl)-4,7-dimethyl-6-(1,3-dithiolan-2-yl)-1,2,3,4,5,6- hexahydro-1,5-methano-2-azocino[4,3-b]indol-2-one","","- C27 H30 N2 O2 S2 -","- C27 H30 N2 O2 S2 -","- C108 H120 N8 O8 S8 -","4","1","WN6198","Hökelek, Tuncer; Uludağ, Nesimi; Patır, Süleyman","<i>N</i>-(2-Benzyloxyethyl)-4,7-dimethyl-6-(1,3-dithiolan-2-yl)-1,2,3,4,5,6-hexahydro-1,5-methano-2-azocino[4,3-<i>b</i>]indol-2-one","Acta Crystallographica Section E","2004","60","1","o25","o27","10.1107/S1600536803027041","","","0.71073","MoKα","","0.1603","0.0556","","","0.1236","0.1549","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203128","10.388","0.003","14.839","0.004","10.567","0.003","90","","100.64","0.03","90","","1600.9","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","olanzapine","2-methyl-4-(4-methyl-1-piperazinyl)-10H-thieno[2,3-b][1,5]benzodiazepine","","- C17 H20 N4 S -","- C17 H20 N4 S -","- C68 H80 N16 S4 -","4","1","WN6201","Wawrzycka-Gorczyca, Irena; Koziol, Anna E.; Glice, Magdalena; Cybulski, Jacek","Polymorphic form II of 2-methyl-4-(4-methyl-1-piperazinyl)-10<i>H</i>-thieno[2,3-<i>b</i>][1,5]benzodiazepine","Acta Crystallographica Section E","2004","60","1","o66","o68","10.1107/S160053680302806X","","","1.54178","CuKα","","0.0421","0.0333","","","0.0908","0.0961","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203129","10.207","0.003","12.44","0.004","14.278","0.005","90","","92.6","0.03","90","","1811.1","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","olanzapine methanol solvate","2-methyl-4-(4-methyl-1-piperazinyl)-10H-thieno[2,3-b][1,5]benzodiazepine methanol solvate","","- C18 H24 N4 O S -","- C18 H24 N4 O S -","- C72 H96 N16 O4 S4 -","4","1","WN6202","Wawrzycka-Gorczyca, Irena; Mazur, Liliana; Koziol, Anna E.","2-Methyl-4-(4-methyl-1-piperazinyl)-10<i>H</i>-thieno[2,3-<i>b</i>][1,5]benzodiazepine methanol solvate","Acta Crystallographica Section E","2004","60","1","o69","o71","10.1107/S1600536803028071","","","1.54178","CuKα","","0.2904","0.0628","","","0.1692","0.2759","","","","","","1.021","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2203130","14.073","0.006","8.228","0.002","9.2","0.002","90","","108.33","0.03","90","","1011.2","0.6","295","","295","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","d4pype","1,2-bis(di-4-pyridylphosphino)ethane","","- C22 H20 N4 P2 -","- C22 H20 N4 P2 -","- C44 H40 N8 P4 -","2","0.5","WN6203","Susan J. Berners-Price; Richard J. Bowen; Peter C. Healy","1,2-Bis(di-4-pyridylphosphino)ethane (d4pype)","Acta Crystallographica Section E","2004","60","1","o43","o44","10.1107/S1600536803027405","","","0.7107","MoKα","","0.1526","0.0522","","","0.1439","0.1824","","","","","","1.002","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203131","10.528","0.002","7.377","0.005","13.551","0.005","90","","108.169","0.008","90","","1000","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","trans-Bis(methanol-κO)bis(2-quinolinecarboxylato-κ^2^N,O)zinc(II)","","- C22 H20 N2 O6 Zn -","- C22 H20 N2 O6 Zn -","- C44 H40 N4 O12 Zn2 -","2","0.5","WW6149","Yue, Zheng-Yu; Cheng, Chao; Gao, Po; Yan, Peng-Fei","<i>trans</i>-Bis(methanol-κ<i>O</i>)bis(2-quinolinecarboxylato-κ^2^<i>N</i>,<i>O</i>)zinc(II)","Acta Crystallographica Section E","2004","60","1","m82","m84","10.1107/S1600536803028241","","","0.71073","MoKα","","0.0341","0.0272","","","0.0666","0.071","","","","","","1.091","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203132","6.993","0.001","14.49","0.002","16.274","0.003","90","","96.07","0.02","90","","1639.8","0.4","299","2","299","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","trans-(4-Phenyltetrahydro-2-furyl)methyl p-nitrobenzoate","","- C18 H17 N O5 -","- C18 H17 N O5 -","- C72 H68 N4 O20 -","4","1","YA6180","Hartung, Jens; Schmidt, Philipp; Svoboda, Ingrid; Fuess, Hartmut","<i>trans</i>-(4-Phenyltetrahydro-2-furyl)methyl <i>p</i>-nitrobenzoate","Acta Crystallographica Section E","2004","60","1","o12","o13","10.1107/S1600536803027028","","","0.71073","MoKα","","0.101","0.074","","","0.218","0.244","","","","","","1.06","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203133","12.18","0.005","4.8825","0.0017","20.083","0.008","90","","91.152","0.009","90","","1194.1","0.8","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","4,5-diiodo[1,2,5]thiadiazolotetrathiafulvalene","5-(4,5-diiodo-1,3-dithiol-2-ylidene)-1,3,2,4,6-diazatrithiapentalene","","- C6 I2 N2 S5 -","- C6 I2 N2 S5 -","- C24 I8 N8 S20 -","4","1","YA6184","Tomura, Masaaki; Yamashita, Yoshiro","4,5-Diiodo[1,2,5]thiadiazolotetrathiafulvalene","Acta Crystallographica Section E","2004","60","1","o63","o65","10.1107/S1600536803027466","","","0.7107","MoKα","","0.123","0.099","","","0.18","0.189","","","","","","1.31","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203134","8.357","0.001","11.122","0.002","15.044","0.002","93.053","0.002","96.081","0.002","90.891","0.002","1388.1","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","5,5'-Oxybis[2-(phthalimido)acetic acid] bis-N,N-dimethylformamide solvate","","- C26 H26 N4 O11 -","- C26 H26 N4 O11 -","- C52 H52 N8 O22 -","2","1","YA6188","Lü, Xingqiang; Kang, Beisheng; Ng, Seik Weng","5,5'-Oxybis[2-(phthalimido)acetic acid] <i>N,N</i>-dimethylformamide disolvate","Acta Crystallographica Section E","2004","60","1","o104","o106","10.1107/S1600536803028253","","","0.71073","MoKα","","0.121","0.06","","","0.162","0.196","","","","","","1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203135","10.814","0.002","13.534","0.003","15.061","0.003","90","","106.561","0.014","90","","2112.8","0.8","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^N,N')dichloronickel(II) dihydrate","","- C12 H16 Cl2 N8 Ni O2 S4 -","- C12 H16 Cl2 N8 Ni O2 S4 -","- C48 H64 Cl8 N32 Ni4 O8 S16 -","4","1","YA6189","Liu, Jia-Geng; Xu, Duan-Jun","Dichlorobis(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^<i>N</i>,<i>N</i>')nickel(II) dihydrate","Acta Crystallographica Section E","2004","60","1","m108","m110","10.1107/S1600536803028800","","","0.71073","MoKα","","0.106","0.045","","","0.09","0.101","","","","","","0.811","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203136","10.8756","0.0004","8.939","0.0003","31.227","0.001","90","","90","","90","","3035.79","0.18","273","2","273","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","(2R*,5S*)-Bicyclic chloromethyl phosphonamide","(1R*,3aS*)-1-(chloromethyl)-1λ^5^-phospha-2,6a-diazaperhydropentalene 1-oxide dihydrate","","- C12 H20 Cl N2 O3 P -","- C12 H20 Cl N2 O3 P -","- C96 H160 Cl8 N16 O24 P8 -","8","1","AC6070","Chen, Dimei; Zhong, Ping; Ding, Jinchang; Yuan, Chengye","(1<i>RS</i>,3a<i>SR</i>)-1-(chloromethyl)-1λ^5^-phospha-2,6a-diazaperhydropentalene 1-oxide dihydrate","Acta Crystallographica Section E","2004","60","2","o237","o238","10.1107/S1600536803025546","","","0.71073","MoKα","","0.053","0.0438","","","0.1215","0.1283","","","","","","1.07","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203137","11.201","0.003","13.187","0.003","27.217","0.005","90","","91.39","0.017","90","","4019","1.6","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H32 N2 O10 -","- C26 H32 N2 O10 -","- C156 H192 N12 O60 -","6","1.5","AC6077","Rademeyer, Melanie; Barkhuizen, David A.; Maguire, Glenn E. M.","Tetramethyl 1,2-bis(2-aminophenoxy)ethane-<i>N,N,N</i>',<i>N</i>'-tetraacetate","Acta Crystallographica Section E","2004","60","2","o213","o215","10.1107/S1600536804000315","","","0.71073","MoKα","","0.0662","0.0467","","","0.1194","0.1281","","","","","","1.082","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203138","8.364","0.003","6.816","0.003","10.972","0.005","90","","101.98","0.006","90","","611.9","0.4","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","N-(4-methyl-1-piperazinyl)phthalimide","","- C13 H15 N3 O2 -","- C13 H15 N3 O2 -","- C26 H30 N6 O4 -","2","0.5","AC6078","Guo, Ming-Lin","<i>N</i>-(4-Methyl-1-piperazinyl)phthalimide","Acta Crystallographica Section E","2004","60","2","o306","o307","10.1107/S1600536804001825","","","0.71073","MoKα","","0.0539","0.041","","","0.1051","0.1138","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203139","7.296","0.0006","7.942","0.0018","8.208","0.0009","97.637","0.014","103.327","0.008","111.756","0.015","417.11","0.13","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H20 N14 Ni -","- C12 H20 N14 Ni -","- C12 H20 N14 Ni -","1","0.5","AC6079","Albada, Gerard A.van; Mohamadou, Aminou; Mutikainen, Ilpo; Turpeinen, Urho; Reedijk, Jan","Diazidobis(2,2'-biimidazoline)nickel(II)","Acta Crystallographica Section E","2004","60","2","m237","m238","10.1107/S1600536804001795","","","0.71073","MoKα","","0.0281","0.025","","","0.0659","0.0672","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203140","18.6723","0.0001","18.6723","0.0001","8.1734","0.0001","90","","90","","90","","2849.7","0.04","293","2","293","2","","","","","","","","3","P 42/m n m","-P 4n 2n","136","","erbium platinum silidide","","- Er36 Pt99.39 Si32 -","- Er36 Pt99.388 Si32 -","- Er36 Pt99.388 Si32 -","1","0.0625","BR6132","Tursina, Anna I.; Gribanov, Alexandr V.; Noël, Henri; Rogl, Peter; Seropegin, Yuri D.","Er~36~Pt~102{-~<i>x</i>}Si~32~ (<i>x</i> = 2.6), a new structure type of a ternary intermetallic silicide","Acta Crystallographica Section E","2004","60","2","i8","i9","10.1107/S1600536803029398","","","0.71073","MoKα","","0.0579","0.0492","","","0.1285","0.135","","","","","","1.135","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203141","10.804","0.002","11.034","0.002","13.748","0.003","90","","95.78","0.02","90","","1630.6","0.6","298","2","298","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","tetrapotassium sodium hydrogendecavanadate decahydrate","","- H21 K4 Na O38 V10 -","- K4 Na O38 V10 -","- K8 Na2 O76 V20 -","2","0.5","BR6134","Lee, Uk; Joo, Hea-Chung","A novel monoprotonated decavanadate, K~4~Na[HV~10~O~28~]·10H~2~O","Acta Crystallographica Section E","2004","60","2","i22","i24","10.1107/S1600536804000893","","","0.71069","MoKα","","0.0726","0.046","","","0.1076","0.1282","","","","","","1.145","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203142","7.6826","0.0007","6.2459","0.0006","8.6691","0.0008","90","","90","","90","","415.98","0.07","295","2","295","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- As H Hg O5 Zn -","- As H Hg O5 Zn -","- As4 H4 Hg4 O20 Zn4 -","4","0.5","","Weil, Matthias","ZnHg(AsO~4~)(OH) with a descloizite-type structure","Acta Crystallographica, Section E","2004","60","2","i25","i27","10.1107/S1600536804001527","","","0.71073","MoKα","","0.0211","0.0181","","","0.0401","0.0407","","","","","","1.124","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2203143","12.6311","0.0019","14.607","0.0019","11.1428","0.0015","90","","112.94","0.02","90","","1893.3","0.5","298","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C18 H15 Cd N3 O5 -","- C18 H15 Cd N3 O5 -","- C72 H60 Cd4 N12 O20 -","4","0.5","BT6376","Liao, Ju-Hsiou; Ho, Chien-De","Poly[diaqua[μ-1,2-bis(4-pyridyl)ethene-κ^2^<i>N</i>:<i>N</i>']tetrakis(μ-isonicotinato-κ^2^<i>N</i>:<i>O</i>)dicadmium(II)]","Acta Crystallographica Section E","2004","60","2","m156","m158","10.1107/S1600536803025340","","","0.71073","MoKα","","0.0248","0.0226","","","0.0566","0.0578","","","","","","1.206","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203144","8.7868","0.001","8.1911","0.001","22.718","0.003","90","","100.098","0.003","90","","1609.8","0.3","133","2","133","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Chlorobis(2-pyridylethanol)copper(II) chloride","","- C14 H18 Cl2 Cu N2 O2 -","- C14 H18 Cl2 Cu N2 O2 -","- C56 H72 Cl8 Cu4 N8 O8 -","4","1","BT6379","Hamamci, Sevim; Yilmaz, Veysel T.; Thöne, Carsten","Chlorobis[2-(2-pyridyl)ethanol]copper(II) chloride","Acta Crystallographica Section E","2004","60","2","m159","m161","10.1107/S1600536804000157","","","0.71073","MoKα","","0.0292","0.0275","","","0.0687","0.0695","","","","","","1.106","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203145","12.013","0.002","7.789","0.001","25.542","0.003","90","","97.802","0.003","90","","2367.8","0.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-[2-(2,6-Dimethylphenylamino)phenylmethyleneamino]-1,3-diisopropylbenzene","","- C27 H32 N2 -","- C27 H32 N2 -","- C108 H128 N8 -","4","1","BT6388","Gao, Haiyang; Wu, Qing; Ng, Seik Weng","2-[2-(2,6-Dimethylphenylamino)phenylmethyleneamino]-1,3-diisopropylbenzene","Acta Crystallographica Section E","2004","60","2","o193","o195","10.1107/S1600536804000492","","","0.71073","MoKα","","0.108","0.052","","","0.148","0.179","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203146","9.5356","0.0007","9.6262","0.0007","11.6413","0.0008","81.701","0.001","82.397","0.001","85.453","0.001","1046.11","0.13","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis[μ-2-benz(oxa/thia)zolyl-2-phenolato-κ^3^N,O:O]bis{bis[2- benz(oxa/thia)zolyl-2-phenolato-κ^2^N,O]zinc(II)}","","- C52 H32 N4 O6.67 S1.33 Zn2 -","- C52 H32 N4 O6.68 S1.32 Zn2 -","- C52 H32 N4 O6.68 S1.32 Zn2 -","1","0.5","BT6389","Tong, Yi-Ping; Chen, Xiao-Ming; Ng, Seik Weng","Bis[μ-2-benz(oxa/thia)zolyl-2-phenolato-κ^3^<i>N,O</i>:<i>O</i>]bis{bis[2-benz(oxa/thia)zolyl-2-phenolato-κ^2^<i>N,O</i>]zinc(II)}","Acta Crystallographica Section E","2004","60","2","m166","m168","10.1107/S1600536804000509","","","0.71073","MoKα","","0.057","0.047","","","0.11","0.115","","","","","","0.99","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203147","21.595","0.003","6.4904","0.0008","15.611","0.002","90","","132.774","0.001","90","","1606.1","0.4","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[[aquamanganese(II)]-di-μ-4-pyridylthioacetato-κ^6^O,O':N;N:O,O']","","- C14 H14 Mn N2 O5 S2 -","- C14 H14 Mn N2 O5 S2 -","- C56 H56 Mn4 N8 O20 S8 -","4","0.5","BT6390","Zhang, Xian-Ming; Fang, Rui-Qin; Wu, Hai-Shun; Ng, Seik Weng","<i>catena</i>-Poly[[aquamanganese(II)]-di-μ-4-pyridylthioacetato-κ^6^<i>O,O</i>':<i>N</i>;<i>N</i>:<i>O,O</i>']","Acta Crystallographica Section E","2004","60","2","m169","m170","10.1107/S1600536804000510","","","0.71073","MoKα","","0.066","0.054","","","0.124","0.131","","","","","","1.12","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203148","8.9507","0.0008","10.0094","0.0009","13.9732","0.0012","90.953","0.01","100.442","0.01","116.19","0.009","1098.1","0.2","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H44 Cu2 N12 O18 S2 -","- C36 H44 Cu2 N12 O18 S2 -","- C36 H44 Cu2 N12 O18 S2 -","1","0.5","BT6391","Dilovan S. Cati; Helen Stoeckli-Evans","A macrocyclic binuclear copper(II) complex of the ligand <i>N,N</i>'-bis(pyridin-2-ylmethyl)pyrazine-2,3-dicarboxamide","Acta Crystallographica Section E","2004","60","2","m177","m179","10.1107/S1600536804000522","","","0.71073","MoKα","","0.0541","0.0288","","","0.0554","0.06","","","","","","0.991","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203149","9.3201","0.001","9.9743","0.0012","11.8877","0.0013","114.331","0.013","90.178","0.013","100.199","0.013","987.5","0.2","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H44 Cu2 N12 O12 -","- C36 H28 Cu2 N12 O12 -","- C36 H28 Cu2 N12 O12 -","1","0.5","BT6392","Dilovan S. Cati; Helen Stoeckli-Evans","A neutral macrocyclic binuclear copper(II) complex of the deprotonated form of the ligand <i>N,N</i>'-bis(pyridin-2-ylmethyl)pyrazine-2,3-dicarboxamide","Acta Crystallographica Section E","2004","60","2","m180","m182","10.1107/S1600536804000534","","","0.71073","MoKα","","0.0626","0.0445","","","0.1085","0.1144","","","","","","0.967","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203150","13.3356","0.0006","13.3356","0.0006","13.6495","0.0009","90","","90","","90","","2427.4","0.2","150","2","150","2","","","","","","","","8","P 4/n :2","-P 4a","85","","","","- C32 H72 Br0.33 Cl3.67 Cu4 Mo N2 S4 -","- C32 H72 Br0.328 Cl3.672 Cu4 Mo N2 S4 -","- C64 H144 Br0.656 Cl7.344 Cu8 Mo2 N4 S8 -","2","0.25","BT6400","Brooks, Neil R.; Clegg, William; Esm-Hosseini, Majid; Hossaini Sadr, Moayad; Yavari, Reza","A second tetragonal polymorph of bis(tetra-<i>n</i>-butylammonium) tetrakis[chloro(μ~3~-sulfido)copper(I)]molybdate(VI)","Acta Crystallographica Section E","2004","60","2","m204","m206","10.1107/S1600536804001175","","","0.71073","MoKα","","0.0419","0.0244","","","0.0515","0.0583","","","","","","1.085","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203151","14.2654","0.001","17.8039","0.0018","17.288","0.002","90","","93.224","0.009","90","","4383.9","0.7","150","2","150","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C27 H66 Br3.42 Cl0.58 Cu3 Mo N3 O2 S3 -","- C27 H66 Br3.415 Cl0.585 Cu3 Mo N3 O2 S3 -","- C108 H264 Br13.66 Cl2.34 Cu12 Mo4 N12 O8 S12 -","4","1","BT6401","Beheshti, Azizolla; Brooks, Neil R.; Clegg, William; Khorrmdin, Rahman","Tris(tetraethylammonium) tris(μ~3~-sulfido)bis[bromocopper(I)][dibromocopper(I)]oxomolybdate(VI) acetone solvate","Acta Crystallographica Section E","2004","60","2","m231","m233","10.1107/S1600536804001722","","","0.71073","MoKα","","0.0741","0.0528","","","0.1179","0.1277","","","","","","1.084","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203152","26.986","0.003","18.412","0.003","17.365","0.002","90","","107.295","0.009","90","","8238","1.9","150","","150","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","α-Dichlorobis(2-phenylazo-4,6-dimethylpyridine)ruthenium(II)","","- C26 H26 Cl2 N6 Ru -","- C26 H26 Cl2 N6 Ru -","- C312 H312 Cl24 N72 Ru12 -","12","1.5","BT6402","Kooijman, Huub; Hotze, Anna C. G.; Caspers, Sabrine E.; Haasnoot, Jaap G.; Reedijk, Jan; Spek, Anthony L.","α-Dichlorobis(2-phenylazo-4,6-dimethylpyridine)ruthenium(II) chloroform solvate","Acta Crystallographica Section E","2004","60","2","m247","m249","10.1107/S1600536804001618","","","0.71073","MoKα","","0.0467","0.0338","","","0.0785","0.0827","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203153","6.9664","0.0014","24.389","0.005","11.713","0.002","90","","97.63","0.03","90","","1972.5","0.7","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-{2-[4-(2,4-Dinitrophenyl)piperazin-1-yl]-ethyl}-4-aza-1-azonia- bicyclo[2.2.2]octane chloride","","- C18 H27 Cl N6 O4 -","- C18 H27 Cl N6 O4 -","- C72 H108 Cl4 N24 O16 -","4","1","BT6403","Clegg, William; Golding, Bernard T.; Harrington, Ross W.; Scott, Richard","1-{2-[4-(2,4-Dinitrophenyl)piperazin-1-yl]ethyl}-4-aza-1-azoniabicyclo[2.2.2]octane chloride","Acta Crystallographica Section E","2004","60","2","o291","o293","10.1107/S1600536804001710","","","0.71073","MoKα","","0.0802","0.046","","","0.0753","0.0849","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203154","9.2962","0.0002","8.2755","0.0002","11.4267","0.0003","90","","91.083","0.0011","90","","878.91","0.04","150","2","150","1","","","","","","","","4","P 1 21 1","P 2yb","4","","(2S,4S,5R)-(-)-2-(4-propoxyphenyl)-3,4-dimethyl-5-phenyl-1,3-oxazolidine","","- C20 H25 N O2 -","- C20 H25 N O2 -","- C40 H50 N2 O4 -","2","1","CF6304","Duffy, Marina; Gallagher, John F.; Lough, Alan J.","C—H···O and C—H···π(arene) interactions in (2<i>S</i>,4<i>S</i>,5<i>R</i>)-(‒)-2-(4-propoxyphenyl)-3,4-dimethyl-5-phenyl-1,3-oxazolidine","Acta Crystallographica Section E","2004","60","2","o234","o236","10.1107/S1600536803028733","","","0.71073","MoKα","","0.035","0.031","","","0.076","0.079","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203155","10.389","0.003","14.745","0.004","19.531","0.007","90","","90","","90","","2991.9","1.6","295","2","295","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3,7,17-O-triacetyl-5-O-butanoyl-13,15-dihydroxymyrisinol","","- C30 H42 O11 -","- C30 H42 O11 -","- C120 H168 O44 -","4","1","CF6314","Parvez, Masood; Ahmad, Viqar Uddin; Hussain, Javid; Hussain, Hidayat; Farooq, Umar","3,7,17-Tri-<i>O</i>-acetyl-5-<i>O</i>-butanoyl-13,15-dihydroxymyrisinol","Acta Crystallographica Section E","2004","60","2","o148","o150","10.1107/S1600536803028770","","","0.71073","MoKα","","0.062","0.048","","","0.126","0.139","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203156","10.832","0.004","8.845","0.003","12.922","0.004","90","","111.22","0.02","90","","1154.1","0.7","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Butylhydrogenphthalate","Butylhydrogenphthalate","","- C12 H14 O4 -","- C12 H14 O4 -","- C48 H56 O16 -","4","1","CF6318","Parvez, Masood; Sadiq-ur-Rahman; Ali, Saqib; Mazhar, Muhammad","<i>n</i>-Butyl hydrogen phthalate","Acta Crystallographica Section E","2004","60","2","o151","o152","10.1107/S160053680302926X","","","0.71073","MoKα","","0.088","0.044","","","0.101","0.119","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203157","14.5978","0.001","8.1794","0.0006","16.9523","0.0012","90","","90","","90","","2024.1","0.2","273","2","273","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","Bis(2,2'-bipyridine)diazidomanganese(II)","","- C20 H16 Mn N10 -","- C20 H16 Mn N10 -","- C80 H64 Mn4 N40 -","4","0.5","CF6322","Ya-Qian Cheng; Mao-Lin Hu; Sai-Rong Fan; Wei Zhang","Diazidobis(2,2'-bipyridine)manganese(II)","Acta Crystallographica Section E","2004","60","2","m212","m213","10.1107/S1600536804001308","","","0.71073","MoKα","","0.0601","0.0591","","","0.1371","0.1377","","","","","","1.341","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203158","7.59","0.004","10.532","0.006","8.101","0.004","90","","100.248","0.009","90","","637.2","0.6","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C14 H14 N4 O2 -","- C14 H14 N4 O2 -","- C28 H28 N8 O4 -","2","1","CF6323","Adams, Harry; Allen, Ray W. K.; Chin, Jitkai; O'Sullivan, Brian; Styring, Peter; Sutton, Liam R.","4'-(Dimethylamino)-4-nitroazobenzene","Acta Crystallographica Section E","2004","60","2","o289","o290","10.1107/S160053680400159X","","","0.71073","MoKα","","0.0823","0.0709","","","0.191","0.2035","","","","","","1.209","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203159","9.1514","0.0002","16.5218","0.0003","12.8524","0.0003","90","","97.186","0.001","90","","1927.99","0.07","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Metoclopramide Sulphate","4-Ammonio-5-chloro-N-[2-(N,N-diethylammonio)ethyl]-2-methoxybenzamide sulfate","","- C14 H24 Cl N3 O6 S -","- C14 H24 Cl N3 O6 S -","- C56 H96 Cl4 N12 O24 S4 -","4","1","CI6315","Girija, C. R.; Noor Shahina Begum","4-Ammonio-5-chloro-<i>N</i>-[2-(<i>N,N</i>-diethylammonio)ethyl]-2-methoxybenzamide sulfate","Acta Crystallographica Section E","2004","60","2","o260","o261","10.1107/S1600536803029611","","","0.71073","MoKα","","0.0842","0.0567","","","0.1575","0.1785","","","","","","1.026","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203160","14.516","0.002","4.784","0.002","19.194","0.004","90","","107.62","0.01","90","","1270.4","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4'-methylazobenzene-2-sulphenylcyanide","","- C14 H11 N3 S -","- C14 H11 N3 S -","- C56 H44 N12 S4 -","4","1","CI6317","Karmakar Sanjib; Patowary Kabita; Barman, P.; Hazarika, D.; Bhattacharjee, S.","4'-Methylazobenzene-2-sulfenyl cyanide","Acta Crystallographica Section E","2004","60","2","o179","o180","10.1107/S1600536803029702","","","1.5418","CuKα","","0.1094","0.0739","","","0.2059","0.2308","","","","","","1.083","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203161","8.427","0.002","10.2","0.002","11.163","0.003","90","","90","","90","","959.5","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","2-[hydroxy(2-pyridyl)methyl]-2-cyclopenten-1-one","2-[hydroxy(2-pyridyl)methyl]-2-cyclopenten-1-one","","- C11 H11 N O2 -","- C11 H11 N O2 -","- C44 H44 N4 O8 -","4","1","CI6318","Huo, Fangjun; Yin, Caixia; Guo, Wei; Xia, Chizhong","2-[Hydroxy(2-pyridyl)methyl]-2-cyclopenten-1-one: the Baylis‒Hillman adduct of 2-pyridinecarboxaldehyde and 2-cyclopenten-1-one","Acta Crystallographica Section E","2004","60","2","o204","o206","10.1107/S1600536804000091","","","0.71073","MoKα","","0.0382","0.0347","","","0.0924","0.095","","","","","","1.057","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203162","22.584","0.005","10.026","0.002","13.401","0.003","90","","102.26","0.03","90","","2965.1","1.2","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","Magnesium ferron pentahydrate","bis(μ-8-hydroxy-7-iodoquinoline-5-sulfonato- κ^3^N,O:O')bis[triaquamagnesium(II)] tetrahydrate","","- C18 H28 I2 Mg2 N2 O18 S2 -","- C18 H28 I2 Mg2 N2 O18 S2 -","- C72 H112 I8 Mg8 N8 O72 S8 -","4","0.5","CI6319","Savarimuthu Francis; Packianathan Thomas Muthiah; Rychlewska, Urszula; Warżajtis, Beata","The dimer bis(μ-8-hydroxy-7-iodoquinoline-5-sulfonato-κ^3^<i>N,O</i>:<i>O</i>')bis[triaquamagnesium(II)] tetrahydrate","Acta Crystallographica Section E","2004","60","2","m137","m139","10.1107/S1600536803029453","","","0.71073","MoKα","","0.0281","0.0237","","","0.0554","0.0572","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203163","9.7677","0.0015","5.875","0.003","13.7295","0.0015","90","","100.76","0.01","90","","774","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","4,6-Dimethyl-5-nitro-1H-pyridin-2-one","4,6-Dimethyl-5-nitro-1H-pyridin-2-one","","- C7 H8 N2 O3 -","- C7 H8 N2 O3 -","- C28 H32 N8 O12 -","4","1","CI6320","Victor B. Rybakov; Alexander A. Bush; Eugene V. Babaev; Leonid A. Aslanov","4,6-Dimethyl-5-nitro-1<i>H</i>-pyridin-2-one","Acta Crystallographica Section E","2004","60","2","o201","o203","10.1107/S160053680302960X","","","1.5418","CuKα","","0.0754","0.0429","","","0.0965","0.1111","","","","","","0.981","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203164","8.7135","0.0006","13.5629","0.0009","13.93","0.001","90","","91.986","0.001","90","","1645.3","0.2","163","2","163","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Di-μ-ethoxy-bis[diethoxy(8-quinolinato)titanium(IV)]","","- C30 H42 N2 O8 Ti2 -","- C30 H42 N2 O8 Ti2 -","- C60 H84 N4 O16 Ti4 -","2","0.5","CI6321","Amini, Mostafa M.; Mirzaee, Mehdi; Ng, Seik Weng","Di-μ-ethoxy-bis[diethoxy(8-quinolinato)titanium(IV)]","Acta Crystallographica Section E","2004","60","2","m145","m146","10.1107/S1600536803029544","","","0.71073","MoKα","","0.041","0.031","","","0.085","0.091","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203165","12.599","0.001","17.659","0.001","13.024","0.001","90","","90","","90","","2897.7","0.4","163","2","163","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Tris(8-hydroxyquinolinato-κ^2^O,N)oxoniobium(V) dichloromethane disolvate","","- C29 H22 Cl4 N3 Nb O4 -","- C29 H22 Cl4 N3 Nb O4 -","- C116 H88 Cl16 N12 Nb4 O16 -","4","0.5","CI6322","Amini, Mostafa M.; Mirzaee, Mehdi; Yeganeh, Farnaz; Ng, Seik Weng","Tris(8-hydroxyquinolinato-κ^2^<i>O,N</i>)oxoniobium(V) dichloromethane disolvate","Acta Crystallographica Section E","2004","60","2","m147","m148","10.1107/S1600536803029556","","","0.71073","MoKα","","0.054","0.036","","","0.088","0.097","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203166","9.1911","0.0016","12.8581","0.0017","15.827","0.002","90","","90","","90","","1870.4","0.5","293","2","","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C17 H20 B F3 N O P -","- C17 H20 B F3 N O P -","- C68 H80 B4 F12 N4 O4 P4 -","4","1","CI6326","Johansson, Magnus J.; Kann, Nina.; Larsson, Krister","(2<i>R</i>,4<i>S</i>,5<i>R</i>)-3,4-Dimethyl-5-phenyl-2-[4-(trifluoromethyl)phenyl]-1,3,2-oxazaphospholidine(<i>P</i>—<i>B</i>)borane","Acta Crystallographica Section E","2004","60","2","o287","o288","10.1107/S1600536804001333","","","0.71073","MoKα","","","0.0476","","","","0.1338","","","","","","1.044","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2203167","13.05","0.003","16.068","0.003","8.0948","0.0016","90","","104.75","0.03","90","","1641.4","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Hexaimidazolemanganese(II) terephthalate tetrahydrate","","- C26 H36 Mn N12 O8 -","- C26 H36 Mn N12 O8 -","- C52 H72 Mn2 N24 O16 -","2","0.5","CI6327","Shu-Yan Niu; Shu-Sheng Zhang; Xue-Mei Li; Yong-Hong Wen; Kui Jiao","Hexaimidazolemanganese(II) terephthalate tetrahydrate","Acta Crystallographica Section E","2004","60","2","m209","m211","10.1107/S160053680400090X","","","0.71073","MoKα","","0.0558","0.0361","","","0.0848","0.1001","","","","","","1.114","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203168","10.6293","0.0006","10.7405","0.0006","21.4937","0.0013","90","","90","","90","","2453.8","0.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","6-Hydroxymexicanolide","4-(3-Furyl)-1,4,4a,5,6,6a,7,8α,9,10,11α,12-dodecahydro-4a,7,9,9- tetramethyl-2,10,13-trioxo-7,11-methano-2H-cycloocta[f][2]benzopyran-8- hydroxyl acetic acid methyl ester","","- C27 H32 O8 -","- C27 H32 O8 -","- C108 H128 O32 -","4","1","CI6328","Kan Chantrapromma; Nisakorn Saewan; Hoong-Kun Fun; Suchada Chantrapromma; Azhar Abdul Rahman","6-Hydroxymexicanolide","Acta Crystallographica Section E","2004","60","2","o312","o314","10.1107/S1600536804001667","","","0.71073","MoKα","","0.065","0.0503","","","0.1219","0.1345","","","","","","1.113","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203169","4.5866","0.0004","19.742","0.002","12.62","0.0011","90","","94.872","0.007","90","","1138.6","0.18","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-[(2-Hydroxymethylphenylimino)methyl]phenol","","- C14 H13 N O2 -","- C14 H13 N O2 -","- C56 H52 N4 O8 -","4","1","CI6329","Ersanlı, Cem Cüneyt; Odabaşoǧlu, Mustafa; Albayrak, Çiǧdem; Erdönmez, Ahmet","2-[2-(Hydroxymethyl)phenyliminomethyl]phenol","Acta Crystallographica Section E","2004","60","2","o264","o266","10.1107/S1600536804001321","","","0.71073","MoKα","","0.088","0.044","","","0.098","0.108","","","","","","0.887","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2203170","7.0862","0.0007","22.547","0.002","14.8041","0.0014","90","","97.875","0.002","90","","2343","0.4","293","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Triaqua(dihydrogen 1,2,4,5-benzenetetracarboxylate)(1,10- phenanthroline)cobalt(II) monohydrate","","- C22 H20 Co N2 O12 -","- C22 H20 Co N2 O12 -","- C88 H80 Co4 N8 O48 -","4","1","CI6330","Ming-De Ye; Hong-Ping Xiao; Ya-Qian Cheng; Mao-Lin Hu","Triaqua(dihydrogen 1,2,4,5-benzenetetracarboxylato)(1,10-phenanthroline)cobalt(II) monohydrate","Acta Crystallographica Section E","2004","60","2","m219","m221","10.1107/S1600536804001229","","","0.71073","MoKα","","0.0555","0.0518","","","0.1201","0.1223","","","","","","1.173","","","","has coordinates,has Fobs","189124","2020-10-21","18:00:00",""
"2203171","9.8702","0.0005","10.0063","0.0005","12.6434","0.0006","101.436","0.001","103.466","0.001","95.981","0.001","1175.37","0.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Trifluoromethanesulfonic acid 2-(2,2,2-trifluoroacetylamino)pyridin-3-yl ester","","- C8 H4 F6 N2 O4 S -","- C8 H4 F6 N2 O4 S -","- C32 H16 F24 N8 O16 S4 -","4","2","CI6333","Huang, Xianghong; Liu, Haitao; Hu, Xiaobo; Ng, Seik Weng","2-(2,2,2-Trifluoroacetylamino)pyridin-3-yl trifluoromethanesulfonate","Acta Crystallographica Section E","2004","60","2","o308","o309","10.1107/S1600536804001679","","","0.71073","MoKα","","0.037","0.032","","","0.083","0.087","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203172","8.8812","0.0003","5.8066","0.0002","11.528","0.0005","90","","111.583","0.001","90","","552.81","0.04","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Ethyl phenylsulfonylacetate","","- C10 H12 O4 S -","- C10 H12 O4 S -","- C20 H24 O8 S2 -","2","1","CI6334","Ding, Jin-Chang; Su, Wei-Ke; Wu, Hua-Yue; Liu, Miao-Chang; Ng, Seik Weng","Ethyl phenylsulfonylacetate","Acta Crystallographica Section E","2004","60","2","o310","o311","10.1107/S1600536804001680","","","0.71073","MoKα","","0.039","0.038","","","0.097","0.098","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203173","10.7252","0.0009","10.7252","0.0009","8.9854","0.0008","90","","90","","120","","895.12","0.13","293","0.3","293","0.3","","","","","","","","4","R -3 c :H","-R 3 2""c","167","Scandium Formate","","","- C3 H3 O6 Sc -","- C3 H3 O6 Sc -","- C18 H18 O36 Sc6 -","6","0.166667","CV6256","Ilyukhin, Andrey B.; Petrosyants, Svetlana P.","The rhombohedral polymorph of scandium formate","Acta Crystallographica Section E","2004","60","2","m151","m152","10.1107/S1600536803029738","","","0.71073","MoKα","","0.0317","0.0267","","","0.0745","0.078","","","","","","1.029","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203174","8.5131","0.0006","31.862","0.002","12.1757","0.0006","90","","90","","90","","3302.6","0.4","153","","153","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C18 H16 N6 O2 -","- C18 H16 N6 O2 -","- C144 H128 N48 O16 -","8","1","CV6257","Dilovan S. Cati; Helen Stoeckli-Evans","An orthorhombic polymorph of <i>N</i>,<i>N</i>'-bis(2-pyridylmethyl)pyrazine-2,3-dicarboxamide","Acta Crystallographica Section E","2004","60","2","o210","o212","10.1107/S160053680400008X","","","0.71073","MoKα","","0.0437","0.0315","","","0.0744","0.0785","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203175","12.2116","0.0005","12.409","0.0006","17.2983","0.0009","90","","107.526","0.002","90","","2499.6","0.2","110","2","110","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C54 H54 Cl4 P2 S2 Zr2 -","- C54 H54 Cl4 P2 S2 Zr2 -","- C108 H108 Cl8 P4 S4 Zr4 -","2","0.5","CV6259","Ortega, Esteban; Pirio, Nadine; Meunier, Philippe; Richard, Philippe","Bis[μ-4-(diphenylphosphino)but-3-ene-2-thiolato]bis[bis(η^5^-cyclopentadienyl)zirconium(IV)] dichloromethane disolvate","Acta Crystallographica Section E","2004","60","2","m201","m203","10.1107/S1600536804000959","","","0.71073","MoKα","","","0.0377","","","","0.0918","","","","","","1.027","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203176","6.442","0.002","15.681","0.005","12.12","0.004","90","","94.579","0.006","90","","1220.4","0.7","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","1-benzylpiperidin-4-ylideneacetonitrile","1-benzylpiperidin-4-ylideneacetonitrile","","- C14 H16 N2 -","- C14 H16 N2 -","- C56 H64 N8 -","4","1","CV6261","Miaoyu Li; Caixia Yin; Pin Yang","(1-Benzylpiperidin-4-ylidene)acetonitrile","Acta Crystallographica Section E","2004","60","2","o250","o251","10.1107/S1600536804001035","","","0.71073","MoKα","","0.1309","0.0652","","","0.1311","0.1581","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203177","8.1635","0.0008","10.0366","0.0009","10.6641","0.001","67.34","0.007","87.008","0.008","76.74","0.007","784.17","0.14","293","","293","","","","","","","","","4","P -1","-P 1","2","","Methyl 6-amino-5-cyano-2-methoxycarbonylmethyl-4-phenyl-4H-pyran-3-carboxylate","","- C17 H16 N2 O5 -","- C17 H16 N2 O5 -","- C34 H32 N4 O10 -","2","1","CV6267","Sema Öztürk; Mehmet Akkurt; Edmont Stoyanov; Orhan Büyükgüngör; Dieter Heber","Methyl 6-amino-5-cyano-2-methoxycarbonylmethyl-4-phenyl-4<i>H</i>-pyran-3-carboxylate","Acta Crystallographica Section E","2004","60","2","o283","o284","10.1107/S1600536804001497","","","0.71073","MoKα","","0.052","0.0375","","","0.1038","0.1084","","","","","","1.05","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203178","8.83","0.002","11.932","0.002","14.888","0.003","90.94","0.02","105.58","0.02","92.12","0.02","1509.4","0.5","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","1,2-bis-(9-carbazol-9-ylmethylene)-3,4-diphenylcyclobutane","","- C42 H30 N2 -","- C42 H30 N2 -","- C84 H60 N4 -","2","1","CV6268","Zubatyuk, Roman I.; Kharanenko, Oleg I.; Shishkin, Oleg V.; Dulenko, Vladimir I.; Kibalny, Alexander V.","1,2-Bis(carbazol-9-ylmethylene)-3,4-diphenylcyclobutane","Acta Crystallographica Section E","2004","60","2","o301","o302","10.1107/S1600536804001813","","","0.71073","MoKα","","0.1801","0.0523","","","0.1029","0.1275","","","","","","0.957","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203179","8.437","0.002","6.853","0.001","16.011","0.003","90","","94.88","0.02","90","","922.4","0.3","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1-Cyclohexylmethoxymethyl-5-[2-hydroxy-1-(hydroxymethyl)ethylamino]cyclohexane- 1,2,3,4-tetraol","","- C17 H33 N O7 -","- C17 H33 N O7 -","- C34 H66 N2 O14 -","2","1","DN6110","Zhang Hong; Kui-Wu Wang; Yuan Jiang Pan","1-Cyclohexylmethoxymethyl-5-[2-hydroxy-1-(hydroxymethyl)ethylamino]cyclohexane-1,2,3,4-tetraol","Acta Crystallographica Section E","2004","60","2","o299","o300","10.1107/S1600536804001564","","","0.71073","MoKα","","0.0446","0.0357","","","0.0847","0.0875","","","","","","0.967","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203180","23.548","0.006","9.596","0.002","15.623","0.003","90","","115.505","0.006","90","","3186.2","1.2","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C37 H31 Cl2 Ir O P2 -","- C37 H31 Cl2 Ir O P2 -","- C148 H124 Cl8 Ir4 O4 P8 -","4","0.5","DN6111","Jonathan P. H. Charmant; Nicholas C. Norman; A. Guy Orpen; George R. Whittell","Carbonyldichlorohydridobis(triphenylphosphine)iridium(III)","Acta Crystallographica Section E","2004","60","2","m162","m163","10.1107/S1600536804000479","","","0.71073","MoKα","","0.0985","0.0561","","","0.1338","0.1531","","","","","","0.936","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203181","6.472","0.002","13.156","0.004","8.598","0.003","90","","97.157","0.005","90","","726.4","0.4","173","2","173","2","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C7 H19 Cl2 Ir O P2 -","- C7 H19 Cl2 Ir O P2 -","- C14 H38 Cl4 Ir2 O2 P4 -","2","1","DN6112","Jonathan P. H. Charmant; Nicholas C. Norman; A. Guy Orpen; George R. Whittell","Carbonyldichlorohydridobis(trimethylphosphine)iridium(III)","Acta Crystallographica Section E","2004","60","2","m164","m165","10.1107/S1600536804000480","","","0.71073","MoKα","","0.0454","0.0424","","","0.0975","0.0997","","","","","","1.054","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203182","10.6039","0.0011","12.9904","0.0014","18.1168","0.0014","90","","90","","90","","2495.6","0.4","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","5-phenyldiazenyl-6-methoxysalicylaldehyde","","- C14 H12 N2 O3 -","- C14 H12 N2 O3 -","- C112 H96 N16 O24 -","8","1","DN6114","Ersanlı, Cem Cüneyt; Odabas̨oǧlu, Mustafa; Albayrak, Çiǧdem; Erdönmez, Ahmet","6-Methoxy-5-(phenyldiazenyl)salicylaldehyde","Acta Crystallographica Section E","2004","60","2","o230","o231","10.1107/S1600536804000819","","","0.71073","MoKα","","0.0668","0.0422","","","0.0922","0.0995","","","","","","0.841","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203183","6.929","0.002","7.854","0.001","14.262","0.002","77.69","0.01","88.09","0.01","85.48","0.02","755.8","0.3","293","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C8 H3 Cl O3 -","- C8 H3 Cl O3 -","- C32 H12 Cl4 O12 -","4","2","DN6115","Zaisu Jin; Wenxi Wang; Weixiao Hu; Zhongyu Yang; Hongwei Chen; Richeng Xuan","5-Chloro-2-benzofuran-1,3-dione","Acta Crystallographica Section E","2004","60","2","o239","o240","10.1107/S1600536804001230","","","0.71073","MoKα","","0.0738","0.0362","","","0.0887","0.1036","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203184","9.268","0.009","10.15","0.01","13.115","0.013","93.919","0.008","101.078","0.008","95.278","0.008","1201","2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H28 N2 O2 -","- C28 H28 N2 O2 -","- C56 H56 N4 O4 -","2","1","DN6116","Atalay, Şehriman; Çoruh, Ufuk; Akdemir, Nesuhi; Aǧar, Erbil","C—H···π interactions in 4,5-bis(2-isopropyl-5-methylphenoxy)phthalonitrile","Acta Crystallographica Section E","2004","60","2","o303","o305","10.1107/S1600536804001758","","","0.71073","MoKα","","0.097","0.0438","","","0.1061","0.1199","","","","","","0.872","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203185","8.425","0.0003","10.29","0.0003","13.139","0.0005","71.432","0.0012","82.667","0.0012","89.769","0.0014","1070.13","0.06","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Gallium 8-hydroxyquinoline","Tris(quinolin-8-olato)gallium(III)","","- C27 H18 Ga N3 O3 -","- C27 H18 Ga N3 O3 -","- C54 H36 Ga2 N6 O6 -","2","1","FL6074","Rajeswaran, Manju; Jarikov, Viktor V.","Tris(quinolin-8-olato)gallium(III)","Acta Crystallographica Section E","2004","60","2","m217","m218","10.1107/S1600536804001242","","","0.71073","MoKα","","0.1296","0.0501","","","0.0945","0.1168","","","","","","0.891","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203186","4.1071","0.0003","12.855","0.001","15.296","0.001","90","","90","","90","","807.58","0.1","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","tribromoresorcinol","","","- C6 H3 Br3 O2 -","- C6 H3 Br3 O2 -","- C24 H12 Br12 O8 -","4","1","FL6075","Kirsop, Peter; Storey, John M. D.; Harrison, William T. A.","1,3,5-Tribromo-2,6-dihydroxybenzene","Acta Crystallographica Section E","2004","60","2","o222","o224","10.1107/S1600536804000571","","","0.71073","MoKα","","0.0658","0.0375","","","0.0515","0.0564","","","","","","0.997","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203187","7.8342","0.0006","8.3781","0.0007","10.6208","0.0009","70.507","0.005","75.84","0.005","87.002","0.005","636.85","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C9 H8 O10 U -","- C9 H8 O10 U -","- C18 H16 O20 U2 -","2","1","FL6076","Borkowski, Lauren A.; Cahill, Christopher L.","A novel uranium-containing coordination polymer: poly[[aqua(benzene-1,3,5-tricarboxylato)dioxouranium(VI)] monohydrate]","Acta Crystallographica Section E","2004","60","2","m198","m200","10.1107/S1600536804000765","","","0.71073","MoKα","","0.0487","0.0389","","","0.0685","0.0706","","","","","","1.18","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203188","13.174","0.005","14.061","0.005","15.905","0.005","100.197","0.005","111.189","0.005","99.505","0.005","2618","1.6","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","bis[N,N'-bis(pyridin-2-ylmethyl)pyrazine-2,3-dicarboxamide]cobalt(III) tris(perchlorate) acetonitrile 3.5-solvate","","- C43 H42.5 Cl3 Co N15.5 O16 -","- C43 H42.5 Cl3 Co N15.5 O16 -","- C86 H85 Cl6 Co2 N31 O32 -","2","1","FL6077","Dilovan S. Cati; Helen Stoeckli-Evans","A mononuclear cobalt(III) complex of the ligand <i>N,N</i>'-bis(pyridin-2-ylmethyl)pyrazine-2,3-dicarboxamide","Acta Crystallographica Section E","2004","60","2","m174","m176","10.1107/S1600536804000431","","","0.71069","MoKα","","0.1481","0.0477","","","0.0899","0.1195","","","","","","0.988","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2203189","6.9905","0.0008","9.8696","0.0011","23.782","0.002","91.431","0.013","93.524","0.013","102.678","0.014","1596.5","0.3","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","Di-μ-chloro-bis[(2,2':6,2""-terpyridine-κ^3^N)copper(II)] diperchlorate","","- C30 H22 Cl4 Cu2 N6 O8 -","- C30 H22 Cl4 Cu2 N6 O8 -","- C60 H44 Cl8 Cu4 N12 O16 -","2","1","FL6078","Gilles Gasser; Gaël Labat; Helen Stoeckli-Evans","Di-μ-chloro-bis[(2,2':6,2''-terpyridine-κ^3^<i>N</i>)copper(II)] diperchlorate: the triclinic polymorph","Acta Crystallographica Section E","2004","60","2","m244","m246","10.1107/S1600536804000443","","","0.71073","MoKα","","0.1491","0.068","","","0.1693","0.185","","","","","","0.971","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203190","8.878","0.002","17.533","0.004","14.398","0.003","90","","105.6","0.03","90","","2158.6","0.9","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Di-μ-phenylselenolato-bis[chloro(triphenylphosphine)palladium(II)]","","- C48 H40 Cl2 P2 Pd2 Se2 -","- C48 H40 Cl2 P2 Pd2 Se2 -","- C96 H80 Cl4 P4 Pd4 Se4 -","2","0.5","FL6080","Hannu-Kuure, Milja S.; Oilunkaniemi, Raija; Laitinen, Risto S.; Ahlgren, Markku","Di-μ-phenylselenolato-bis[chloro(triphenylphosphine)palladium(II)]","Acta Crystallographica Section E","2004","60","2","m214","m216","10.1107/S1600536804000960","","","0.71073","MoKα","","0.05","0.0384","","","0.0874","0.0935","","","","","","1.094","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203191","10.278","0.012","10.885","0.013","17.55","0.02","90","","92.224","0.017","90","","1962","4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Tetrakis(μ-2-bromobenzoato-κ^2^O,O')bis[(N,N'-dimethylformamide)copper(II)]","","- C34 H30 Br4 Cu2 N2 O10 -","- C34 H30 Br4 Cu2 N2 O10 -","- C68 H60 Br8 Cu4 N4 O20 -","2","0.5","HB6008","Yu-Liang Zhang; Su-Wen Chen; Wei-Sheng Liu; Da-Qi Wang","Tetrakis(μ-2-bromobenzoato-κ^2^<i>O,O</i>')bis[(<i>N,N</i>'-dimethylformamide)copper(II)], a new binuclear complex containing a metal‒metal bond","Acta Crystallographica Section E","2004","60","2","m196","m197","10.1107/S1600536804000649","","","0.71073","MoKα","","0.1126","0.0489","","","0.1066","0.1228","","","","","","0.855","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203192","23.714","0.001","8.0928","0.0004","20.012","0.001","90","","110.325","0.001","90","","3601.4","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diethyl phenyl(4-pyridylcarbonylamino)methylphosphonate","","- C17 H21 N2 O4 P -","- C17 H21 N2 O4 P -","- C136 H168 N16 O32 P8 -","8","1","HB6010","Fang, Hua; Wang, Jian-Feng; Liu, Xiao-Xia; Zhao, Yu-Fen; Ng, Seik Weng","Diethyl phenyl(4-pyridylcarbonylamino)methylphosphonate","Acta Crystallographica Section E","2004","60","2","o153","o154","10.1107/S1600536803029271","","","0.71073","MoKα","","0.079","0.072","","","0.2","0.207","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203193","9.7216","0.0019","16.113","0.003","17.339","0.004","90","","91.88","0.03","90","","2714.6","1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","[tris(2-aminoethyl)amine]manganese(II) tetraantimony heptasulfide hemihydrate, [Mn(dien)~2~][Sb~4~S~7~].0.5H~2~0","","- C8 H27 Mn N6 O0.5 S7 Sb4 -","- C8 H26 Mn N6 O0.5 S7 Sb4 -","- C32 H104 Mn4 N24 O2 S28 Sb16 -","4","1","HG6011","Schaefer, Michael; Kurowski, Daniel; Pfitzner, Arno; Näther, Christian; Bensch, Wolfgang","[Tris(2-aminoethyl)amine]manganese(II) heptasulfidotetraantimony(III) hemihydrate","Acta Crystallographica Section E","2004","60","2","m183","m185","10.1107/S1600536803027983","","","0.71073","MoKα","","0.0327","0.0281","","","0.081","0.0832","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203194","6.1396","0.0004","13.6929","0.0012","20.4225","0.0013","90","","97.51","0.005","90","","1702.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H13 N2 O -","- C23 H13 N2 O -","- C92 H52 N8 O4 -","4","1","HG6014","Petek, Hande; Işık, Şamil; Akdemir, Nesuhi; Kantar, Cihan; Aǧar, Erbil; Şenel, İsmet","4-(Anthracen-9-ylmethoxy)phthalonitrile","Acta Crystallographica Section E","2004","60","2","o256","o257","10.1107/S1600536804000285","","","0.71073","MoKα","","0.0736","0.052","","","0.1389","0.1469","","","","","","0.959","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203195","7.4924","0.0005","10.4589","0.0007","12.1369","0.0008","90","","107.393","0.001","90","","907.59","0.1","298","2","298","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","Tetraaquabis(4-pyridylthioactetato)nickel(II)","","- C14 H20 N2 Ni O8 S2 -","- C14 H20 N2 Ni O8 S2 -","- C28 H40 N4 Ni2 O16 S4 -","2","0.5","HG6016","Zhang, Xian-Ming; Fang, Rui-Qin; Wu, Hai-Shun; Ng, Seik Weng","Tetraaquabis(4-pyridylthioacetato)nickel(II)","Acta Crystallographica Section E","2004","60","2","m135","m136","10.1107/S1600536803029039","","","0.71073","MoKα","","0.029","0.026","","","0.07","0.072","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203196","16.391","0.002","8.54","0.001","10.4825","0.001","90","","90","","90","","1467.3","0.3","120","2","120","2","","","","","","","","5","P n a 21","P 2c -2n","33","","mer-trichlorotris(dimethyl sulfide)ruthenium(III)","","- C6 H18 Cl3 Ru S3 -","- C6 H18 Cl3 Ru S3 -","- C24 H72 Cl12 Ru4 S12 -","4","1","HG6017","Bolton, Peter R.; Levason, William; Reid, Gillian; Webster, Michael","<i>mer</i>-Trichlorotris(dimethyl sulfide)ruthenium(III)","Acta Crystallographica Section E","2004","60","2","m207","m208","10.1107/S1600536804001047","","","0.71073","MoKα","","0.0359","0.0291","","","0.0611","0.0642","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203197","9.209","0.003","10.182","0.003","19.158","0.005","90","","103.507","0.005","90","","1746.7","0.9","293","2","","","","","","","","","","6","P 1 n 1","P -2yac","7","","Poly[[silver(I)-di-μ-1,5-bis(phenylsulfanyl)pentane] tetrafluoroborate]","","- C34 H40 Ag B F4 S4 -","- C34 H40 Ag B F4 S4 -","- C68 H80 Ag2 B2 F8 S8 -","2","1","LH6148","Miao Du; Xiao-Jun Zhao","The two-dimensional coordination polymer poly[[silver(I)-di-μ-1,5-bis(phenylsulfanyl)pentane] tetrafluoroborate]","Acta Crystallographica Section E","2004","60","2","m193","m195","10.1107/S1600536803028605","","","0.71073","MoKα","","0.0369","0.0298","","","0.0611","0.0643","","","","","","1.069","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2203198","11.333","0.001","6.474","0.001","10.181","0.001","90","","112","0.01","90","","692.59","0.15","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","cis-7-azabicyclo[4.2.0]octan-8-one","","- C7 H11 N O -","- C7 H11 N O -","- C28 H44 N4 O4 -","4","1","LH6150","Argay, Gyula; Fábián, László; Kálmán, Alajos; Bernáth, Gábor; Cs. Gyarmati, Zsuzsanna","<i>cis</i>-7-Azabicyclo[4.2.0]octan-8-one","Acta Crystallographica Section E","2004","60","2","o170","o172","10.1107/S1600536803027958","","","1.5418","CuKα","","0.056","0.0521","","","0.1824","0.1853","","","","","","1.304","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203199","6.683","0.001","9.166","0.001","12.696","0.002","90","","90","","90","","777.71","0.19","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","cis-8-azabicyclo[5.2.0]nonan-9-one","","- C8 H13 N O -","- C8 H13 N O -","- C32 H52 N4 O4 -","4","1","LH6151","Argay, Gyula; Kálmán, Alajos; Bernáth, Gábor; Cs. Gyarmati, Zsuzsanna","<i>cis</i>-8-Azabicyclo[5.2.0]nonan-9-one","Acta Crystallographica Section E","2004","60","2","o173","o175","10.1107/S160053680302796X","","","1.5418","CUkα","","0.0714","0.066","","","0.2144","0.227","","","","","","1.979","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203200","8.92","0.007","12.053","0.006","15.658","0.006","90","","101.7","0.04","90","","1648.5","1.7","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(Z)-3-(3,4-dimethoxyphenyl)-2-(2-methoxyphenoxy)-2-propenoic acid","","- C18 H18 O6 -","- C18 H18 O6 -","- C72 H72 O24 -","4","1","LH6154","Langer, Vratislav; Li, Shiming; Lundquist, Knut; Stomberg, Rolf","(<i>Z</i>)-3-(3,4-Dimethoxyphenyl)-2-(2-methoxyphenoxy)-2-propenoic acid","Acta Crystallographica Section E","2004","60","2","o165","o167","10.1107/S1600536803029519","","","0.71069","MoKα","","0.0688","0.0345","","","0.0859","0.1012","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203201","6.492","0.001","9.857","0.002","28.154","0.006","90","","90","","90","","1801.6","0.6","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","catena-Poly[[trimethyltin(IV)]-μ-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)- 3-phenylpropionato-κ^2^O:O']","catena-Poly[[trimethyltin(IV)]-μ-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)- 3-phenylpropionato-κ^2^O:O']","","- C16 H19 N O4 Sn -","- C16 H19 N O4 Sn -","- C64 H76 N4 O16 Sn4 -","4","1","LH6155","Parvez, Masood; Ahmed, Sajjad; Ali, Saqib; Bhatti, Muhammad H.; Mazhar, Muhammad","<i>catena</i>-Poly[[trimethyltin(IV)]-μ-(2,5-dioxo-2,5-dihydro-1<i>H</i>-pyrrol-1-yl)-3-phenylpropionato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2004","60","2","m190","m192","10.1107/S1600536804000789","","","0.71073","MoKα","","0.025","0.023","","","0.059","0.06","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203202","17.667","0.003","6.708","0.002","14.425","0.003","90","","116.608","0.015","90","","1528.5","0.6","295","","295","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-amino-2,6-dichloro-5-nitropyrimidine","","- C4 H2 Cl2 N4 O2 -","- C4 H2 Cl2 N4 O2 -","- C32 H16 Cl16 N32 O16 -","8","1","LH6156","Declan McKeveney; Ronald J. Quinn; Christian O. Janssen; Peter C. Healy","4-Amino-2,6-dichloro-5-nitropyrimidine","Acta Crystallographica Section E","2004","60","2","o241","o243","10.1107/S160053680400100X","","","0.7107","MoKα","","0.0712","0.0473","","","0.1289","0.1441","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203203","13.4832","0.0011","13.4832","0.0011","13.4832","0.0011","90","","90","","90","","2451.2","0.3","173","2","173","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","","","- C12 H36 Cl2 Cu2 P4 -","- C12 H36 Cl2 Cu2 P4 -","- C48 H144 Cl8 Cu8 P16 -","4","0.333333","LH6159","Margraf, Günter; Lerner, Hans-Wolfram; Wagner, Matthias; Bolte, Michael","The absolute structure of tetrakis(trimethylphosphine)copper(I) dichlorocopper(I)","Acta Crystallographica Section E","2004","60","2","m186","m187","10.1107/S1600536804000790","","","0.71073","MoKα","","0.0328","0.0307","","","0.0788","0.0798","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203204","8.335","0.0009","9.8193","0.0008","14.8736","0.0014","89.948","0.006","74.391","0.009","68.276","0.005","1082.51","0.19","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","","","- C24 H21 As O3 Si -","- C24 H21 As O3 Si -","- C48 H42 As2 O6 Si2 -","2","1","LH6160","Ferguson, George; O'Leary, Brian J.; Spalding, Trevor R.","The arsenic(V) compound PhAs(O)(OH)(OSiPh~3~)","Acta Crystallographica Section E","2004","60","2","m222","m224","10.1107/S1600536804001217","","","0.71073","MoKα","","0.07","0.0352","","","0.0733","0.0795","","","","","","1.012","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203205","21.134","0.004","7.639","0.0015","14.384","0.003","90","","98.625","0.007","90","","2295.9","0.8","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[PV2+]2[Br-]^.^MeOH'","N,N'-Dibenzyl-4,7-phenanthrolinium dibromide methanol solvate","","- C27 H26 Br2 N2 O -","- C27 H26 Br2 N2 O -","- C108 H104 Br8 N8 O4 -","4","1","NA6279","Marilyn M. Olmstead; Jeff T. Suri; Bakthan Singaram","<i>N</i>,<i>N</i>'-Dibenzyl-4,7-phenanthrolinium dibromide methanol solvate","Acta Crystallographica Section E","2004","60","2","o275","o277","10.1107/S1600536804001370","","","0.71073","MoKα","","0.0334","0.0272","","","0.0685","0.0709","","","","","","1.053","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203206","16.376","0.003","13.894","0.003","9.0289","0.0015","90","","103.723","0.004","90","","1995.7","0.7","90","2","90","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N-[2-(Hydroxymethoxyboryl)benzyl]-4,7-phenanthrolinium bromide methanol solvate","","- C21 H22 B Br N2 O3 -","- C21 H22 B Br N2 O3 -","- C84 H88 B4 Br4 N8 O12 -","4","1","NA6280","Marilyn M. Olmstead; Jeff T. Suri; Bakthan Singaram","<i>N</i>-[2-(<i>H</i>ydroxymethoxyboryl)benzyl]-4,7-phenanthrolinium bromide methanol solvate","Acta Crystallographica Section E","2004","60","2","o278","o280","10.1107/S1600536804001369","","","0.71073","MoKα","","0.0677","0.042","","","0.0901","0.0962","","","","","","1.119","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203207","6.6521","0.0011","7.948","0.002","10.848","0.002","90","","90","","90","","573.5","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-Nitrosoazetidine-2-carboxylic acid","","- C4 H6 N2 O3 -","- C4 H6 N2 O3 -","- C16 H24 N8 O12 -","4","1","NA6283","Maria Gdaniec; Maria J. Milewska; Tadeusz Połoński","(<i>S</i>)-<i>N</i>-Nitrosoazetidine-2-carboxylic acid","Acta Crystallographica Section E","2004","60","2","o181","o183","10.1107/S1600536804000327","","","1.54178","CuKα","","0.0376","0.035","","","0.098","0.1002","","","","","","1.066","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203208","7.5058","0.0007","8.5766","0.0008","8.9156","0.0008","102.551","0.007","110.398","0.007","99.698","0.007","506.04","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H30 N2 Ni O10 -","- C16 H30 N2 Ni O10 -","- C16 H30 N2 Ni O10 -","1","0.5","NA6286","Yeşilel, Okan Zafer; Bulut, Ahmet; Uçar, İbrahim; İçbudak, Hasan; Ölmez, Halis; Büyükgüngör, Orhan","Bis(triethanolamine-κ^3^<i>N,O,O</i>')nickel(II) squarate","Acta Crystallographica Section E","2004","60","2","m228","m230","10.1107/S1600536804001503","","","0.71073","MoKα","","0.0339","0.0323","","","0.0886","0.0894","","","","","","1.078","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203209","7.978","0.004","8.593","0.004","7.797","0.008","111.01","0.06","104.91","0.06","61.65","0.03","436.7","0.6","297.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C8 H24 Cl2 Cu N4 O8 -","- C8 H24 Cl2 Cu N4 O8 -","- C8 H24 Cl2 Cu N4 O8 -","1","0.5","NA6287","Akitsu, Takashiro; Einaga, Yasuaki","Bis(<i>N,N</i>-dimethylethylenediamine-κ^2^<i>N,N</i>')bis(perchlorato-κ<i>O</i>)copper(II)","Acta Crystallographica Section E","2004","60","2","m234","m236","10.1107/S1600536804001461","","","0.7107","MoKα","","","0.031","","","","0.1133","","","","","","0.908","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203210","13.1166","0.0009","12.0736","0.0012","20.9806","0.0015","90","","104.454","0.005","90","","3217.4","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(2-Methoxy-1-naphthylmethoxy)phthalonitrile","","- C20 H14 N2 O2 -","- C20 H14 N2 O2 -","- C160 H112 N16 O16 -","8","2","NA6289","Yavuz Köysal; Şamil Işık; Nesuhi Akdemir; Erbil Ag̃ar; Cihan Kantar","4-(2-Methoxy-1-naphthylmethoxy)phthalonitrile","Acta Crystallographica Section E","2004","60","2","o285","o286","10.1107/S1600536804001473","","","0.71073","MoKα","","0.1456","0.0379","","","0.0702","0.0874","","","","","","0.68","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203211","7.5839","0.0004","9.7257","0.0006","11.9698","0.0007","76.927","0.001","87.388","0.001","79.807","0.001","846.41","0.08","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","μ-Benzene-1,2,4,5-tetracarboxylato-bis[triaqua(2,2'-bipyridine)nickel(II)] dihydrate","","- C30 H34 N4 Ni2 O16 -","- C30 H34 N4 Ni2 O16 -","- C30 H34 N4 Ni2 O16 -","1","0.5","NG6008","Xin-Hua Li; Hong-Ping Xiao; Mao-Lin Hu","μ-Benzene-1,2,4,5-tetracarboxylato-bis[triaqua(2,2'-bipyridine)nickel(II)] dihydrate","Acta Crystallographica Section E","2004","60","2","m242","m243","10.1107/S1600536804000807","","","0.71073","MoKα","","0.03","0.029","","","0.077","0.078","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203212","14.791","0.002","6.939","0.001","15.424","0.003","90","","90","","90","","1583","0.4","298.2","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C14 H18 Co N2 O6 -","- C14 H18 Co N2 O6 -","- C56 H72 Co4 N8 O24 -","4","0.5","OB6330","Akitsu, Takashiro; Iwakura, Izumi; Tanaka, Hirotaka; Ikeno, Taketo; Einaga, Yasuaki; Yamada, Tohru","[<i>N,N</i>'-Bis(2-methoxycarbonyl-3-oxobutylidene)ethylenediaminato-κ^4^<i>O,N,N</i>',<i>O</i>']cobalt(II)","Acta Crystallographica Section E","2004","60","2","m149","m150","10.1107/S1600536803029520","","","0.7107","MoKα","","","0.0408","","","","0.135","","","","","","1.054","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2203213","10.5582","0.0005","19.5961","0.0008","24.003","0.0011","90","","90","","90","","4966.2","0.4","120","2","120","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","Triphenylphenacylphosphonium hydrogenmaleate","Benzoylmethyltriphenylphosphonium hydrogenmaleate","","- C30 H25 O5 P -","- C30 H25 O5 P -","- C240 H200 O40 P8 -","8","1","OB6335","Mahimaidoss Baby Mariyatra; Elinor C. Spencer; Krishanaswamy Panchanatheswaran; Judith A.K. Howard","Benzoylmethyltriphenylphosphonium hydrogen maleate: supramolecular layer formation due to C—H···O interactions","Acta Crystallographica Section E","2004","60","2","o162","o164","10.1107/S1600536803029404","","","0.71073","MoKα","","0.0622","0.0407","","","0.0936","0.1061","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203214","11.722","0.002","16.945","0.003","9.898","0.002","90","","90","","90","","1966","0.6","293","2","293","2","","","","","","","","4","F d d 2","F 2 -2d","43","3-Methyl-3-Pyrazolin-5-one","3-Methyl-3-Pyrazolin-5-one","","- C4 H6 N2 O -","- C4 H6 N2 O -","- C64 H96 N32 O16 -","16","1","OB6336","Zhenfeng Zhang; Shuo Jin; Siqian Wang; Bo Liu; Jianping Guo","3-Methyl-3-pyrazolin-5-one","Acta Crystallographica Section E","2004","60","2","o315","o316","10.1107/S160053680302974X","","","0.71073","MoKα","","0.045","0.0427","","","0.1137","0.1152","","","","","","1.163","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203215","27.2961","0.0009","14.4293","0.0017","7.568","0.004","90","","90","","90","","2980.8","1.6","293","","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","p-[p^'^-methylphenylazo]-o-allylphenol monohydrate","","- C16 H18 N2 O2 -","- C16 H18 N2 O2 -","- C128 H144 N16 O16 -","8","1","OB6337","Karadayı, Nevzat; Turgut, Günseli; Odabas̨oğlu, Mustafa; Büyükgüngör, Orhan","4-(4-Methylphenylazo)-2-allylphenol monohydrate","Acta Crystallographica Section E","2004","60","2","o176","o178","10.1107/S1600536803029751","","","0.71073","MoKα","","0.2183","0.0685","","","0.1482","0.1799","","","","","","0.882","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203216","10.695","0.0008","12.3204","0.001","14.8486","0.0012","90","","101.144","0.006","90","","1919.7","0.3","291","","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-[(3-Chlorophenyl)diazenyl]-6-methoxy- 2-{[tris(hydroxymethyl)methyl]aminomethylene}cyclohexa-3,5-dien-1(2H)-one","","- C18 H20 Cl N3 O5 -","- C18 H20 Cl N3 O5 -","- C72 H80 Cl4 N12 O20 -","4","1","OB6339","Kos̨ar, Bas̨ak; Albayrak, Çiǧdem; Odabas̨oǧlu, Mustafa; Büyükgüngör, Orhan","4-[(3-Chlorophenyl)diazenyl]-6-methoxy-2-{[tris(hydroxymethyl)methyl]aminomethylene}cyclohexa-3,5-dien-1(2<i>H</i>)-one","Acta Crystallographica Section E","2004","60","2","o190","o192","10.1107/S1600536804000108","","","0.71073","MoKα","","0.0657","0.0427","","","0.1077","0.1161","","","","","","0.94","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203217","17.4603","0.0017","10.7156","0.0012","10.6495","0.0009","90","","94.83","0.007","90","","1985.4","0.3","293","2","291","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-[(4-methylphenyl)diazenyl]-6-methoxy-2-{[tris(hydroxymethyl)methyl] aminomethylene}cyclohexa-3,5-dien-1(2H)-one","","- C19 H23 N3 O5 -","- C19 H23 N3 O5 -","- C76 H92 N12 O20 -","4","1","OB6342","Kos̨ar, Bas̨ak; Albayrak, Çiǧdem; Odabas̨oǧlu, Mustafa; Büyükgüngör, Orhan","4-[(4-Methylphenyl)diazenyl]-6-methoxy-2-{[tris(hydroxymethyl)methyl]aminomethylene}cyclohexa-3,5-dien-1(2<i>H</i>)-one","Acta Crystallographica Section E","2004","60","2","o246","o247","10.1107/S1600536804001102","","","0.71073","MoKα","","0.1767","0.0711","","","0.1368","0.1729","","","","","","0.941","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203218","20.149","0.003","10.8606","0.0008","7.6424","0.001","90","","81.892","0.011","90","","1655.7","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(4-Benzyloxyphenoxy)phthalonitrile","","- C21 H14 N2 O2 -","- C21 H14 N2 O2 -","- C84 H56 N8 O8 -","4","1","OB6345","Karadayı, Nevzat; Is̨ık, S̨amil; Akdemir, Nesuhi; Ağar, Erbil; Özil, Musa","4-(4-Benzyloxyphenoxy)phthalonitrile","Acta Crystallographica Section E","2004","60","2","o254","o255","10.1107/S160053680400114X","","","0.71073","MoKα","","0.1181","0.0565","","","0.1631","0.1788","","","","","","0.989","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203219","6.228","0.001","9.482","0.002","10.76","0.002","77.66","0.03","87.74","0.03","74.47","0.03","598","0.2","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","N,N,N',N'-Tetrakis(2-pyridylmethyl)-1,2-diaminoethane","","- C26 H28 N6 -","- C26 H28 N6 -","- C26 H28 N6 -","1","0.5","OB6346","Fujihara, Takashi; Saito, Miki; Nagasawa, Akira","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetrakis(2-pyridylmethyl)-1,2-diaminoethane: a multidentate ligand","Acta Crystallographica Section E","2004","60","2","o262","o263","10.1107/S1600536804001254","","","0.71073","MoKα","","0.0865","0.0536","","","0.1247","0.1417","","","","","","1.023","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203220","21.619","0.003","13.656","0.003","23.517","0.004","90","","103.296","0.014","90","","6757","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[tris(2,2'-bipyridyl-κ^2^N,N')iron(II)] cyclo-tetravanadate decahydrate","","- C60 H68 Fe2 N12 O22 V4 -","- C60 H48 Fe2 N12 O22 V4 -","- C240 H192 Fe8 N48 O88 V16 -","4","0.5","OM6193","Ming-Hua Huang; Li-Hua Bi; Shao-Jun Dong","Bis[tris(2,2'-bipyridyl-κ^2^<i>N,N</i>')iron(II)] <i>cyclo</i>-tetravanadate decahydrate","Acta Crystallographica Section E","2004","60","2","m153","m155","10.1107/S1600536803029532","","","0.71073","MoKα","","0.1116","0.0741","","","0.195","0.2111","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203221","9.1464","0.0005","18.6955","0.001","16.4401","0.001","90","","95.806","0.004","90","","2796.8","0.3","297","1","297","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","rac-[2,2'-Bis(1-ethylbenzimidazol-2-yl-κN^3^)biphenyl]dichloronickel(II)","","- C30 H26 Cl2 N4 Ni -","- C30 H26 Cl2 N4 Ni -","- C120 H104 Cl8 N16 Ni4 -","4","1","OM6201","Robert T. Stibrany; Michael G. Matturro; Stephen Zushma; Abhimanyu O. Patil","<i>rac</i>-[2,2'-Bis(1-ethylbenzimidazol-2-yl-κ<i>N</i>^3^)biphenyl]dichloronickel(II)","Acta Crystallographica Section E","2004","60","2","m188","m189","10.1107/S160053680400056X","","","0.71073","MoKα","","0.1075","0.059","","","0.1403","0.169","","","","","","1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203222","6.3657","0.0016","6.3657","0.0016","52.125","0.013","90","","90","","90","","2112.2","0.9","297","2","293","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","2,5,6-trichloro-4-iodoisophthalonitrile","","- C8 Cl3 I N2 -","- C8 Cl3 I N2 -","- C64 Cl24 I8 N16 -","8","1","OM6205","Britton, Doyle","2,5,6-Trichloro-4-iodoisophthalonitrile","Acta Crystallographica Section E","2004","60","2","o184","o186","10.1107/S1600536804000133","","","0.71073","MoKα","","0.069","0.05","","","0.092","0.095","","","","","","1.16","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2203223","17.795","0.004","5.394","0.002","12.431","0.002","90","","100.65","0.01","90","","1172.7","0.5","295","2","295","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C11 H15 N O5 -","- C11 H15 N O5 -","- C44 H60 N4 O20 -","4","1","OM6206","Zi-Qiang Hu; Duan-Jun Xu; Yuan-Zhi Xu","(<i>S</i>)-Alanine‒(<i>S</i>)-mandelic acid (1/1)","Acta Crystallographica Section E","2004","60","2","o269","o271","10.1107/S160053680400145X","","","0.71073","MoKα","","0.063","0.054","","","0.146","0.154","","","","","","1.062","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203224","16.866","0.003","12.704","0.005","10.41","0.002","90","","90","","90","","2230.5","1.1","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4-[(4-chlorobenzylidene)-amino]-phenol","","- C13 H10 Cl N O -","- C13 H10 Cl N O -","- C104 H80 Cl8 N8 O8 -","8","1","RN6011","Kazak, Canan; Aygün, Muhittin; Turgut, Günseli; Odabaşoǧlu, Mustafa; Büyükgüngör, Orhan; Kahveci, Nermin","4-[(4-Chlorobenzylidene)amino]phenol","Acta Crystallographica Section E","2004","60","2","o252","o253","10.1107/S1600536804001138","","","0.71069","MoKα","","0.0888","0.0629","","","0.1556","0.193","","","","","","1.107","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203226","34.738","0.004","9.5934","0.0012","10.0715","0.0019","90.278","0.012","93.993","0.011","90.021","0.01","3348.2","0.9","248","","","","","","","","","","","4","P 1","P 1","1","","","","- C79 H83 N O10 -","- C79 H83 N O10 -","- C158 H166 N2 O20 -","2","2","SU6066","Ohba, Shigeru; Miyamoto, Hisakazu","(<i>R,R</i>)-(‒)-<i>trans</i>-1,4-Dioxaspiro[4,4]nonane-2,3-diylbis(diphenylmethanol)‒<i>N</i>-allyl-<i>N</i>-propyl-3-oxocyclohexene-1-carboxamide (2/1)","Acta Crystallographica Section E","2004","60","2","o216","o218","10.1107/S1600536804000145","","","1.5418","CuKα","","","0.0768","","","","0.2223","","","","","","1.037","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203227","10.5196","0.0004","6.4129","0.0003","11.7201","0.0007","90","","114.107","0.002","90","","721.69","0.06","150","","150","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C16 H14 O5 -","- C16 H14 O5 -","- C32 H28 O10 -","2","1","SU6068","Mughal, Robila K.; Pritchard, Robin G.; Davey, Roger J.","(2<i>S</i>)-[(2<i>S</i>)-2-Hydroxy-2-phenylethanoyloxy]phenylacetic acid","Acta Crystallographica Section E","2004","60","2","o232","o233","10.1107/S1600536804000741","","","0.71073","MoKα","","0.0588","0.0403","","","0.0893","0.0976","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203228","29.427","0.011","5.2611","0.0017","17.947","0.01","90","","116.2","0.02","90","","2493.1","1.9","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-(phenylamino)sydno[3,4-a]quinoxaline","","- C15 H10 N4 O2 -","- C15 H10 N4 O2 -","- C120 H80 N32 O16 -","8","1","SU6069","Riddle, Gordon B.; Grossie, David A.; Turnbull, Kenneth","A new sydnone structure: 4-(phenylamino)sydno[3,4-<i>a</i>]quinoxaline","Acta Crystallographica Section E","2004","60","2","o258","o259","10.1107/S1600536804000777","","","0.71073","MoKα","","0.0674","0.0531","","","0.1256","0.1336","","","","","","1.058","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203229","7.723","0.007","14.255","0.001","22.53","0.002","90","","90","","90","","2480","2","293","","293","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","5-chloro-6-(2-fluorobenzoyl)-1,3-benzoxazol-2(3H)-one","","- C14 H7 Cl F N O3 -","- C14 H7 Cl F N O3 -","- C112 H56 Cl8 F8 N8 O24 -","8","1","SU6070","Abdullah Aydın; Tijen Önkol; Mehmet Akkurt; Orhan Büyükgüngör; Serdar Ünlü","5-Chloro-6-(2-fluorobenzoyl)-1,3-benzoxazol-2(3<i>H</i>)-one","Acta Crystallographica Section E","2004","60","2","o244","o245","10.1107/S1600536804001011","","","0.71073","MoKα","","0.0637","0.0317","","","0.0683","0.0727","","","","","","0.858","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203230","22.1161","0.001","8.7361","0.0005","22.3793","0.001","90","","95.336","0.004","90","","4305.1","0.4","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,3-Bis(2-phenylethyl)benzimidazolium-2-dithiocarboxylate","","- C24 H22 N2 S2 -","- C24 H22 N2 S2 -","- C192 H176 N16 S16 -","8","2","SU6072","Mehmet Akkurt; Sema Öztürk; Hasan Küçükbay; Ersin Orhan; Orhan Büyükgüngör","1,3-Bis(2-phenylethyl)benzimidazolium-2-dithiocarboxylate","Acta Crystallographica Section E","2004","60","2","o219","o221","10.1107/S160053680400073X","","","0.71073","MoKα","","0.0917","0.0354","","","0.0747","0.0844","","","","","","0.817","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203231","8.906","0.001","16.768","0.003","10.628","0.003","90","","93.39","0.02","90","","1584.4","0.6","293","2","293","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","halfppt","1,1-diphenyl-2-(4-methylphenyl)ethene","","- C21 H18 -","- C21 H18 -","- C84 H72 -","4","1","SU6073","Vande Velde, Christophe M. L.; Wuyts, Cindy; Geise, Herman J.; Blockhuys, Frank","2-(4-Methylphenyl)-1,1-diphenylethene","Acta Crystallographica Section E","2004","60","2","o248","o249","10.1107/S1600536804000984","","","0.71073","MoKα","","0.1266","0.0405","","","0.0925","0.1169","","","","","","0.95","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203232","13.113","0.003","9.999","0.003","18.474","0.003","90","","90","","90","","2422.3","1","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","dimethoxyphenylthiocarbamate","O-(3,5-dimethoxyphenyl)-N,N-dimethylthiocarbamate","","- C11 H15 N O3 S -","- C11 H15 N O3 S -","- C88 H120 N8 O24 S8 -","8","1","TK6147","Vande Velde, Christophe M. L.; Geise, Herman J.; Blockhuys, Frank","<i>O</i>-(3,5-Dimethoxyphenyl) <i>N,N</i>-dimethylthiocarbamate","Acta Crystallographica Section E","2004","60","2","o199","o200","10.1107/S1600536804000467","","","0.71073","MoKα","","0.118","0.034","","","0.078","0.097","","","","","","0.95","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203233","8.008","0.004","18.046","0.003","9.8377","0.0016","90","","96.04","0.02","90","","1413.8","0.8","293","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","benzyl(1,1-dimethyl-3-oxobutyl)ammonium iodide","","- C13 H20 I N O -","- C13 H20 I N O -","- C52 H80 I4 N4 O4 -","4","1","TK6148","Rademeyer, Melanie","Benzyl(1,1-dimethyl-3-oxobutyl)ammonium iodide","Acta Crystallographica Section E","2004","60","2","o267","o268","10.1107/S1600536804001436","","","0.71073","MoKα","","0.028","0.025","","","0.057","0.059","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203234","10.196","0.003","10.41","0.004","13.308","0.005","79.46","0.005","68.928","0.004","61.01","0.004","1152.8","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Bis(μ-5-phenyltetrazolate-κ^2^N^2^:N^3^)bis[(2,2'-bipyridine- κ^2^N,N')bis(5-phenyltetrazolate-κN^2^)copper(II)]","","- C48 H36 Cu2 N20 -","- C48 H36 Cu2 N20 -","- C48 H36 Cu2 N20 -","1","0.5","TK6149","Ze-Huai, Shao; Jun, Luo; Rui-Fang, Cai; Xi-Geng, Zhou; Lin-Hong, Weng; Zhen-Xia, Chen","Bis(μ-5-phenyltetrazolate-κ^2^<i>N</i>^2^:<i>N</i>^3^)bis[(2,2'-bipyridine-κ^2^<i>N,N</i>')bis(5-phenyltetrazolate-κ<i>N</i>^2^)copper(II)]","Acta Crystallographica Section E","2004","60","2","m225","m227","10.1107/S1600536804001345","","","0.71073","MoKα","","0.076","0.052","","","","0.118","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203235","5.569","0.003","15.062","0.007","18.245","0.009","90","","90","","90","","1530.4","1.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-Benzyl-3-(α-hydroxybenzylidene)pyrrolidine-2,4-dione","","- C18 H15 N O3 -","- C18 H15 N O3 -","- C72 H60 N4 O12 -","4","1","WK6005","You-Quan Zhu; Hai-Bin Song; Jian-Rong Li; Chang-Sheng Yao; Fang-Zhong Hu; Xiao-Mao Zou; Hua-Zheng Yang","1-Benzyl-3-(α-hydroxybenzylidene)pyrrolidine-2,4-dione","Acta Crystallographica Section E","2004","60","2","o196","o198","10.1107/S1600536804000364","","","0.71073","MoKα","","0.112","0.0593","","","0.1132","0.1307","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203236","9.792","0.001","9.832","0.001","11.556","0.002","101.56","0.002","99.974","0.002","108.034","0.002","1002.8","0.2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","5-Methyl-2-phenyl-4-[(Z)-(2-tolylamino)phenylmethylene]pyrazol-3(2H)-one","","- C24 H21 N3 O -","- C24 H21 N3 O -","- C48 H42 N6 O2 -","2","1","WK6006","Bao, Feng; Lü, Xingqiang; Wu, Qing; Kang, Beisheng; Ng, Seik Weng","5-Methyl-2-phenyl-4-[(<i>Z</i>)-(2-tolylamino)phenylmethylene]pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2004","60","2","o155","o156","10.1107/S1600536803029258","","","0.71073","MoKα","","0.071","0.043","","","0.114","0.133","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203237","6.809","0.0003","6.809","0.0003","10.376","0.0009","90","","90","","120","","416.61","0.04","293","2","293","2","","","","","","","","4","P -6 c 2","P -6c 2","188","","Calcium potassium cyclo-triphosphate","","- Ca K O9 P3 -","- Ca K O9 P3 -","- Ca2 K2 O18 P6 -","2","0.166667","","Malin Sandström; Dan Boström","Calcium potassium cyclo-triphosphate","Acta Crystallographica, Section E","2004","60","2","i15","i17","10.1107/S1600536804000303","","","0.71073","MoKα","","0.0248","0.024","","","0.0556","0.056","","","","","","1.182","","","","has coordinates","277836","2022-09-14","17:02:02",""
"2203238","10.6226","0.0019","10.6226","0.0019","4.0954","0.0015","90","","90","","120","","400.21","0.18","273","2","298","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Lanthanum(III) nitrite","","- La N3 O6 -","- La N3 O6 -","- La3 N9 O18 -","3","0.166667","","Qing-Qing Kang; La-Sheng Long; Rong-Bin Huang; Lan-Sun Zheng","La(NO~2~)~3~, a novel (3,9)-connected lanthanide-based network","Acta Crystallographica, Section E","2004","60","2","i12","i14","10.1107/S1600536804000297","","","0.71073","MoKα","","0.0128","0.0128","","","0.0292","0.0292","","","","","","1.137","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2203239","24.755","0.0009","24.8832","0.0009","8.2003","0.0003","90","","90","","90","","5051.3","0.3","297","","297","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Li Mn2 O4 -","- Li Mn2 O4 -","- Li72 Mn144 O288 -","72","2.25","","Tateishi, Kenji; Suda, Katsumi; du Boulay, Douglas; Ishizawa, Nobuo; Oishi, Shuji","LiMn~2~O~4~: a spinel-related low-temperature modification","Acta Crystallographica, Section E","2004","60","2","i18","i21","10.1107/S160053680400025X","","","0.75044","Synchrotron","","0.038","0.038","","0.038","","0.038","","","3.203","","","3.203","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2203240","9.6254","0.0006","7.0218","0.0005","12.3761","0.0008","90","","90","","90","","836.47","0.1","153","2","153","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","Dirubidium tetrathiotungstate","","- Rb2 S4 W -","- Rb2 S4 W -","- Rb8 S16 W4 -","4","0.5","","Yao, Jiyong; Ibers, James A.","Dirubidium tetrathiotungstate, Rb~2~[WS~4~]","Acta Crystallographica, Section E","2004","60","2","i10","i11","10.1107/S1600536804000169","","","0.71073","MoKα","","0.0268","0.0234","","","0.0588","0.0608","","","","","","1.334","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2203241","3.975","0.004","7.417","0.004","12.82","0.008","76.36","0.04","88.54","0.04","88.62","0.04","367.1","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","3-cyano-4,6-dimethyl-2-pyridone","","","- C8 H8 N2 O -","- C8 H8 N2 O -","- C16 H16 N4 O2 -","2","1","WN6204","Victor B. Rybakov; Alexander A. Bush; Eugene V. Babaev; Leonid A. Aslanov","3-Cyano-4,6-dimethyl-2-pyridone (Guareschi pyridone)","Acta Crystallographica Section E","2004","60","2","o160","o161","10.1107/S1600536803029295","","","1.5418","CuKα","","0.0838","0.0468","","","0.1148","0.138","","","","","","1.076","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2203242","9.02","0.002","11.39","0.003","12.89","0.003","73.95","0.02","86.18","0.02","67.49","0.02","1174.6","0.5","293","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C25 H18 Cl3 N3 O4 -","- C25 H18 Cl3 N3 O4 -","- C50 H36 Cl6 N6 O8 -","2","1","WN6206","Kovalenko, Sergiy M.; Baumer, Vyacheslav N.; Zhuravel, Iryna V.; Chernykh, Valentyn P.","{3-[(4-Chloroanilino)carbonyl]-2-[(3,4-dichlorophenyl)imino]-8-methyl-2<i>H</i>-pyrano[2,3-<i>c</i>]pyridin-5-yl}methyl acetate","Acta Crystallographica Section E","2004","60","2","o187","o189","10.1107/S1600536804000078","","","0.71073","MoKα","","","0.043","","","","0.071","","","","","","0.92","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203243","10.5512","0.001","10.4538","0.0012","8.2152","0.001","90","","91.061","0.01","90","","905.98","0.17","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H28 O2 S4 -","- C14 H28 O2 S4 -","- C28 H56 O4 S8 -","2","0.5","WN6208","Gültekin, Zeynep; Bayrak, Hacer; Frey, Wolfgang; Hökelek, Tuncer","2,9-Bis(methoxymethyl)-1,3,8,10-tetrathiacyclotetradecane","Acta Crystallographica Section E","2004","60","2","o157","o159","10.1107/S1600536803029283","","","0.71073","MoKα","","0.0587","0.0495","","","0.1315","0.1429","","","","","","1.018","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203244","12.9211","0.0005","14.0305","0.0005","8.0488","0.0003","90","","99.341","0.002","90","","1439.81","0.09","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(2,4-Dichlorophenyl)-2-phthalimidoethanone","","- C16 H9 Cl2 N O3 -","- C16 H9 Cl2 N O3 -","- C64 H36 Cl8 N4 O12 -","4","1","WN6209","Zhang, Xingguo; Zhong, Ping; Hu, Maolin; Xiao, Hongping","1-(2,4-Dichlorophenyl)-2-phthalimidoethanone","Acta Crystallographica Section E","2004","60","2","o297","o298","10.1107/S1600536804001412","","","0.71073","MoKα","","0.0425","0.0373","","","0.1075","0.1108","","","","","","1.081","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203245","21.224","0.007","15.83","0.004","15.55","0.005","90","","109.42","0.03","90","","4927","3","293","2","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H26 Cl N3 O4 -","- C27 H26 Cl N3 O4 -","- C216 H208 Cl8 N24 O32 -","8","1","WN6211","Baumer, Vyacheslav N.; Silin, Olexiy V.; Savchenko, Timur I.; Nikitchenko, Viktor M.; Kovalenko, Sergiy M.","5-Benzyl-7,9-dimethoxy-3-phenyl-5<i>H</i>-pyrazolo[4,3-<i>c</i>]quinolin-1-ium chloride acetic acid solvate","Acta Crystallographica Section E","2004","60","2","o294","o296","10.1107/S1600536804001606","","","0.71073","MoKα","","","0.046","","","","0.083","","","","","","0.99","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203246","6.9211","0.001","8.3176","0.001","10.648","0.001","79.21","0.1","76.19","0.1","85.84","0.1","584.5","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-Chloro-3-chloromethylbenzo[h]quinoline","","- C14 H9 Cl2 N -","- C14 H9 Cl2 N -","- C28 H18 Cl4 N2 -","2","1","WW6143","Beghidja, Adel; Benboudiaf, Ali; Beghidja, Chahrazed; Welter, Richard","2-Chloro-3-chloromethylbenzo[<i>h</i>]quinoline","Acta Crystallographica Section E","2004","60","2","o228","o229","10.1107/S1600536804000650","","","0.71073","MoKα","","0.1213","0.0601","","","0.1585","0.2095","","","","","","1.081","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203247","7.641","0.002","23.508","0.005","11.134","0.002","90","","102.4","0.03","90","","1953.3","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetraaqua(2,2'-bipyridine)zinc(II) terephthalate","","- C18 H20 N2 O8 Zn -","- C18 H20 N2 O8 Zn -","- C72 H80 N8 O32 Zn4 -","4","1","WW6148","Xu, Hongbin; Liang, Yucang; Su, Zhongmin; Zhao, Yahui; Shao, Kuizhan; Zhang, Hengjun; Yue, Shumei","Tetraaqua(2,2'-bipyridine)zinc(II) terephthalate","Acta Crystallographica Section E","2004","60","2","m142","m144","10.1107/S1600536803029210","","","0.71073","MoKα","","0.0775","0.0598","","","0.1944","0.2015","","","","","","1.104","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2203248","8.604","0.002","27.271","0.006","5.914","0.001","90","","90","","90","","1387.7","0.5","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","catena-Poly[[diaquazinc(II)-μ-benzene-1,3-dioxyacetate] dihydrate]","","- C10 H16 O10 Zn -","- C10 H8 O10 Zn -","- C40 H32 O40 Zn4 -","4","1","WW6150","Gao, Shan; Li, Jian-Rong; Liu, Ji-Wei; Huo, Li-Hua","<i>catena</i>-Poly[[diaquazinc(II)-μ-benzene-1,3-dioxyacetate] dihydrate]","Acta Crystallographica Section E","2004","60","2","m140","m141","10.1107/S1600536803029234","","","0.71073","MoKα","","0.0505","0.0376","","","0.0905","0.0933","","","","","","0.916","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203249","7.933","0.002","8.737","0.003","9.907","0.003","79.464","0.004","72.596","0.004","79.918","0.005","638.9","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3-(2,4-Dichlorophenyl)-1-(2-furyl)-3-hydroxypropan-1-one","","- C13 H10 Cl2 O3 -","- C13 H10 Cl2 O3 -","- C26 H20 Cl4 O6 -","2","1","WW6151","Yu, Zhifang; Gu, Xiuyan; Zhao, Bing; Cao, Xiaoqiang","3-(2,4-Dichlorophenyl)-1-(2-furyl)-3-hydroxypropan-1-one","Acta Crystallographica Section E","2004","60","2","o168","o169","10.1107/S1600536803029568","","","0.71073","MoKα","","0.0498","0.0385","","","0.1018","0.1109","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203250","11.3103","0.0004","13.3106","0.0003","14.928","0.0005","90","","90","","90","","2247.36","0.12","296.2","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H28 I2 N2 O -","- C21 H28 I2 N2 O -","- C84 H112 I8 N8 O4 -","4","1","WW6155","Yoshikawa, Naokazu; Takemoto, Keiko; Sakamoto, Jun; Kanehisa, Nobuko; Kai, Yasushi; Takashima, Hiroshi; Tsukahara, Keiichi","(11<i>R</i>)-(‒)-<i>N,N</i>'-Dimethylcinchonidinium diiodide","Acta Crystallographica Section E","2004","60","2","o281","o282","10.1107/S1600536804000583","","","0.7107","MoKα","","","0.0498","","","","0.0843","","","","","","1.095","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2203251","10.8677","0.0005","21.96","0.001","13.716","0.0006","90","","90.715","0.001","90","","3273.1","0.3","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(3,5-dimethylpiperazinium) di-μ~5~-hydrogenphosphato-penta-μ~2~-oxo-pentakis[dioxomolybdenum(III)] dihydrate","","- C12 H38 Mo5 N4 O25 P2 -","- C12 H38 Mo5 N4 O25 P2 -","- C48 H152 Mo20 N16 O100 P8 -","4","0.5","YA6186","Zhang, Xian-Ming; Fang, Rui-Qin; Wu, Hai-Shun; Ng, Seik Weng","Bis(3,5-dimethylpiperazinium) di-μ~5~-hydrogenphosphato-penta-μ~2~-oxo-pentakis[dioxomolybdenum(V)] dihydrate","Acta Crystallographica Section E","2004","60","2","m171","m173","10.1107/S160053680400011X","","","0.71073","MoKα","","0.042","0.034","","","0.078","0.095","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203252","23.263","0.001","7.0762","0.0003","11.5216","0.0005","90","","100.989","0.001","90","","1861.84","0.14","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Diamminediaquabis(4-pyridylthioacetato)copper(II)","","- C14 H22 Cu N4 O6 S2 -","- C14 H22 Cu N4 O6 S2 -","- C56 H88 Cu4 N16 O24 S8 -","4","0.5","YA6187","Huang, Yong-Qing; Zhang, Hui; Chen, Jian-Gu; Zou, Wei; Li, Li; Wei, Zan-Bin; Ng, Seik Weng","Diamminediaquabis(4-pyridylthioacetato)copper(II)","Acta Crystallographica Section E","2004","60","2","m133","m134","10.1107/S1600536803028629","","","0.71073","MoKα","","0.039","0.034","","","0.087","0.09","","","","","","0.95","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203253","10.8893","0.001","10.6093","0.0007","23.629","0.002","90","","94.297","0.007","90","","2722.1","0.4","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3,5-Bis(4-methylbenzoyl)-2,6-bis(4-methylphenyl)-4H-pyran-4-one","","- C35 H28 O4 -","- C35 H28 O4 -","- C140 H112 O16 -","4","1","YA6191","Dinçer, Muharrem; Yıldırım, İsmail; Koca, İrfan; Özdemir, Namık","3,5-Bis(4-methylbenzoyl)-2,6-bis(4-methylphenyl)-4<i>H</i>-pyran-4-one","Acta Crystallographica Section E","2004","60","2","o207","o209","10.1107/S1600536804000121","","","0.71073","MoKα","","0.102","0.045","","","0.084","0.09","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203254","10.182","0.002","12.131","0.002","11.3","0.002","90","","106.11","0.01","90","","1340.9","0.4","296.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H22 Cl2 Fe2 N2 O4 -","- C28 H22 Cl2 Fe2 N2 O4 -","- C56 H44 Cl4 Fe4 N4 O8 -","2","0.5","YA6192","Koikawa, Masayuki; Iwashita, Kumiko; Tokii, Tadashi","Dichlorobis[<i>N</i>-(2-oxymethylphenyl)salicylideneiminato]diiron(III)","Acta Crystallographica Section E","2004","60","2","m239","m241","10.1107/S1600536804001709","","","0.7107","MoKα","","","0.04","","","","0.123","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203255","15.343","0.003","8.576","0.0014","4.8863","0.0008","90","","90","","90","","642.95","0.19","150","","150","","","","","","","","","4","P n a 21","P 2c -2n","33","","2-Chloroethyl ethyl sulfide","","- C4 H9 Cl S -","- C4 H9 Cl S -","- C16 H36 Cl4 S4 -","4","1","YA6195","Zawadski, Alexander; Parsons, Simon","2-Chloroethyl ethyl sulfide: a mustard gas analogue","Acta Crystallographica Section E","2004","60","2","o225","o227","10.1107/S1600536804000753","","","0.71073","MoKα","","0.028","0.024","","0.064","0.062","0.064","","","","","","1.01","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203256","11.283","0.002","15.457","0.003","10.365","0.002","90","","102.56","0.03","90","","1764.4","0.6","81","2","81","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","8-hydroxy-3,4-dimethylisocoumarin","","- C11 H10 O3 -","- C11 H10 O3 -","- C88 H80 O24 -","8","1","AC6080","Twamley, Brendan; Zawadzka, Anna; Paszczynski, Andrzej J.","8-Hydroxy-3,4-dimethylisocoumarin","Acta Crystallographica Section E","2004","60","3","o370","o371","10.1107/S1600536804003034","","","0.71073","MoKα","","0.1078","0.0596","","","0.1116","0.1282","","","","","","1.029","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203257","22.782","0.011","4.884","0.002","23.432","0.011","90","","92.461","0.007","90","","2605","2","298","2","298","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","1,1-[2,6-bis-(hydroxymethyl)-4-methylphenol]-benzaldehydeacetal","1,1-[2,6-bis-(hydroxymethyl)-4-methylphenol]-benzaldehydeacetal","","- C16 H16 O3 -","- C16 H16 O3 -","- C128 H128 O24 -","8","1","AC6081","Yin, Caixia; Huo, Fangjun; Gao, Fei; Yang, Pin","2,6-Bis(hydroxymethyl)-4-methylphenol benzylidene 1,2-acetal","Acta Crystallographica Section E","2004","60","3","o457","o459","10.1107/S160053680400409X","","","0.71073","MoKα","","0.0911","0.0632","","","0.1624","0.1765","","","","","","1.038","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203258","6.681","0.005","12.04","0.005","12.326","0.005","90","","90","","90","","991.5","0.9","293","","293","","","","","","","","","3","P n m a","-P 2ac 2n","62","","2,3,-exo,exo-5,6-tetrabromo-bicyclo[2.2.1]hept-2-ene","","- C7 H6 Br4 -","- C7 H6 Br4 -","- C28 H24 Br16 -","4","0.5","AC6082","Ísmail Çelik; Osman Çakmak; Mehmet Akkurt; Cem Cüneyt Ersanlı; Orhan Büyükgüngör","2,3,-<i>exo,exo</i>-5,6-Tetrabromobicyclo[2.2.1]hept-2-ene","Acta Crystallographica Section E","2004","60","3","o468","o470","10.1107/S1600536804004131","","","0.71073","MoKα","","0.0933","0.0477","","","0.0802","0.0915","","","","","","1.005","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203259","7.218","0.003","9.254","0.003","8.864","0.003","90","","99.377","0.005","90","","584.2","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","cesium lanthanum tetrametaphosphate","","","- Cs La O12 P4 -","- Cs La O12 P4 -","- Cs2 La2 O24 P8 -","2","1","","Sun, Tongqing; Shen, Guangqiu; Wang, Xiaoqing; Wang, Ruji; Wei, Jingzhi; Shen, Dezhong","CsLa(PO~3~)~4~","Acta Crystallographica, Section E","2004","60","3","i28","i30","10.1107/S160053680400131X","","","0.71073","MoKα","","0.0232","0.0216","","","0.0485","0.049","","","","","","1.022","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203260","9.3168","0.0004","9.8985","0.0006","34.083","0.0017","90","","94.236","0.006","90","","3134.6","0.3","180","2","180","2","","","","","","","","4","C 1 c 1","C -2yc","9","","tricaesium dihafnium pentaphosphorus octadecasulfide","","- Cs3 Hf2 P5 S18 -","- Cs3 Hf2 P5 S18 -","- Cs12 Hf8 P20 S72 -","4","1","BR6136","Gutzmann, Andreas; Näther, Christian; Bensch, Wolfgang","Cs~3~Hf~2~(P~2~S~7~)~2~(PS~4~)","Acta Crystallographica Section E","2004","60","3","i42","i44","10.1107/S1600536804002880","","","0.71073","MoKα","","0.0417","0.0407","","","0.1033","0.1037","","","","","","1.147","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203261","6.2987","0.0013","10.5","0.002","39.68","0.008","90","","90","","90","","2624.3","0.9","180","2","180","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C30 H46 O3 -","- C30 H46 O3 -","- C120 H184 O12 -","4","1","BT6394","Alcock, Nathaniel W.; Sanders, Karen J.; Rodger, Alison","Potential injectable contraceptive steroids: testosterone buciclate","Acta Crystallographica Section E","2004","60","3","o348","o349","10.1107/S1600536804000820","","","0.71073","MoKα","","0.1263","0.0731","","","0.1421","0.1624","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203262","10.5029","0.0009","11.046","0.0002","34.5904","0.0009","90","","97.055","0.001","90","","3982.6","0.4","291","1","291","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C21 H34 O4 -","- C21 H34 O4 -","- C168 H272 O32 -","8","2","BT6404","Fresu, Sonia; Schürmann, Markus; Preut, Hans; Eilbracht, Peter","<i>rac</i>-(1<i>R</i>,11<i>R</i>,14<i>S</i>,18<i>R</i>)-Methyl 18-hydroxy-19-oxotricyclo[9.7.1.0^1,14^]nonadecane-11-carboxylate","Acta Crystallographica Section E","2004","60","3","o403","o405","10.1107/S1600536804003368","","","0.71073","MoKα","","0.1799","0.0428","","","0.0612","0.0713","","","","","","0.907","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203263","7.251","0.001","7.4873","0.001","9.7058","0.0013","112.628","0.01","98.786","0.011","103.832","0.011","454.32","0.12","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H16 Cl2 Cu2 N4 -","- C16 H16 Cl2 Cu2 N4 -","- C16 H16 Cl2 Cu2 N4 -","1","0.5","BT6405","Goreshnik, Evgeny; Schollmeyer, Dieter; Mys'kiv, Marian","Bis(2-methylbenzimidazole-κ<i>N</i>^1^)copper(I) dichlorocuprate(I)","Acta Crystallographica Section E","2004","60","3","m279","m281","10.1107/S1600536804002466","","","1.54178","CuKα","","0.0468","0.044","","","0.1217","0.1245","","","","","","1.129","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203264","5.7681","0.0003","9.8914","0.0006","24.4281","0.0016","90","","96.798","0.003","90","","1383.94","0.14","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(Benzoylmethylsulfanyl)-6-methoxy-1H-benzimidazole","","- C16 H14 N2 O2 S -","- C16 H14 N2 O2 S -","- C64 H56 N8 O8 S4 -","4","1","BT6406","Daniel E. Lynch; Ian McClenaghan","2-(Benzoylmethylsulfanyl)-6-methoxy-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2004","60","3","o363","o364","10.1107/S1600536804003137","","","0.71073","MoKα","","0.1041","0.0607","","","0.1154","0.1263","","","","","","1.067","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203265","5.5919","0.0005","9.2507","0.001","7.9146","0.0009","90","","90","","90","","409.41","0.07","150","1","150","1","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C6 H10 O3 S2 -","- C6 H10 O3 S2 -","- C12 H20 O6 S4 -","2","0.5","BT6407","Brewer, A. David; Ferguson, George; Lough, Alan J.; Strunk, Richard J.","2,3-Dihydro-5,6-dimethyl-1,4-dithiine 1,1,4-trioxide","Acta Crystallographica Section E","2004","60","3","o392","o394","10.1107/S1600536804003356","","","0.71073","MoKα","","0.0674","0.0562","","","0.1363","0.1432","","","","","","1.159","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203266","10.7227","0.0013","11.0789","0.0013","10.1268","0.0012","90","","90","","90","","1203","0.2","120","2","120","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","N-(8-Quinolyl)-o-phenylenediamine","","- C15 H13 N3 -","- C15 H13 N3 -","- C60 H52 N12 -","4","1","BT6408","Seshadri, Tarimala; Flörke, Ulrich; Henkel, Gerald","<i>N</i>-(8-Quinolyl)-<i>o</i>-phenylenediamine","Acta Crystallographica Section E","2004","60","3","o399","o400","10.1107/S1600536804003472","","","0.71073","MoKα","","0.0496","0.0427","","","0.1033","0.1073","","","","","","1.105","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203267","9.2842","0.0005","12.2427","0.0007","16.349","0.0009","90","","101.463","0.001","90","","1821.22","0.17","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","N-(8-Quinolyl)-o-(1,1,3,3-tetramethylguanidino)phenylamine","","- C20 H23 N5 -","- C20 H23 N5 -","- C80 H92 N20 -","4","1","BT6409","Seshadri, Tarimala; Flörke, Ulrich; Henkel, Gerald","<i>N</i>-(8-Quinolyl)-<i>o</i>-(1,1,3,3-tetramethylguanidino)phenylamine","Acta Crystallographica Section E","2004","60","3","o401","o402","10.1107/S1600536804003484","","","0.71073","MoKα","","0.0656","0.0485","","","0.1149","0.1236","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203268","8.1791","0.0006","8.1791","","16.42","0.001","90","","90","","90","","1098.46","0.1","294","2","294","2","","","","","","","","5","P -4 n 2","P -4 -2n","118","Cadmium binicotinate","2,2'-Bipyridyl-3,3'-dicarboxylatocadmium(II)","","- C12 H6 Cd N2 O4 -","- C12 H6 Cd N2 O4 -","- C48 H24 Cd4 N8 O16 -","4","0.5","BT6410","Huang, Xiao-Chun; Zhang, Lin-Yun; Chen, Xiao-Ming; Ng^a^, Seik Weng","Cadmium binicotinate","Acta Crystallographica Section E","2004","60","3","m332","m333","10.1107/S1600536804003940","","","0.71073","MoKα","","0.02","0.019","","","0.045","0.045","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203269","7.4072","0.0006","8.6995","0.0007","10.2525","0.0008","87.205","0.001","74.517","0.001","66.277","0.001","581.6","0.08","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Guanidinium 4-hydroxy-3-carboxybenzene sulfonate","","- C8 H11 N3 O6 S -","- C8 H11 N3 O6 S -","- C16 H22 N6 O12 S2 -","2","1","BT6411","Zhang, Xiu-Lian; Chen, Xiao-Ming; Ng^a^, Seik Weng","Guanidinium 4-hydroxy-3-carboxybenzenesulfonate","Acta Crystallographica Section E","2004","60","3","o453","o454","10.1107/S1600536804004052","","","0.71073","MoKα","","0.043","0.038","","","0.108","0.112","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203270","9.8121","0.0009","6.6775","0.0006","15.647","0.001","90","","97.957","0.002","90","","1015.33","0.15","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","4,4'-Bipyridinium 1,5-naphthalenedisulfonate dihydrate","","- C20 H20 N2 O8 S2 -","- C20 H20 N2 O8 S2 -","- C40 H40 N4 O16 S4 -","2","0.5","BT6412","Zhang, Xiu-Lian; Chen, Xiao-Ming; Ng^a^, Seik Weng","4,4'-Bipyridinium 1,5-naphthalenedisulfonate dihydrate","Acta Crystallographica Section E","2004","60","3","o455","o456","10.1107/S1600536804004064","","","0.71073","MoKα","","0.062","0.049","","","0.125","0.134","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203271","6.518","0.002","28.543","0.006","10.194","0.002","90","","106.19","0.03","90","","1821.3","0.8","143","2","143","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","1,3-Di-tert-butyl-6-phenylethynyl-fulvene","","- C22 H26 -","- C22 H26 -","- C88 H104 -","4","1","BT6413","Jones, Peter G.; Berger, Harald; Bubenitschek, Peter; Hopf, Henning","1,3-Di-<i>tert</i>-butyl-6-(phenylethynyl)fulvene","Acta Crystallographica Section E","2004","60","3","o444","o445","10.1107/S1600536804003964","","","0.71073","MoKα","","0.0732","0.0525","","","0.1249","0.1409","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203272","14.0901","0.0014","5.8367","0.0008","23.519","0.002","90","","105.383","0.006","90","","1864.9","0.4","173","2","173","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","10-Phenyl-10-phenylethynyl-9-methylene-fluorene","","- C28 H18 -","- C28 H18 -","- C112 H72 -","4","1","BT6414","Jones, Peter G.; Berger, Harald; Bubenitschek, Peter; Hopf, Henning","10-Phenyl-10-phenylethynyl-9-methylenefluorene","Acta Crystallographica Section E","2004","60","3","o446","o447","10.1107/S1600536804003976","","","0.71073","MoKα","","0.0758","0.037","","","0.069","0.0762","","","","","","0.819","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203273","8.906","0.004","9.865","0.005","13.619","0.007","88.908","0.009","78.705","0.009","66.753","0.009","1075.8","0.9","296","1","296","1","","","","","","","","7","P -1","-P 1","2","","Di-μ-α-pyrrolidinonato-bis[cis-diamminechloroplatinum(III)] sulfate dihydrate","","- C8 H28 Cl2 N6 O8 Pt2 S -","- C8 H24 Cl2 N6 O8 Pt2 S -","- C16 H48 Cl4 N12 O16 Pt4 S2 -","2","1","CF6324","Sakai, Ken; Sakai, Itsuki; Kajiwara, Takashi; Ito, Tasuku","Di-μ-α-pyrrolidinonato-bis[<i>cis</i>-diamminechloroplatinum(III)] sulfate dihydrate: a head-to-head isomer","Acta Crystallographica Section E","2004","60","3","m255","m258","10.1107/S1600536804002065","","","0.71073","MoKα","","0.0841","0.0591","","","0.141","0.1526","","","","","","0.967","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203274","8.6846","0.001","9.7645","0.0011","10.4676","0.0012","63.154","0.002","68.579","0.002","78.644","0.002","736.74","0.15","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","μ-Terephthalato-bis[aquachloro(1,10-phenanthroline)copper(II)]","","- C32 H24 Cl2 Cu2 N4 O6 -","- C32 H24 Cl2 Cu2 N4 O6 -","- C32 H24 Cl2 Cu2 N4 O6 -","1","0.5","CF6325","Hong-Ping Xiao; Xin-Hua Li; Ming-De Ye; Mao-Lin Hu","μ-Terephthalato-bis[aquachloro(1,10-phenanthroline)copper(II)]","Acta Crystallographica Section E","2004","60","3","m253","m254","10.1107/S1600536804002107","","","0.71073","MoKα","","0.0304","0.0286","","","0.0754","0.0763","","","","","","1.088","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203275","6.2908","0.0003","12.4043","0.0006","9.2181","0.0005","90","","106.146","0.002","90","","690.94","0.06","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Hexaaquacopper(II) diperchlorate dihydrate","","- Cl2 Cu H16 O16 -","- Cl2 Cu H16 O16 -","- Cl4 Cu2 H32 O32 -","2","0.5","","Xin-Hua Li; Feng-Yi Xia; Hong-Ping Xiao; Mao-Lin Hu","Hexaaquacopper(II) diperchlorate dihydrate","Acta Crystallographica, Section E","2004","60","3","i31","i32","10.1107/S1600536804002168","","","0.71073","MoKα","","0.0331","0.0325","","","0.1044","0.1048","","","","","","1.171","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203276","8.145","0.005","13.634","0.005","9.082","0.005","90","","101.206","0.005","90","","989.3","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(triethanolamine-κ^3^N,O,O')copper(II) squarate","","- C16 H30 Cu N2 O10 -","- C16 H30 Cu N2 O10 -","- C32 H60 Cu2 N4 O20 -","2","0.5","CI6336","Ucar, Ibrahim; Yesilel, Okan Zafer; Bulut, Ahmet; Icbudak, Hasan; Olmez, Halis; Kazak, Canan","Bis(triethanolamine-κ^3^<i>N,O,O</i>')copper(II) squarate","Acta Crystallographica Section E","2004","60","3","m322","m324","10.1107/S160053680400354X","","","0.71069","MoKα","","0.0472","0.0265","","","0.0482","0.0503","","","","","","0.774","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203277","25.6412","0.0014","4.9773","0.0003","22.3894","0.0016","90","","90","","90","","2857.4","0.3","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","N-(3-chloro-4-methylphenyl)-N'-hydroxy-2-oxo-2-phenylacetamidine","","- C15 H13 Cl N2 O2 -","- C15 H13 Cl N2 O2 -","- C120 H104 Cl8 N16 O16 -","8","2","CI6337","Hökelek, Tuncer; Büyükgüngör, Orhan; Taş, Murat; Batı, Hümeyra","<i>N</i>-(3-Chloro-4-methylphenyl)-<i>N</i>'-hydroxy-2-oxo-2-phenylacetamidine","Acta Crystallographica Section E","2004","60","3","o406","o408","10.1107/S1600536804003459","","","0.71073","MoKα","","0.098","0.0413","","","0.0878","0.0996","","","","","","0.753","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203278","8.229","0.002","11.828","0.003","12.088","0.003","67.403","0.004","86.94","0.004","74.256","0.004","1043.8","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","6-Nitro-2-propyl-1H-indole","","- C11 H12 N2 O2 -","- C11 H12 N2 O2 -","- C44 H48 N8 O8 -","4","2","CI6338","Xianghong Huang; Qian-Feng Zhang; Herman H. Y. Sung","6-Nitro-2-propyl-1<i>H</i>-indole","Acta Crystallographica Section E","2004","60","3","o409","o410","10.1107/S1600536804003393","","","0.71073","MoKα","","0.0904","0.0517","","","0.1297","0.1419","","","","","","0.949","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203279","5.805","0.0012","8.431","0.0017","10.74","0.002","98.88","0.03","105.17","0.03","91.68","0.03","499.9","0.19","150","2","150","2","","","","","","","","4","P -1","-P 1","2","DL-Threoninium maleate","DL-Threoninium maleate","","- C8 H13 N O7 -","- C8 H13 N O7 -","- C16 H26 N2 O14 -","2","1","CI6339","K. Rajagopal; E. Ramachandran; A. Mostad; S. Natarajan","<small>DL</small>-Threoninium maleate at 150K","Acta Crystallographica Section E","2004","60","3","o386","o388","10.1107/S1600536804003277","","","0.71073","MoKα","","0.0346","0.0337","","","0.0919","0.0928","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203280","8.524","0.005","8.64","0.005","9.307","0.005","91.426","0.005","90.25","0.005","116.059","0.005","615.5","0.6","100","","100","","","","","","","","","6","P -1","-P 1","2","","4-(4-Chlorophenyl)-3-(furan-2-yl)-1H-1,2,4-triazole-5(4H)-thione","","- C12 H8 Cl N3 O S -","- C12 H8 Cl N3 O S -","- C24 H16 Cl2 N6 O2 S2 -","2","1","CI6341","Sema Öztürk; Mehmet Akkurt; Ahmet Cansız; Metin Koparır; Mehmet Şekerci; Frank W. Heinemann","4-(4-Chlorophenyl)-3-(furan-2-yl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2004","60","3","o425","o427","10.1107/S1600536804003721","","","0.71069","MoKα","","0.0484","0.0332","","","0.0935","0.0983","","","","","","1.155","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203281","14.4063","0.0005","12.6196","0.0006","13.34","0.0005","90","","111.48","0.003","90","","2256.79","0.16","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","chlorobis(1,10-phenanthroline)copper(II) dichlorocuprate(I)","","- C24 H16 Cl3 Cu2 N4 -","- C24 H16 Cl3 Cu2 N4 -","- C96 H64 Cl12 Cu8 N16 -","4","1","CV6258","Yang, Hong-Fang; Huang, Chang-Cang; Zhang, Han-Hui; Liu, Yongxiu; Lian, Zhao-Xun; Xiao,Guang-Can","A new mixed-valence Cu^II^/Cu^I^ complex: chlorobis(1,10-phenanthroline)copper(II) dichlorocuprate(I)","Acta Crystallographica Section E","2004","60","3","m291","m293","10.1107/S1600536804002375","","","0.71069","MoKα","","0.0492","0.0351","","","0.0995","0.11","","","","","","1.007","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203282","8.1393","0.0016","22.855","0.002","8.653","0.0019","90","","100.633","0.016","90","","1582","0.5","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Aqua(2,2'-diamino-4,4-bi-1,3-thiazole-κ^2^N,N')(oxydiacetato- κ^3^O,O',O'')cobalt(II) monohydrate","","- C10 H14 Co N4 O7 S2 -","- C10 H14 Co N4 O7 S2 -","- C40 H56 Co4 N16 O28 S8 -","4","0.5","CV6265","Yue Luo; Duan-Jun Xu; Zhi-Yong Wu; Jing-Yun Wu; Michael Y. Chiang","Aqua(2,2'-diamino-4,4-bi-1,3-thiazole-κ^2^<i>N,N</i>')(oxydiacetato-κ^3^<i>O,O</i>',<i>O</i>'')cobalt(II) monohydrate","Acta Crystallographica Section E","2004","60","3","m270","m272","10.1107/S1600536804002454","","","0.71073","MoKα","","0.026","0.022","","","0.058","0.06","","","","","","1.063","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203283","11.4599","0.0002","11.4599","0.0002","11.6864","0.0002","90","","90","","90","","1534.77","0.05","150","2","150","2","","","","","","","","5","P 43","P 4cw","78","","(S,Sp)-2-[4-(1-methylethyl)-4,5-dihydrooxazol-1-yl]ferrocenecarboxylic acid","","- C17 H19 Fe N O3 -","- C17 H19 Fe N O3 -","- C68 H76 Fe4 N4 O12 -","4","1","CV6269","Štěpnička, Petr; Císařová, Ivana","(<i>S,S</i>~<i>p~</i>)-2-[4-(1-Methylethyl)-4,5-dihydrooxazol-1-yl]ferrocenecarboxylic acid","Acta Crystallographica Section E","2004","60","3","m288","m290","10.1107/S1600536804002685","","","0.71073","MoKα","","0.0369","0.0339","","","0.0845","0.0874","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203284","19.111","0.003","5.9619","0.0011","18.726","0.002","90","","119.337","0.012","90","","1860","0.5","100","2","100","2","","","","","","","","3","C 1 2 1","C 2y","5","","Methyl 3,4-di-O-pivaloyl-β-D-xylopyranoside","","- C16 H28 O7 -","- C16 H28 O7 -","- C64 H112 O28 -","4","1","CV6270","Prugovečki, Biserka; Matković-Čalogović, Dubravka; Petrović, Vesna; Tomić, Srđanka","Methyl 3,4-di-<i>O</i>-pivaloyl-β-<small>D</small>-xylopyranoside","Acta Crystallographica Section E","2004","60","3","o378","o380","10.1107/S1600536804002995","","","0.71073","MoKα","","0.0479","0.0427","","","0.1039","0.108","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203285","7.502","0.0004","14.6261","0.0007","12.4567","0.0006","90","","96.295","0.002","90","","1358.57","0.12","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","m-Terephthalato-bis[chloro(1,10-phenanthroline)cobalt(II)]","","- C32 H20 Cl2 Co2 N4 O4 -","- C32 H20 Cl2 Co2 N4 O4 -","- C64 H40 Cl4 Co4 N8 O8 -","2","0.5","CV6273","Hong-Ping Xiao; Mao-Lin Hu; Xin-Hua Li","μ-Terephthalato-bis[chloro(1,10-phenanthroline)cobalt(II)]","Acta Crystallographica Section E","2004","60","3","m336","m337","10.1107/S1600536804003824","","","0.71073","MoKα","","0.0901","0.0887","","","0.1666","0.1673","","","","","","1.374","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203286","8.2631","0.0007","9.71","0.001","10.957","0.001","75.81","0.005","69.703","0.007","77.549","0.007","791.1","0.13","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H34 Cl2 N8 Ni O4 -","- C28 H34 Cl2 N6 Ni O4 -","- C28 H34 Cl2 N6 Ni O4 -","1","0.5","DN6108","Sbai, S.; Regragui, R.; Essassi, E., M.; Kenz, A.; Pierrot, M.","(<i>N</i>-2-Aminophényl-5-méthylpyrazolylacétamide)nickel(II) dimethanole dichlorure","Acta Crystallographica Section E","2004","60","3","m250","m252","10.1107/S1600536803027740","","","0.71073","MoKα","","0.0543","0.0463","","","0.1181","0.1238","","","","","","1.148","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203287","10.209","0.001","11.617","0.001","11.916","0.001","87.633","0.002","75.94","0.002","88.501","0.002","1369.5","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","[1,8-Bis(2-benzyl)-1,3,6,8,10,13-hexaazacyclotetradecane]nickel(II) diperchlorate","","- C22 H34 Cl2 N6 Ni O8 -","- C22 H34 Cl2 N6 Ni O8 -","- C44 H68 Cl4 N12 Ni2 O16 -","2","1","DN6117","Li, Yan-Wu; Xiang, Hua; Lu, Tong-Bu; Ng, Seik Weng","[1,8-Bis(2-benzyl)-1,3,6,8,10,13-hexaazacyclotetradecane]nickel(II) diperchlorate","Acta Crystallographica Section E","2004","60","3","m309","m311","10.1107/S160053680400248X","","","0.71073","MoKα","","0.044","0.0357","","","0.1","0.1046","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203288","8.1634","0.0006","12.411","0.001","12.518","0.001","77.094","0.001","83.348","0.001","71.882","0.001","1173.47","0.16","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","[1,8-Di-2-n-propyl-1,3,6,8,10,13-hexaazacyclotetradecane]nickel(II) diperchlorate","","- C14 H34 Cl2 N6 Ni O8 -","- C14 H34 Cl2 N6 Ni O8 -","- C28 H68 Cl4 N12 Ni2 O16 -","2","1","DN6118","Li, Yan-Wu; Xiang, Hua; Lu, Tong-Bu; Ng, Seik Weng","(1,8-Di-<i>n</i>-propyl-1,3,6,8,10,13-hexaazacyclotetradecane)nickel(II) diperchlorate","Acta Crystallographica Section E","2004","60","3","m312","m313","10.1107/S1600536804002491","","","0.71073","MoKα","","0.0532","0.0438","","","0.1238","0.1305","","","","","","1.083","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203289","11.427","0.002","8.329","0.001","15.622","0.002","90","","105.48","0.003","90","","1432.9","0.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[1,8-Bis(2-phenylethyl)-1,3,6,8,10,13-hexaazacyclotetradecane]nickel(II) ditetrafluoroborate","","- C24 H38 B2 F8 N6 Ni -","- C24 H38 B2 F8 N6 Ni -","- C48 H76 B4 F16 N12 Ni2 -","2","0.5","DN6119","Li, Yan-Wu; Xiang, Hua; Lu, Tong-Bu; Ng, Seik Weng","[1,8-Bis(2-phenylethyl)-1,3,6,8,10,13-hexaazacyclotetradecane]nickel(II) bis(tetrafluoroborate)","Acta Crystallographica Section E","2004","60","3","m314","m316","10.1107/S1600536804002508","","","0.71073","MoKα","","0.0652","0.0368","","","0.0821","0.0909","","","","","","0.941","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203290","7.5818","0.0005","8.3976","0.0005","9.7596","0.0006","105.506","0.001","97.283","0.001","105.853","0.001","562.45","0.06","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[(3,10-diethyl-1,3,5,8,10,12-hexaazacyclotetradecane)nickel(II)]- μ-terephthalato]","","- C20 H34 N6 Ni O4 -","- C20 H34 N6 Ni O4 -","- C20 H34 N6 Ni O4 -","1","0.5","DN6120","Li, Yan-Wu; Xiang, Hua; Lu, Tong-Bu; Ng, Seik Weng","<i>catena</i>-Poly[[(3,10-diethyl-1,3,5,8,10,12-hexaazacyclotetradecane)nickel(II)]-μ-terephthalato]","Acta Crystallographica Section E","2004","60","3","m317","m318","10.1107/S160053680400251X","","","0.71073","MoKα","","0.0314","0.0304","","","0.0804","0.081","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203291","22.041","0.005","10.82","0.005","8.924","0.005","90","","91.55","0.005","90","","2127.4","1.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(2-Hydroxyphenyliminomethylene)phenol","","- C13 H11 N O2 -","- C13 H11 N O2 -","- C104 H88 N8 O16 -","8","2","DN6122","Ersanlı, Cem Cüneyt; Albayrak, Çiǧdem; Odabaşoǧlu, Mustafa; Erdönmez, Ahmet","4-(2-Hydroxyphenyliminomethylene)phenol","Acta Crystallographica Section E","2004","60","3","o389","o391","10.1107/S1600536804003319","","","0.71069","MoKα","","0.1109","0.0426","","","0.0747","0.087","","","","","","0.726","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203292","7.8637","0.0004","29.1592","0.0009","31.2637","0.0009","90","","90","","90","","7168.7","0.5","150","","150","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(1S,2S)-[1,1'-Bis(4-methoxyphenyl)-3,3'-(1,2-cyclohexanediyldinitrilo)diprop- 1-enethiolato-κ^4^S,N,N',S']nickel(II)","","- C26 H28 N2 Ni O2 S2 -","- C26 H28 N2 Ni O2 S2 -","- C312 H336 N24 Ni12 O24 S24 -","12","3","DN6125","Evain, Michel; Deniaud, David; Meslin, Jean Claude","(1<i>S</i>,2<i>S</i>)-[1,1'-Bis(4-methoxyphenyl)-3,3'-(1,2-cyclohexanediyldinitrilo)diprop-1-enethiolato-κ^4^<i>S,N,N</i>',<i>S</i>']nickel(II)","Acta Crystallographica Section E","2004","60","3","m325","m327","10.1107/S1600536804003551","","","0.71069","MoKα","","0.0875","0.0682","","","0.1644","0.1689","","","","","","2.24","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2203293","13.105","0.003","14.054","0.003","14.344","0.003","90","","90","","90","","2641.8","1","293","2","293","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","bis[(3-Amino-5-methyl-isoxazole)-N-]zinc(II)dichloride","","- C8 H12 Cl2 N4 O2 Zn -","- C8 H12 Cl2 N4 O2 Zn -","- C64 H96 Cl16 N32 O16 Zn8 -","8","1","DN6126","Liang Shen; Mei Chao Li; Zhi Min Jin; Mao Lin Hu; Ri Cheng Xuan","Bis(3-amino-5-methylisoxazole-κ<i>N</i>)dichlorozinc(II)","Acta Crystallographica Section E","2004","60","3","m330","m331","10.1107/S1600536804003939","","","0.71073","MoKα","","0.0834","0.0568","","","0.1503","0.1548","","","","","","1.24","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203294","7.494","0.004","8.05","0.005","12.097","0.007","82.402","0.013","79.337","0.012","67.609","0.012","661.6","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-[(1,3-Benzodioxol-5-yl)methylene]-6,7-dihydro-5H-thiazolo[3,2-a]pyrimidin- 3-one","","- C14 H12 N2 O3 S -","- C14 H12 N2 O3 S -","- C28 H24 N4 O6 S2 -","2","1","FL6079","Liang, Zu-Pei","2-[(1,3-Benzodioxol-5-yl)methylene]-6,7-dihydro-5<i>H</i>-thiazolo[3,2-<i>a</i>]pyrimidin-3-one","Acta Crystallographica Section E","2004","60","3","o339","o340","10.1107/S1600536804001357","","","0.71073","MoKα","","0.0582","0.0391","","","","0.1143","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203295","8.1493","0.0004","11.5615","0.0005","13.2055","0.0006","90","","90.662","0.001","90","","1244.11","0.1","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(4,5-difluoren-9-one)diaquazinc(II) diperchlorate","","- C22 H16 Cl2 N4 O12 Zn -","- C22 H16 Cl2 N4 O12 Zn -","- C44 H32 Cl4 N8 O24 Zn2 -","2","0.5","FL6081","Zhang, Rong-Lan; Zhao, Jian-She; Yang, Shi-Yao; Ng, Seik Weng","Diaquabis(4,5-diazafluoren-9-one-κ^2^<i>N,N</i>')zinc(II) diperchlorate","Acta Crystallographica Section E","2004","60","3","m262","m263","10.1107/S1600536804001886","","","0.71073","MoKα","","0.079","0.068","","","0.175","0.185","","","","","","1.1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203296","7.4661","0.0003","25.951","0.001","8.2342","0.0003","90","","92.604","0.001","90","","1593.75","0.11","298","2","298","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Tetra-μ-acetato-bis[aquacopper(II)]‒4,5-diazafluoren-9-one (1/2)","","- C30 H28 Cu2 N4 O12 -","- C30 H28 Cu2 N4 O12 -","- C60 H56 Cu4 N8 O24 -","2","0.5","FL6082","Zhao, Jian-She; Zhang, Rong-Lan; Yang, Shi-Yao; Ng, Seik Weng","Tetra-μ-acetato-bis[aquacopper(II)]‒4,5-diazafluoren-9-one (1/2)","Acta Crystallographica Section E","2004","60","3","m264","m266","10.1107/S1600536804001898","","","0.71073","MoKα","","0.065","0.05","","","0.108","0.114","","","","","","1.12","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203297","14.0496","0.0006","16.2459","0.0006","11.8597","0.0005","90","","106.976","0.002","90","","2589.01","0.18","90","0.2","90","0.2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis{(E)-6-methoxy-2-[(4-methylphenyl)iminomethyl]phenolato}cobalt(II)","","- C30 H28 Co N2 O4 -","- C30 H28 Co N2 O4 -","- C120 H112 Co4 N8 O16 -","4","0.5","FL6083","Peter A. Iyere; William Y. Boadi; Lewis Ross","Bis{(<i>E</i>)-6-methoxy-2-[(4-methylphenyl)iminomethyl]phenolato}cobalt(II)","Acta Crystallographica Section E","2004","60","3","m304","m306","10.1107/S1600536804002764","","","0.71073","MoKα","","0.0541","0.0376","","","0.0716","0.076","","","","","","1.108","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203298","8.974","0.003","9.126","0.003","16.463","0.006","84.194","0.006","87.085","0.006","62.97","0.005","1194.8","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Ethyl 5-(2,6-dichlorophenyl)-7-methyl-2-(1-naphthylmethylene)-3-oxo-2,3-dihydro- 5H-thiazolo[3,2-a]pyrimidine-6-carboxylate","","- C27 H20 Cl2 N2 O3 S -","- C27 H20 Cl2 N2 O3 S -","- C54 H40 Cl4 N4 O6 S2 -","2","1","FL6085","Liu, Xin-Gang; Feng, Ya-Qing; Li, Xiao-Fang; Gao, Bo","Ethyl 5-(2,6-dichlorophenyl)-7-methyl-2-(1-naphthylmethylene)-3-oxo-2,3-dihydro-5<i>H</i>-thiazolo[3,2-<i>a</i>]pyrimidine-6-carboxylate","Acta Crystallographica Section E","2004","60","3","o464","o465","10.1107/S1600536804004143","","","0.71073","MoKα","","0.0745","0.0404","","","","0.1261","","","","","","1.059","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2203299","6.216","0.001","10.011","0.002","16.911","0.003","97.952","0.003","93.786","0.003","96.541","0.003","1031.9","0.3","183","2","183","2","","","","","","","","4","P -1","-P 1","2","","4-tert-Butyl-2-(4-pyridyl)-N,N'-bis(trimethylsilyl)propane-1,3-diimine","","- C18 H33 N3 Si2 -","- C18 H33 N3 Si2 -","- C36 H66 N6 Si4 -","2","1","FL6086","Xia Chen; Li Wang; Shu-Ping Huang; Dian-Sheng Liu","4-<i>tert</i>-Butyl-2-(4-pyridyl)-<i>N</i>,<i>N</i>'-bis(trimethylsilyl)propane-1,3-diimine","Acta Crystallographica Section E","2004","60","3","o473","o475","10.1107/S1600536804004222","","","0.71073","MoKα","","0.0533","0.0474","","","0.1165","0.1206","","","","","","1.062","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203300","8.0566","0.0005","8.7694","0.0007","10.4093","0.0007","68.54","0.007","81.355","0.005","63.933","0.007","614.78","0.09","293","","293","2","","","","","","","","5","P -1","-P 1","2","","Aqua(malonato-κ^2^O,O')(pyridine-2-carboxamide-κ^2^N^1^,O)copper(II) monohydrate","","- C9 H12 Cu N2 O7 -","- C9 H12 Cu N2 O7 -","- C18 H24 Cu2 N4 O14 -","2","1","HB6017","Sieroń, Lesław","Aqua(malonato-κ^2^<i>O,O</i>')(pyridine-2-carboxamide-κ^2^<i>N</i>^1^,<i>O</i>)copper(II) monohydrate","Acta Crystallographica Section E","2004","60","3","m297","m299","10.1107/S1600536804002727","","","0.71073","MoKα","","0.0425","0.0291","","","0.0637","0.0672","","","","","","0.917","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203301","6.443","0.001","13.032","0.003","9.987","0.002","90","","106.85","0.02","90","","802.6","0.3","293","","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","trans-Bis(2-amino-1,3-benzothiazole-κN^3^)dichlorocopper(II)","","- C14 H12 Cl2 Cu N4 S2 -","- C14 H12 Cl2 Cu N4 S2 -","- C28 H24 Cl4 Cu2 N8 S4 -","2","1","HB6018","Maniukiewicz, Waldemar","<i>trans</i>-Bis(2-amino-1,3-benzothiazole-κ<i>N</i>^3^)dichlorocopper(II)","Acta Crystallographica Section E","2004","60","3","m340","m341","10.1107/S1600536804003885","","","0.71073","MoKα","","0.0501","0.0375","","","0.0819","0.0872","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203302","10.5662","0.0013","11.8911","0.0015","25.158","0.003","90","","100.039","0.002","90","","3112.5","0.7","150","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H41 Br3 N6 Ni2 O5 -","- C21 H41 Br3 N6 Ni2 O5 -","- C84 H164 Br12 N24 Ni8 O20 -","4","1","HB6019","Adams, Harry; Clunas, Scott; Fenton, David E.","A dinuclear nickel(II) complex of the ligand 2,6-bis[2-(dimethylamino)ethyliminomethyl]-4-methylphenol","Acta Crystallographica Section E","2004","60","3","m338","m339","10.1107/S1600536804004118","","","0.71073","MoKα","","","0.0407","","","","0.0875","","","","","","0.87","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203303","9.4373","0.0001","9.9388","0.0001","10.1736","0.0002","117.127","0.0006","101.332","0.0007","101.069","0.001","788.17","0.02","123","2","","","","","","","","","","5","P -1","-P 1","2","","","","- Fe4 H6 N8 O8 S3 -","- Fe4 H6 N8 O8 S3 -","- Fe8 H12 N16 O16 S6 -","2","1","HG6018","Fallon, Gary D.; Martin, Lisandra L.; Wu, Bei","Ammonium heptanitrosyltrithiotetraferrate monohydrate","Acta Crystallographica Section E","2004","60","3","i37","i39","10.1107/S1600536804002338","","","0.71073","MoKα","","","0.033","","","","0.0876","","","","","","1.129","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203304","9.039","0.002","8.175","0.002","20.304","0.002","90","","90","","90","","1500.3","0.5","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H16 O3 -","- C20 H16 O3 -","- C80 H64 O12 -","4","1","HG6020","Wentrup, Curt; Buchanan, Jeff; Karl A. Byriel; Colin H. L. Kennard","2-Benzyl-1-hydroxy-5,6-dihydro-3<i>H</i>-naphtho[2,1-<i>b</i>]pyran-3-one","Acta Crystallographica Section E","2004","60","3","o471","o472","10.1107/S1600536804003848","","","0.71073","Mokα","","0.0526","0.0306","","","0.0805","0.0938","","","","","","0.934","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203305","11.6048","0.0013","13.8916","0.0015","14.3273","0.0016","62.43","0.002","89.898","0.002","66.14","0.002","1822.8","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Aqua[tris(1H-benzimidazol-2-ylmethyl)amine]copper(II) diperchlorate 4-picoline N-oxide monohydrate","Aqua[tris(1H-benzimidazol-2-ylmethyl)amine]copper(II) diperchlorate 4-picoline N-oxide monohydrate","","- C30 H32 Cl2 Cu N8 O11 -","- C30 H32 Cl2 Cu N8 O11 -","- C60 H64 Cl4 Cu2 N16 O22 -","2","1","LH6157","Huilu Wu; Yizhi Li; Yici Gao","Aqua[tris(1<i>H</i>-benzimidazol-2-ylmethyl)amine]copper(II) diperchlorate 4-picoline <i>N</i>-oxide monohydrate","Acta Crystallographica Section E","2004","60","3","m277","m278","10.1107/S1600536804002053","","","0.71073","MoKα","","0.0628","0.0541","","","0.1686","0.1706","","","","","","1.072","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203306","3.958","0.0007","5.9476","0.0016","10.107","0.002","102.828","0.019","92.1","0.017","91.27","0.02","231.72","0.09","298","2","","","","","","","","","","3","P -1","-P 1","2","","","","- C10 H10 N4 -","- C10 H10 N4 -","- C10 H10 N4 -","1","0.5","LH6158","Chad Eller; Bradley W. Smucker; Robert Kirgan; David M. Eichhorn; D. Paul Rillema","5,5'-Dimethyl-2,2'-bipyrazine","Acta Crystallographica Section E","2004","60","3","o433","o434","10.1107/S1600536804000881","","","0.71073","MoKα","","","0.0477","","","","0.1357","","","","","","0.959","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203307","6.2858","0.001","12.2693","0.0017","14.258","0.002","96.528","0.012","91.642","0.013","93.932","0.012","1089.2","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H14 O2 Si -","- C10 H14 O2 Si -","- C40 H56 O8 Si4 -","4","2","LH6162","Haberecht, Monika Christine; Vitze, Hannes; Lerner, Hans-Wolfram; Bolte, Michael","4-(Trimethylsilyl)benzoic acid","Acta Crystallographica Section E","2004","60","3","o329","o330","10.1107/S1600536804002041","","","0.71073","MoKα","","0.0759","0.0335","","","0.0575","0.0626","","","","","","0.899","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203308","5.6755","0.0001","25.5102","0.0005","26.5536","0.0005","90","","90","","90","","3844.51","0.12","120","2","120","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","5-(4-Bromophenyl)-3-phenyl-1-(3-phenylpropyl)-1H-pyrazole","","- C24 H21 Br N2 -","- C24 H21 Br N2 -","- C192 H168 Br8 N16 -","8","1","LH6163","Low, John N.; Cobo, Justo; Arroyabe, Frank; Torres, Harlen; Abonia, Rodrigo; Glidewell, Christopher","5-(4-Bromophenyl)-3-phenyl-1-(3-phenylpropyl)-1<i>H</i>-pyrazole","Acta Crystallographica Section E","2004","60","3","o324","o326","10.1107/S1600536804001874","","","0.71073","MoKα","","0.0531","0.0326","","","0.0717","0.0783","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203309","6.859","0.002","10.229","0.002","12.896","0.002","99.569","0.01","93.538","0.01","95.146","0.01","885.9","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Di-μ-α-pyrrolidinonato-bis[cis-diammineplatinum(II)] sulfate hydrate","","- C8 H26 N6 O7 Pt2 S -","- C8 H24 N6 O7 Pt2 S -","- C16 H48 N12 O14 Pt4 S2 -","2","1","LH6164","Sakai, Ken; Sakai, Itsuki; Draper, Neil D.; Leznoff, Daniel B.","Di-μ-α-pyrrolidinonato-bis[<i>cis</i>-diammineplatinum(II)] sulfate monohydrate as a head-to-head isomer","Acta Crystallographica Section E","2004","60","3","m273","m276","10.1107/S1600536804002442","","","1.5418","CuKα","","0.0827","0.0537","","","0.117","0.1265","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203310","8.78","0.011","14.461","0.018","11.495","0.015","90","","94.121","0.018","90","","1456","3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","'Dichloro(N,N'-bis(furaldehyde)ethylenediamine)zinc(II)","","- C12 H12 Cl2 N2 O2 Zn -","- C12 H12 Cl2 N2 O2 Zn -","- C48 H48 Cl8 N8 O8 Zn4 -","4","1","LH6167","Wang, Wei; Li, Jun; Du, GuiXiang; Zhang, Fengxing","[<i>N,N</i>'-Bis(2-furylmethylene)ethylenediamine]dichlorozinc(II)","Acta Crystallographica Section E","2004","60","3","m334","m335","10.1107/S1600536804003915","","","0.71073","MoKα","","0.0471","0.0317","","","0.0794","0.0857","","","","","","0.98","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203311","13.4235","0.0013","12.9358","0.001","8.2935","0.0006","90","","90","","90","","1440.1","0.2","150","2","150","2","","","","","","","","5","C m c 21","C 2c -2","36","","2-Bromo-1,3-dipyrrolidin-1-ylpropane-1,3-dionate bromide","","- C11 H18 Br2 N2 O2 -","- C11 H18 Br2 N2 O2 -","- C44 H72 Br8 N8 O8 -","4","0.5","LH6168","Jonathan D. Crane; Richard P. Bunce","2-Bromo-1,3-dipyrrolidin-1-ylpropane-1,3-dionate bromide","Acta Crystallographica Section E","2004","60","3","o414","o415","10.1107/S1600536804003563","","","0.71073","MoKα","","0.0613","0.051","","","0.1209","0.1312","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203312","9.2929","0.0009","10.8379","0.0011","18.7453","0.0019","85.696","0.008","84.306","0.008","83.175","0.008","1861.5","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","[(Z)-3-Dimethylamino-2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)- allylidene]dimethylammonium hexafluorophosphate","","- C15 H18 F6 N3 O2 P -","- C15 H18 F6 N3 O2 P -","- C60 H72 F24 N12 O8 P4 -","4","2","LH6170","Jonathan D Crane; Steven M Daniels","[(<i>Z</i>)-3-Dimethylamino-2-(1,3-dioxo-2,3-dihydro-1<i>H</i>-isoindol-2-yl)allylidene]dimethylammonium hexafluorophosphate","Acta Crystallographica Section E","2004","60","3","o395","o396","10.1107/S1600536804003447","","","0.71073","MoKα","","0.0881","0.0451","","","0.1085","0.1183","","","","","","0.81","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203313","14.3555","0.0004","4.4969","0.0001","31.4473","0.001","90","","90","","90","","2030.09","0.1","120","2","120","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","2-Phenylbenzaldehydeoxime","","- C13 H11 N O -","- C13 H11 N O -","- C104 H88 N8 O8 -","8","2","LH6171","Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Wardell, James L.","(<i>E</i>)-2-Phenylbenzaldehyde oxime forms hydrogen-bonded <i>C</i>~2~^2^(6) chains","Acta Crystallographica Section E","2004","60","3","o422","o424","10.1107/S1600536804003575","","","0.71073","MoKα","","0.0711","0.0452","","","0.0991","0.111","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203314","7.795","0.002","9.734","0.003","17.164","0.005","95.982","0.006","102.332","0.006","110.48","0.005","1168.9","0.6","293","2","","","","","","","","","","4","P -1","-P 1","2","","(2-Pyridinio-2'-pyridyl)amine nitrate hydrate","","- C10 H12 N4 O4 -","- C10 H12 N4 O4 -","- C40 H48 N16 O16 -","4","2","LH6172","Miao Du; Xiao-Jun Zhao","2-(2-Pyridylamino)pyridinium nitrate monohydrate: two-dimensional supramolecular aggregation through hydrogen-bonding and π‒π stacking interactions","Acta Crystallographica Section E","2004","60","3","o439","o441","10.1107/S1600536804004015","","","0.71073","MoKα","","0.122","0.0677","","","0.1573","0.1822","","","","","","1.102","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2203315","6.572","0.003","6.199","0.003","9.463","0.003","90","","104.54","0.03","90","","373.2","0.3","298","2","298","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","1,4-Diacetyl-1,2,4-triazolin-5-one","","- C6 H7 N3 O3 -","- C6 H7 N3 O3 -","- C12 H14 N6 O6 -","2","0.5","LH6173","Crockett, Rowena; Forrester, Alexander R.; Howie, R. Alan","1,4-Diacetyl-1,2,4-triazolin-5-one","Acta Crystallographica Section E","2004","60","3","o460","o461","10.1107/S1600536804004027","","","0.71073","MoKα","","0.0526","0.0402","","","0.1033","0.1093","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203316","4.6375","0.0006","11.4064","0.0019","7.1965","0.0011","90","","90","","90","","380.67","0.1","170","2","170","2","","","","","","","","4","P b c m","-P 2c 2b","57","mercuric hydroxide chlorate","mercury(II) hydroxide chlorate(V)","","- Cl H Hg O4 -","- Cl H Hg O4 -","- Cl4 H4 Hg4 O16 -","4","0.5","","Göbbels, Dirk; Wickleder, Mathias S.","Redetermination of mercury(II) hydroxide chlorate(V)","Acta Crystallographica, Section E","2004","60","3","i40","i41","10.1107/S1600536804002648","","","0.71073","MoKα","","0.0269","0.0195","","","0.0406","0.0427","","","","","","0.967","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2203317","10.377","0.003","17.876","0.005","7.226","0.002","90","","106.235","0.004","90","","1287","0.6","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H10 N4 -","- C16 H10 N4 -","- C64 H40 N16 -","4","1","NA6276","Yin-Xiang Lu; Peng Guo; Yong-zhi Cai; Wei Xu; Lin-Hong Weng; Yong-Ming Huang","(1-Phenyl-2,3-dihydro-1<i>H</i>-benzimidazol-2-ylidene)malonodinitrile","Acta Crystallographica Section E","2004","60","3","o431","o432","10.1107/S1600536804003460","","","0.71073","MoKα","","0.0948","0.0586","","","0.1177","0.1298","","","","","","1.125","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203318","28.912","0.017","28.912","0.017","19.784","0.017","90","","90","","120","","14322","17","293","2","293","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","Bis(ferrocenyl methyl ketone thiosemicarbazone-κ^2^N,S)zinc tetrahydrofuran hemisolvate","","- C28 H32 Fe2 N6 O0.5 S2 Zn -","- C28 H32 Fe2 N6 O0.5 S2 Zn -","- C504 H576 Fe36 N108 O9 S36 Zn18 -","18","0.5","NA6282","Li, Xun; Cui, Xue-Gui; Liu, Xin-Gang; Li, Xiao-Fang","Bis(ferrocenyl methyl ketone thiosemicarbazone-κ^2^<i>N</i>,<i>S</i>)zinc tetrahydrofuran hemisolvate","Acta Crystallographica Section E","2004","60","3","m307","m308","10.1107/S1600536804000923","","","0.71073","MoKα","","0.1282","0.0572","","","","0.1937","","","","","","0.957","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203319","8.627","0.005","13.115","0.004","10.299","0.002","90","","90.38","0.02","90","","1165.2","0.8","293","","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Chloro(1-methoxymethyl-π-allyl)(pyridine-κN)palladium","","- C10 H14 Cl N O Pd -","- C10 H14 Cl N O Pd -","- C40 H56 Cl4 N4 O4 Pd4 -","4","1","NA6284","Cheshkov, Dmitry A.; Belyaev, Boris A.; Belov, Andrey P.; Rybakov, Victor B.","Chloro(1-methoxymethyl-π-allyl)(pyridine-κ<i>N</i>)palladium(II)","Acta Crystallographica Section E","2004","60","3","m300","m301","10.1107/S1600536804001631","","","0.71073","MoKα","","0.0599","0.0413","","","0.0959","0.1051","","","","","","1.058","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203320","8.04","0.0008","7.8514","0.0007","18.1877","0.0016","90","","101.133","0.002","90","","1126.5","0.18","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H13 Cl -","- C14 H13 Cl -","- C56 H52 Cl4 -","4","1","NA6290","Ufuk Çoruh; Tuncer Hökelek; Vázquez-López, Ezequiel M.; Abdullah Menzek; Cavit Kazaz; M. Emin Şengül","<i>exo</i>-(1<i>RS</i>,8<i>SR</i>,9<i>RS</i>,11<i>SR</i>)-10-Chloromethyltetracyclo[6.3.2.0^2,7^0^9,11^]undecane-2,4,6,12-tetraene","Acta Crystallographica Section E","2004","60","3","o350","o352","10.1107/S1600536804001904","","","0.71073","MoKα","","0.0927","0.0418","","","0.0866","0.0975","","","","","","0.848","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203321","13.23","0.01","9.191","0.007","18.3","0.02","90","","110.63","0.08","90","","2083","3","293","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","(+)-1-[(2S)-2-(2,4-Dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]- 1H-imidazole mononitrate","","- C18 H15 Cl4 N3 O4 -","- C18 H15 Cl4 N3 O4 -","- C72 H60 Cl16 N12 O16 -","4","2","NA6291","Oswald M. Peeters; Norbert M. Blaton; Christine Aeschlimann; Joseph Gal","(+)-1-{(2<i>S</i>)-2-(2,4-Dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl}-1<i>H</i>-imidazole mononitrate [(+)-(<i>S</i>)-miconazole nitrate]","Acta Crystallographica Section E","2004","60","3","o365","o366","10.1107/S1600536804003058","","","0.71073","MoKα","","0.0759","0.0422","","0.1011","","0.1011","","","1.032","","","1.032","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203322","10.374","0.0005","10.8633","0.0007","13.2251","0.0004","67.725","0.003","79.262","0.004","65.743","0.004","1256.6","0.12","293","","","","","","","","","","","5","P 1","P 1","1","","(+)-cis-1-Acetyl-4-[4-[[(2R,4S)-2-(2,4-dichloro-phenyl) -2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazine,","","- C26 H28 Cl2 N4 O4 -","- C26 H28 Cl2 N4 O4 -","- C52 H56 Cl4 N8 O8 -","2","2","NA6292","Oswald M. Peeters; Norbert M. Blaton; John G. Gerber; Joseph Gal","(+)-<i>cis</i>-1-Acetyl-4-(4-{[(2<i>R</i>,4<i>S</i>)-2-(2,4-dichlorophenyl)-2-(1<i>H</i>-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)piperazine [(2<i>R</i>,4<i>S</i>)-(+)-ketoconazole]","Acta Crystallographica Section E","2004","60","3","o367","o369","10.1107/S1600536804003046","","","1.54178","CuKα","","0.0394","0.0385","","0.1083","","0.1083","","","1.05","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203323","6.1137","0.0002","11.2202","0.0003","15.9632","0.0006","90","","91.0483","0.0018","90","","1094.84","0.06","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-Hydroxy-6-methyl-2-(sulfonatoethylsulfanyl)pyrimidin-1-ium monohydrate","","- C7 H12 N2 O5 S2 -","- C7 H12 N2 O5 S2 -","- C28 H48 N8 O20 S8 -","4","1","NA6293","Daniel E. Lynch; Ian McClenaghan","4-Hydroxy-6-methyl-2-(sulfonatoethylsulfanyl)pyrimidin-1-ium monohydrate","Acta Crystallographica Section E","2004","60","3","o376","o377","10.1107/S1600536804003204","","","0.71073","MoKα","","0.0423","0.0321","","","0.0771","0.0819","","","","","","1.073","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203324","9.4076","0.0012","6.8574","0.0009","16.242","0.002","90","","90","","90","","1047.8","0.2","298","2","298","2","","","","","","","","5","P n m a","-P 2ac 2n","62","Dimethyl 4-bromo-1-methyl-3,5-pyrazoledicarboxylate","Dimethyl 4-bromo-1-methyl-3,5-pyrazoledicarboxylate","","- C8 H9 Br N2 O4 -","- C8 H9 Br N2 O4 -","- C32 H36 Br4 N8 O16 -","4","0.5","NA6296","Huo, Fangjun; Guo, Wei; Yin, Caixia; Yang, Pin; Xia, Chizhong","Dimethyl 4-bromo-1-methyl-3,5-pyrazoledicarboxylate","Acta Crystallographica Section E","2004","60","3","o416","o418","10.1107/S1600536804003629","","","0.71073","MoKα","","0.0406","0.0308","","","0.0782","0.0828","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203325","14.3699","0.0014","7.5806","0.0004","13.1208","0.0014","90","","114.879","0.007","90","","1296.6","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,3-Dihydro-4-phenyl-1,4-benzoxazine-6,7-dicarbonitrile","","- C16 H11 N3 O -","- C16 H11 N3 O -","- C64 H44 N12 O4 -","4","1","NA6297","Karadayı, Nevzat; Akyüz, Emine; Kahveci, Bahittin; Ağar, Erbil; S̨aşmaz, Selami; Büyükgüngör, Orhan","2,3-Dihydro-4-phenyl-1,4-benzoxazine-6,7-dicarbonitrile","Acta Crystallographica Section E","2004","60","3","o450","o452","10.1107/S1600536804003861","","","0.71073","MoKα","","0.0669","0.0381","","","0.0893","0.0978","","","","","","0.906","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203326","7.0566","0.0005","8.3022","0.0006","14.8495","0.001","104.593","0.002","93.149","0.001","112.148","0.001","768.79","0.09","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Diaquabis[2,5-bis(4-pyridyl)-1,3,4-thiadiazole]dithiocyanatocobalt(II) dihydrate","","- C26 H24 Co N10 O4 S4 -","- C26 H24 Co N10 O4 S4 -","- C26 H24 Co N10 O4 S4 -","1","0.5","NG6011","Miao Du; Xiao-Jun Zhao","Diaquabis[2,5-bis(4-pyridyl)-1,3,4-thiadiazole]dithiocyanatocobalt(II) dihydrate","Acta Crystallographica Section E","2004","60","3","m267","m269","10.1107/S1600536804002247","","","0.71073","MoKα","","0.0554","0.04","","","0.0944","0.1024","","","","","","1.012","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203327","20.961","0.001","9.7061","0.0005","20.894","0.001","90","","139.336","0.001","90","","2770","0.2","298","1","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(Benzhydrylsulfinyl)acetamide","","- C15 H15 N O2 S -","- C15 H15 N O2 S -","- C120 H120 N8 O16 S8 -","8","2","OB6340","Wen Pei; Li Sun; Yueshui Shao; Dongwei Li","2-(Benzhydrylsulfinyl)acetamide","Acta Crystallographica Section E","2004","60","3","o372","o373","10.1107/S1600536804001382","","","0.7107","MoKα","","","0.042","","","","0.115","","","","","","1.001","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203328","8.6363","0.0003","9.6144","0.0003","12.0887","0.0004","107.319","0.001","104.509","0.001","104.854","0.0009","866.18","0.05","297.1","","","","","","","","","","","4","P -1","-P 1","2","","(5SR,6RS)-6-Phenyl-5-(phenylsulfonylacetyl)bicyclo[2.2.1]hept-2-ene","","- C21 H20 O3 S -","- C21 H20 O3 S -","- C42 H40 O6 S2 -","2","1","OB6341","Pei, Wen; Shao, Yueshui; Sun, Li","(5<i>SR</i>,6<i>RS</i>)-6-Phenyl-5-(phenylsulfonylacetyl)bicyclo[2.2.1]hept-2-ene","Acta Crystallographica Section E","2004","60","3","o374","o375","10.1107/S1600536804002089","","","0.7107","MoKα","","","0.039","","","","0.103","","","","","","1.001","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203329","9.011","0.002","9.403","0.002","11.621","0.002","66.49","0.03","67.67","0.03","62.05","0.03","774.6","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","5-(3,4-dimethoxyphenyl)-1-phenylpyrazolidin-3-one","","- C17 H18 N2 O3 -","- C17 H18 N2 O3 -","- C34 H36 N4 O6 -","2","1","OB6343","Zhu, Hong-Jun; Ma, Ji; Wei, Chang-Mei; Wang, Jin-Tang","(±)-5-(3,4-Dimethoxyphenyl)-1-phenylpyrazolidin-3-one","Acta Crystallographica Section E","2004","60","3","o411","o413","10.1107/S1600536804003381","","","0.71073","MoKα","","0.0857","0.0651","","","0.2449","0.2753","","","","","","1.178","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203330","8.8268","0.0014","5.9191","0.0006","12.167","0.0019","90","","90.277","0.013","90","","635.68","0.16","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1-[(3-Hydroxypyridin-2-ylamino)methylene]naphthalen-2(1H)-one","","- C16 H12 N2 O2 -","- C16 H12 N2 O2 -","- C32 H24 N4 O4 -","2","1","OB6347","Özek, Arzu; Yüce, Süheyla; Albayrak, Çiǧdem; Odabaşoǧlu, Mustafa; Büyükgüngör, Orhan","1-[(3-Hydroxypyridin-2-ylamino)methylene]naphthalen-2(1<i>H</i>)-one","Acta Crystallographica Section E","2004","60","3","o356","o358","10.1107/S1600536804002971","","","0.71073","MoKα","","0.0523","0.0339","","","0.0676","0.0709","","","","","","0.979","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203331","10.74","0.002","7.5172","0.0015","20.398","0.004","90","","93.4","0.03","90","","1643.9","0.6","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(tetraethylammonium) 2,2'-bipyridine-4,4'-dicarboxylate tetrahydrate","","- C28 H54 N4 O8 -","- C28 H54 N4 O8 -","- C56 H108 N8 O16 -","2","0.5","OB6349","Fujihara, Takashi; Kobayashi, Atsuo; Nagasawa, Akira","Bis(tetraethylammonium) 2,2'-bipyridine-4,4'-dicarboxylate tetrahydrate","Acta Crystallographica Section E","2004","60","3","o353","o355","10.1107/S1600536804002910","","","0.71073","MoKα","","0.0762","0.0586","","","0.1699","0.187","","","","","","1.043","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203332","8.589","0.002","19.126","0.004","10.176","0.002","90","","104.88","0.03","90","","1615.6","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","9-Bromo-4-methyl-2-phenylbenzo[de]cyclobut[i] isoquinoline-3,5(2H)-dione","","- C21 H14 Br N O2 -","- C21 H14 Br N O2 -","- C84 H56 Br4 N4 O8 -","4","1","OB6352","Qingjian Liu; Jianhua Xu","9-Bromo-4-methyl-2-phenylbenzo[<i>de</i>]cyclobut[<i>i</i>]isoquinoline-3,5(2<i>H</i>)-dione","Acta Crystallographica Section E","2004","60","3","o466","o467","10.1107/S1600536804004192","","","0.71073","MoKα","","0.1325","0.0481","","","0.1206","0.1631","","","","","","0.903","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203333","9.939","0.003","29.449","0.008","9.747","0.003","90","","111.912","0.004","90","","2646.8","1.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H13 Cl N2 O S -","- C14 H13 Cl N2 O S -","- C112 H104 Cl8 N16 O8 S8 -","8","2","OB6353","Vasu; K. A. Nirmala; Deepak Chopra; S. Mohan; J.Saravanan","2-Amino-<i>N</i>-(2-chlorophenyl)-5,6-dihydro-4<i>H</i>-cyclopenta[<i>b</i>]thiophene-3-carboxamide","Acta Crystallographica Section E","2004","60","3","o437","o438","10.1107/S1600536804003927","","","0.71073","MoKα","","0.0792","0.0568","","","0.1212","0.1303","","","","","","1.145","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203334","10.715","0.002","11.333","0.002","22.72","0.005","90","","103.3","0.03","90","","2685","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","5-(8-hydroxyquinolyl)guanidine dihydrochloride","","- C10 H12 Cl2 N4 O -","- C10 H12 Cl2 N4 O -","- C80 H96 Cl16 N32 O8 -","8","1","OB6354","Wei, Chang-Mei; Jiang, Tao; Li, Yi-Zhi; Zhu, Hong-Jun; Wang, Jin-Tang","5-(8-Hydroxyquinolyl)guanidinium dichloride","Acta Crystallographica Section E","2004","60","3","o442","o443","10.1107/S1600536804004040","","","0.71073","MoKα","","0.0511","0.0453","","","0.1369","0.1386","","","","","","1.048","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203335","9.283","0.004","8.416","0.003","12.68","0.005","90","","105.42","0.03","90","","955","0.7","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H13 N O3 -","- C8 H13 N O3 -","- C32 H52 N4 O12 -","4","1","OB6355","Kazuyuki Takahashi; Taka-aki Okamura; Hitoshi Yamamoto; Norikazu Ueyama","(<i>Z</i>)-4-(<i>tert</i>-Butylamino)-4-oxo-2-butenoic acid","Acta Crystallographica Section E","2004","60","3","o448","o449","10.1107/S1600536804004039","","","0.71069","MoKα","","0.1503","0.042","","","0.1035","0.1338","","","","","","0.976","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203336","15.3738","0.0008","7.2254","0.0002","15.9661","0.0009","90","","106.578","0.002","90","","1699.82","0.14","173","2","173","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(4α)-Kaur-16-en-18-carbonyl 2,3,4,6-tetra-O-acetyl-α-D-glucopyranoside","","- C34 H48 O11 -","- C34 H48 O11 -","- C68 H96 O22 -","2","1","OM6204","Asiloé J. Mora; Gerzon E. Delgado; Gavin B. M. Vaughan; Patrick Martin; Tomás Visbal; Alfredo Usubillaga","A peracetylated glucosyl ester of kaurenic acid","Acta Crystallographica Section E","2004","60","3","o334","o336","10.1107/S1600536804002181","","","0.53378","Synchrotron","","0.048","0.0462","","","0.1239","0.1252","","","","","","1.044","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203337","8.6467","0.0006","20.5855","0.0013","10.9985","0.0008","90","","100.297","0.006","90","","1926.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 4-benzoyl-1,5-diphenyl-1H-pyrazole-3-carboxylate","","- C24 H18 N2 O3 -","- C24 H18 N2 O3 -","- C96 H72 N8 O12 -","4","1","OM6207","Dinçer, Muharrem; Özdemir, Namık; Yıldırım, İsmail; Demir, Elif; Akçamur, Yunus; Işık, Şamil","Methyl 4-benzoyl-1,5-diphenyl-1<i>H</i>-pyrazole-3-carboxylate","Acta Crystallographica Section E","2004","60","3","o317","o319","10.1107/S1600536804000455","","","0.71073","MoKα","","0.0438","0.0262","","","0.0438","0.0447","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203338","9.747","0.004","11.291","0.004","12.297","0.005","84.546","0.007","74.655","0.006","78.378","0.006","1277.1","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Ethyl 2-(2,4-dichlorobenzylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro- 5H-thiazolo[3,2-a]pyrimidine-6-carboxylate dichloromethane solvate","","- C24 H20 Cl4 N2 O3 S -","- C24 H20 Cl4 N2 O3 S -","- C48 H40 Cl8 N4 O6 S2 -","2","1","OM6208","Liu, Xin-Gang; Feng, Ya-Qing; Li, Xiao-Fang; Liang, Zu-Pei","Ethyl 2-(2,4-dichlorobenzylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5<i>H</i>-thiazolo[3,2-<i>a</i>]pyrimidine-6-carboxylate dichloromethane solvate","Acta Crystallographica Section E","2004","60","3","o344","o345","10.1107/S1600536804002740","","","0.71073","MoKα","","0.1092","0.0588","","","","0.1795","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203339","16.3204","0.0012","17.8489","0.0013","18.6636","0.0014","90","","90","","90","","5436.7","0.7","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","99348z","","","- C19 H41 Cl N4 O6 Zn2 -","- C19 H41 Cl N4 O6 Zn2 -","- C152 H328 Cl8 N32 O48 Zn16 -","8","1","OM6209","McCowan, C. Shawn; Carrie E. Buss; Victor G. Young Jr; McDonnell, Ryan J.; Caudle, M. Tyler","Chloro(diethylamino)tris(μ-diethylcarbamato)dizinc(II): an example of the generality of the threefold paddlewheel structure in carbamatozinc chemistry","Acta Crystallographica Section E","2004","60","3","m285","m287","10.1107/S1600536804002193","","","0.71073","MoKα","","0.0362","0.0232","","","0.0526","0.0564","","","","","","1.024","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203340","26.015","0.01","6.252","0.005","20.412","0.004","90","","109.749","0.016","90","","3125","3","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3-(6-Benzoyl-5-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)propanoic acid","","- C17 H12 Cl N O5 -","- C17 H12 Cl N O5 -","- C136 H96 Cl8 N8 O40 -","8","1","OM6211","Abdullah Aydın; Tijen Önkol; Mehmet Akkurt; Orhan Büyükgüngör; Serdar Ünlü","3-(6-Benzoyl-5-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)propanoic acid","Acta Crystallographica Section E","2004","60","3","o341","o343","10.1107/S160053680400220X","","","0.71073","MoKα","","0.0763","0.0329","","","0.0776","0.0851","","","","","","0.724","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203341","28.6778","0.001","11.3532","0.0004","12.6453","0.0005","90","","90","","90","","4117.1","0.3","298","2","298","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","Tetrakis(1,3-dimethylimidazolidinium-2-dithiocarboxylate-κS)zinc perchlorate","","- C24 H40 Cl2 N8 O8 S8 Zn -","- C24 H40 Cl2 N8 O8 S8 Zn -","- C96 H160 Cl8 N32 O32 S32 Zn4 -","4","0.5","OM6212","Fujihara, Takashi; Sugaya, Tomoaki; Nagasawa, Akira; Nakayama, Juzo","Tetrakis(1,3-dimethylimidazolidinium-2-dithiocarboxylate-κ<i>S</i>)zinc(II) diperchlorate","Acta Crystallographica Section E","2004","60","3","m282","m284","10.1107/S160053680400217X","","","0.71073","MoKα","","0.0886","0.0832","","","0.1702","0.1727","","","","","","1.31","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203342","7.509","0.002","7.777","0.002","8.43","0.002","83.776","0.006","68.993","0.005","71.511","0.005","435.84","0.19","103","1","103","1","","","","","","","","4","P 1","P 1","1","","","","- C20 H25 N O5 -","- C20 H25 N O5 -","- C20 H25 N O5 -","1","1","OM6213","Deschamps, Jeffrey R.; Coop, Andrew; Parrish, Damon A.; Rice, Kenner C.","7β,14β-Epoxyhydrocodone-6,6-dimethoxy ketal: an unusual oxetane-containing opioid","Acta Crystallographica Section E","2004","60","3","o331","o333","10.1107/S1600536804002077","","","0.71073","MoKα","","0.0321","0.0318","","","0.0832","0.0835","","","","","","1.03","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203343","12.1203","0.0019","12.868","0.002","15.502","0.002","90","","107.481","0.006","90","","2306.1","0.6","110","2","110","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H20 Cu N6 S2 -","- C22 H20 Cu N6 S2 -","- C88 H80 Cu4 N24 S8 -","4","0.5","OM6214","Gary, John Brannon; Kautz, Jason A.; Klausmeyer, Kevin K.; Wong, Ching-Wah","Diisothiocyanatotetrapyridinecopper(II)","Acta Crystallographica Section E","2004","60","3","m328","m329","10.1107/S1600536804003836","","","0.71073","MoKα","","0.0237","0.0218","","","0.0619","0.0631","","","","","","1.063","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203344","5.239","0.004","23.709","0.019","5.669","0.005","90","","111.708","0.013","90","","654.2","0.9","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(1SR,2SR,4SR)-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid","","- C7 H8 O3 -","- C7 H8 O3 -","- C28 H32 O12 -","4","1","OM6216","Gartenmann Dickson, Lukas; Hauser, Jürg; Blaser, Adrian; Reymond, Jean-Louis; Bürgi, Hans-Beat","(1<i>SR</i>,2<i>SR</i>,4<i>SR</i>)-7-Oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid","Acta Crystallographica Section E","2004","60","3","o381","o382","10.1107/S1600536804003198","","","0.71073","MoKα","","0.0489","0.0428","","","0.1107","0.1151","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203345","10.097","0.002","12.977","0.002","14.86","0.002","88.86","0.01","75.41","0.01","73.86","0.01","1807.4","0.5","296","2","296","2","","","","","","","","5","P -1","-P 1","2","Dinitratoaquabis(3-pyrazolidinone, 1,5-dimethyl-2-phenyl-4-[{(E)-4-pyridinylmethylidene}amino])nickel(II)","Aquabis(1,5-dimethyl-2-phenyl-4-{[(E)-4-pyridylmethylene- κN]amino}pyrazolidin-3-one)dinitratonickel(II)","","- C34 H34 N10 Ni O9 -","- C34 H34 N10 Ni O9 -","- C68 H68 N20 Ni2 O18 -","2","1","RN6009","Hong Liang; Xian-Wen Wang; Zhen-Feng Chen; Ling Huang; Hong-Li Zou; Jian Zhou; Kai-Bei Yu","Aquabis(1,5-dimethyl-2-phenyl-4-{[(<i>E</i>)-4-pyridylmethylene-κ<i>N</i>]amino}pyrazolidin-3-one)dinitratonickel(II)","Acta Crystallographica Section E","2004","60","3","m294","m296","10.1107/S1600536804002636","","","0.71073","MoKα","","0.054","0.038","","","0.0901","0.0945","","","","","","0.977","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203346","15.615","0.004","10.543","0.004","20.403","0.005","90","","92.4","0.02","90","","3356","1.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetrakis(anilinium) hexachlorotin(IV) dichloride","","- C24 H32 Cl8 N4 Sn -","- C24 H32 Cl8 N4 Sn -","- C96 H128 Cl32 N16 Sn4 -","4","1","RN6013","Rademeyer, Melanie","Tetrakis(anilinium) hexachlorotin(IV) dichloride","Acta Crystallographica Section E","2004","60","3","m345","m347","10.1107/S1600536804004258","","","0.71073","MoKα","","0.1153","0.0428","","","0.0847","0.1038","","","","","","0.918","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203347","11.712","0.004","12.708","0.004","15.354","0.005","80.869","0.004","68.461","0.004","73.281","0.004","2032.2","1.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C45 H60 N8 -","- C45 H60 N8 -","- C90 H120 N16 -","2","1","SU6074","Wei Xu; Yin-Xiang Lu; Peng Guo; Hui Zhou; Bi-Jian Lan","Tetrakis[(4-phenylpiperazin-1-yl)methyl]methane","Acta Crystallographica Section E","2004","60","3","o428","o430","10.1107/S1600536804002016","","","0.71073","MoKα","","0.1197","0.0607","","","0.1277","0.1561","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203348","15.0815","0.001","3.8941","0.0003","26.0597","0.0016","90","","98.498","0.002","90","","1513.65","0.18","291","2","291","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Diacenaphtheno[7,8-b:7^1^,8^1^-d]thiophene","","- C24 H12 S -","- C24 H12 S -","- C96 H48 S4 -","4","1","SU6075","Oliver C. Musgrave; Janet M. S. Skakle","Diacenaphtheno[7,8-<i>b</i>:7^1^,8^1^-<i>d</i>]thiophene","Acta Crystallographica Section E","2004","60","3","o359","o360","10.1107/S160053680400265X","","","0.71073","MoKα","","0.1126","0.0616","","","0.1266","0.1447","","","","","","0.986","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203349","9.786","0.003","10.55","0.004","15.603","0.005","97.04","0.02","91.47","0.02","94.66","0.02","1592.4","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H30 Cl2 N6 O12 Zn -","- C24 H30 Cl2 N6 O12 Zn -","- C48 H60 Cl4 N12 O24 Zn2 -","2","1","SU6076","Elguja B. Miminoshvili; Alexandre N. Sobolev; Ketevan E. Miminoshvili; Tamara N. Sakvarelidze","Bis(piperidinium) <i>trans</i>-dichlorobis(3,5-dinitrobenzoato)zincate(II)","Acta Crystallographica Section E","2004","60","3","m319","m321","10.1107/S160053680400337X","","","0.71069","MoKα","","0.0322","0.0322","","","0.0845","0.0845","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203350","11.228","0.0011","7.222","0.0011","13.3393","0.0016","90","","97.8","0.01","90","","1071.7","0.2","296","1","296","1","","","","","","","","5","C 1 2 1","C 2y","5","(S)-(-)-α-Methylbenzylammonium tetrachloropalladate(II)","(S)-(-)-1-Phenylethylammonium tetrachloropalladate(II)","","- C16 H24 Cl4 N2 Pd -","- C16 H24 Cl4 N2 Pd -","- C32 H48 Cl8 N4 Pd2 -","2","0.5","SU6077","Cruz-Cruz, Sandra; Rodríguez-Pastrana, Modesto; Bernès, Sylvain; Gutiérrez-Pérez, René","Bis[(<i>S</i>)-(‒)-1-phenylethylammonium] tetrachloropalladate(II)","Acta Crystallographica Section E","2004","60","3","m342","m344","10.1107/S1600536804003411","","","0.71073","MoKα","","0.0287","0.0276","","","0.0731","0.0744","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203351","10.056","0.004","12.014","0.007","12.842","0.008","107.11","0.05","94.83","0.05","111.92","0.04","1342.3","1.5","240","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C30 H31 In N4 -","- C30 H31 In N4 -","- C60 H62 In2 N8 -","2","1","TK6150","Aris, Damian R.; Barker, James; Errington, William; Wallbridge, Malcolm G. H.","Bis(<i>N,N</i>'-diphenylacetamidinato)ethylindium(III)","Acta Crystallographica Section E","2004","60","3","m302","m303","10.1107/S1600536804002867","","","0.71073","MoKα","","","0.048","","","","0.124","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203352","11.969","0.003","14.326","0.003","12.622","0.003","90","","113.604","0.003","90","","1983.2","0.8","168","2","168","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,4-Bis(8-quinolyloxymethyl)benzene","","- C26 H20 N2 O2 -","- C26 H20 N2 O2 -","- C104 H80 N8 O8 -","4","1","TK6152","Steel, Peter J.; Al-Mandhary, Muna R. A.","1,4-Bis(8-quinolyloxymethyl)benzene","Acta Crystallographica Section E","2004","60","3","o346","o347","10.1107/S1600536804002879","","","0.71073","MoKα","","0.055","0.041","","","0.1","0.107","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203353","15.7515","0.0015","8.2452","0.0017","15.673","0.002","90","","110.153","0.009","90","","1910.9","0.5","295","","295","","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C16 H22 N2 O6 S -","- C16 H22 N2 O6 S -","- C64 H88 N8 O24 S4 -","4","1","TK6153","Laurent F. Bornaghi; Sally-Ann Poulsen; Peter C. Healy","<i>N</i>-Allyl-<i>N</i>-(2-nitrobenzenesulfonyl)-<small>L</small>-leucine methyl ester","Acta Crystallographica Section E","2004","60","3","o383","o385","10.1107/S1600536804003186","","","0.7107","MoKα","","0.075","0.04","","","0.104","0.12","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203354","10.8426","0.001","21.704","0.002","11.0967","0.0009","90","","107.92","0.007","90","","2484.7","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4,5-Bis(2-tert-butylphenoxy)phthalonitrile","","- C28 H28 N2 O2 -","- C28 H28 N2 O2 -","- C112 H112 N8 O8 -","4","1","WK6008","Ocak, Nazan; Işık, Şamil; Akdemir, Nesuhi; Kantar, Cihan; Aǧar, Erbil","4,5-Bis(2-<i>tert</i>-butylphenoxy)phthalonitrile","Acta Crystallographica Section E","2004","60","3","o361","o362","10.1107/S1600536804002156","","","0.71073","MoKα","","0.0893","0.0397","","","0.0951","0.1076","","","","","","0.804","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203355","12.646","0.002","10.518","0.001","12.904","0.002","90","","98.703","0.002","90","","1696.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","3-[2-(N,N-Diethylamino)glyoxyloyl]-1H-indol-4-yl acetate monohydrate","","- C16 H20 N2 O5 -","- C16 H20 N2 O5 -","- C64 H80 N8 O20 -","4","1","WK6010","Wu, Hai-Qiang; Zhou, Jin-Lin; Huang, Zhi-Shu; Gu, Lian-Quan; Ng, Seik Weng","3-[2-(<i>N</i>,<i>N</i>-Diethylamino)glyoxyloyl]-1<i>H</i>-indol-4-yl acetate monohydrate","Acta Crystallographica Section E","2004","60","3","o337","o338","10.1107/S1600536804002211","","","0.71073","MoKα","","0.0526","0.0404","","","0.1164","0.1279","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203356","10.736","0.002","12.803","0.003","14.877","0.003","105.5","0.03","105.13","0.03","97.43","0.03","1858.1","0.9","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- H36.5 Na5.5 O41 Pt W6 -","- Na5.5 O41 Pt W6 -","- Na11 O82 Pt2 W12 -","2","1","WM6009","Lee, Uk; Joo, Hea-Chung","A novel protonated hexatungstoplatinate(IV), Na~5.5~[H~2.5~PtW~6~O~24~]·17H~2~O","Acta Crystallographica Section E","2004","60","3","i33","i36","10.1107/S1600536804002302","","","0.71069","MoKα","","0.052","0.0387","","","0.0886","0.0979","","","","","","1.132","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2203357","6.9928","0.0006","8.7617","0.0004","15.0426","0.001","90","","90","","90","","921.64","0.11","299","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","Sodium pentafluorouranate(IV) monohydrate","","- F5 H2 Na O U -","- F5 H Na O U -","- F40 H8 Na8 O8 U8 -","8","1","WM6010","Andreas Fischer; Zoltán Szabó","Sodium pentafluorouranate(IV) monohydrate, Na[UF~5~]·H~2~O","Acta Crystallographica Section E","2004","60","3","i45","i46","10.1107/S1600536804003241","","","0.71073","MoKα","","0.0295","0.0229","","","0.0459","0.0475","","","","","","1.253","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2203358","15.423","0.002","19.0022","0.0009","7.6423","0.0007","90","","90","","90","","2239.7","0.4","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- H8 Mo4 N2 O13 -","- Mo4 N2 O13 -","- Mo32 N16 O104 -","8","1","WM6011","Alexander Briceño; Reinaldo Atencio","[(NH~4~)~2~(Mo~4~O~13~)]~<i>n~</i>: a novel two-dimensional polyoxomolybdate(VI) framework","Acta Crystallographica Section E","2004","60","3","i47","i49","10.1107/S160053680400385X","","","0.71073","MoKα","","0.0397","0.0374","","","0.1025","0.1042","","","","","","1.242","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203359","5.194","0.005","20.102","0.005","6.914","0.005","90","","102.573","0.005","90","","704.6","0.9","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-Furan-2-yl-1,3,4-oxadiazole-2(3H)-thione","","- C6 H4 N2 O2 S -","- C6 H4 N2 O2 S -","- C24 H16 N8 O8 S4 -","4","1","WN6214","Sema Öztürk; Mehmet Akkurt; Ahmet Cansız; Ahmet Çetin; Mehmet Şekerci; Frank W. Heinemann","5-(Furan-2-yl)-1,3,4-oxadiazole-2(3<i>H</i>)-thione","Acta Crystallographica Section E","2004","60","3","o322","o323","10.1107/S1600536804001977","","","0.71069","MoKα","","0.0383","0.0301","","","0.1016","0.1073","","","","","","1.089","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203360","6.809","0.004","20.164","0.01","7.062","0.006","90","","93.33","0.05","90","","968","1.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(melaminium) terephthalate dihydrate","","- C14 H22 N12 O6 -","- C14 H22 N12 O6 -","- C28 H44 N24 O12 -","2","0.5","WN6215","Jian Zhang; Yao Kang; Yi-Hang Wen; Zhao-Ji Li; Ye-Yan Qin; Yuan-Gen Yao","Bis(melaminium) terephthalate dihydrate","Acta Crystallographica Section E","2004","60","3","o462","o463","10.1107/S1600536804003514","","","0.71073","MoKα","","","0.0669","","","0.1511","0.1741","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203361","9.184","0.002","14.147","0.003","17.302","0.004","90","","100.074","0.004","90","","2213.3","0.8","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3,5-pyrazoledicarboxylic acid diethyl ester","diethyl 1H-pyrazole-3,5-dicarboxylate","","- C9 H12 N2 O4 -","- C9 H12 N2 O4 -","- C72 H96 N16 O32 -","8","2","WW6160","Yin, Caixia; Huo, Fangjun; Gao, Fei; Yang, Pin","Diethyl 1<i>H</i>-pyrazole-3,5-dicarboxylate","Acta Crystallographica Section E","2004","60","3","o320","o321","10.1107/S1600536804001928","","","0.71073","MoKα","","0.1588","0.0469","","","0.0846","0.1133","","","","","","0.813","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203362","4.869","0.002","13.902","0.005","11.839","0.004","90","","97.93","0.006","90","","793.7","0.5","293","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-(4-Pyridyl)-1,3,4-oxadiazole-2(3H)-thione","","- C7 H5 N3 O S -","- C7 H5 N3 O S -","- C28 H20 N12 O4 S4 -","4","1","WW6163","Du, Miao; Zhao, Xiao-Jun; Guo, Jian-Hua","5-(4-Pyridyl)-1,3,4-oxadiazole-2(3<i>H</i>)-thione","Acta Crystallographica Section E","2004","60","3","o327","o328","10.1107/S1600536804001916","","","0.71073","MoKα","","0.0791","0.0447","","","0.0818","0.092","","","","","","1.085","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203363","13.9921","0.0001","8.903","0.0001","24.9658","0.0003","90","","96.259","0.001","90","","3091.49","0.06","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Pentacyanoferrate(III)-μ-cyano-triaquatetrakis- (dimethylformamide)gadolinium(III) hydrate","","- C18 H36 Fe Gd N10 O8 -","- C18 H36 Fe Gd N10 O8 -","- C72 H144 Fe4 Gd4 N40 O32 -","4","1","YA6185","Jian-Rong Li; Li-Zhen Cai; Guo-Cong Guo; Xian-He Bu; Jin-Shun Huang","Pentacyanoferrate(III)-μ-cyano-[triaquatetrakis(dimethylformamide)gadolinium(III)] monohydrate","Acta Crystallographica Section E","2004","60","3","m259","m261","10.1107/S160053680400193X","","","0.71073","MoKα","","0.045","0.034","","","0.072","0.078","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203364","7.69","0.001","17.93","0.001","7.095","0.001","90","","95.7","0.01","90","","973.4","0.2","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","4-Acetylanilinium chloride monohydrate","","- C8 H12 Cl N O2 -","- C8 H12 Cl N O2 -","- C32 H48 Cl4 N4 O8 -","4","1","YA6193","Ersanlı, Cem Cüneyt; Odabaşoǧlu, Mustafa; Albayrak, Çiǧdem; Büyükgüngör, Orhan; Erdönmez, Ahmet","4-Acetylanilinium chloride monohydrate","Acta Crystallographica Section E","2004","60","3","o397","o398","10.1107/S1600536804002569","","","0.71073","MoKα","","0.04","0.032","","","0.068","0.07","","","","","","0.96","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203365","6.7202","0.0016","10.131","0.003","17.813","0.004","90","","97.884","0.004","90","","1201.3","0.5","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2-[hydroxy(4-nitrophenyl)methyl]-cyclohex-2-en-1-one","2-[hydroxy(4-nitrophenyl)methyl]-cyclohex-2-en-1-one","","- C13 H13 N O4 -","- C13 H13 N O4 -","- C52 H52 N4 O16 -","4","1","YA6194","Huo, Fangjun; Yin, Caixia; Guo, Wei; Xia, Chizhong; Yang, Pin","The Baylis‒Hillman adduct of 4-nitrobenzaldehyde and cyclohex-2-en-1-one: 2-[hydroxy(4-nitrophenyl)methyl]-cyclohex-2-en-1-one","Acta Crystallographica Section E","2004","60","3","o419","o421","10.1107/S1600536804003587","","","0.71073","MoKα","","0.085","0.056","","","0.131","0.146","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203366","8.3592","0.001","7.53","0.0005","31.368","0.003","90","","97.4","0.009","90","","1958","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2,7-Bis(3',4'-dicyanophenoxy)naphthalene","4,4'-Naphthalene-2,7-dioxydibenzene-1,2-dicarbonitrile","","- C26 H12 N4 O2 -","- C26 H12 N4 O2 -","- C104 H48 N16 O8 -","4","1","YA6196","Ocak, Nazan; Işık, Şamil; Akdemir, Nesuhi; Ağar, Erbil; Gümrükçüoğlu, Ismail Erdem","2,7-Bis(3,4-dicyanophenoxy)naphthalene","Acta Crystallographica Section E","2004","60","3","o435","o436","10.1107/S1600536804003630","","","0.71073","MoKα","","0.09","0.036","","","0.074","0.084","","","","","","0.77","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203367","38.939","0.003","4.9902","0.0003","8.904","0.0005","90","","95.896","0.002","90","","1721.01","0.19","150","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-di-n-tetradecylpyromellitic diimide","","- C38 H60 N2 O4 -","- C38 H60 N2 O4 -","- C76 H120 N4 O8 -","2","0.5","AC6083","Daniel E. Lynch; Darren G. Hamilton","<i>N</i>,<i>N</i>'-Di-<i>n</i>-tetradecylpyromellitic diimide","Acta Crystallographica Section E","2004","60","4","o597","o598","10.1107/S1600536804006038","","","0.71073","MoKα","","0.161","0.0594","","","0.1322","0.2029","","","","","","0.968","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203368","11.2818","0.0005","12.4987","0.0006","13.8074","0.0005","90","","91.209","0.001","90","","1946.52","0.15","297.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H9 N O2 S -","- C10 H9 N O2 S -","- C80 H72 N8 O16 S8 -","8","2","AC6085","Delong Shen; Jianquan Weng; Chengxia Tan; Aishu Tang","3-Benzoylthiazolidin-2-one","Acta Crystallographica Section E","2004","60","4","o602","o603","10.1107/S160053680400604X","","","0.7107","MoKα","","","0.035","","","","0.093","","","","","","1.008","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203369","7.946","0.003","12.385","0.004","12.741","0.004","90","","100.789","0.005","90","","1231.7","0.7","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dichlorobis(1-methylimidazole)zinc(II)","","- C8 H12 Cl2 N4 Zn -","- C8 H12 Cl2 N4 Zn -","- C32 H48 Cl8 N16 Zn4 -","4","1","AC6087","Musie, Ghezai T.; Li, Xiaobao; Powell, Douglas R.","Dichlorobis(1-methylimidazole)zinc(II)","Acta Crystallographica Section E","2004","60","4","m471","m472","10.1107/S1600536804006579","","","0.71073","MoKα","","0.023","0.0219","","","0.0585","0.0591","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203370","5.555","0.001","27.83","0.009","6.842","0.002","90","","107.56","0.02","90","","1008.5","0.5","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","RbMn~6~(As~2~O~7~)~2~(As~3~O~10~)","Rubidium manganese arsenate(1;6;7)","","- As7 Mn6 O24 Rb -","- As7 Mn6 O24 Rb -","- As14 Mn12 O48 Rb2 -","2","0.5","BR6138","Ayed,Brahim; Haj Abbdallah,Anissa; Hadded,Amor","RbMn~6~(As~2~O~7~)~2~(As~3~O~10~): a new manganese(II) arsenate","Acta Crystallographica, Section E","2004","60","4","i52","i54","10.1107/S1600536804004544","","","0.71073","MoKα","","0.0632","0.0371","","","0.0949","0.1106","","","","","","1.094","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2203371","10.028","0.001","10.591","0.001","12.109","0.003","113.13","0.01","107.17","0.01","99.48","0.01","1070.8","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- H46 Na6 O46 Pt W6 -","- Na6 O46 Pt W6 -","- Na6 O46 Pt W6 -","1","0.5","BR6139","Lee, Uk; Joo, Hea-Chung; Park, Ki-Min","A diprotonated hexatungstoplatinate(IV), Na~6~[H~2~PtW~6~O~24~]·22H~2~O","Acta Crystallographica Section E","2004","60","4","i55","i57","10.1107/S1600536804004970","","","0.71069","MoKα","","0.0444","0.0354","","","0.0886","0.0964","","","","","","1.113","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203372","9.8825","0.0007","9.8825","0.0007","9.8825","0.0007","90","","90","","90","","965.16","0.12","293","2","293","2","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","","","","- Ba3 O24 P6 V4 -","- Ba3 O24 P6 V4 -","- Ba6 O48 P12 V8 -","2","0.166667","BR6140","Droß, Thomas; Glaum, Robert","The langbeinite-type barium vanadium(III) orthophosphate, Ba~3~V~4~(PO~4~)~6~","Acta Crystallographica Section E","2004","60","4","i58","i60","10.1107/S1600536804005689","","","0.71073","MoKα","","0.027","0.027","","","0.0586","0.059","","","","","","1.131","","","","has coordinates,has Fobs","282068","2023-03-26","10:12:33",""
"2203373","6.9009","0.0002","31.1833","0.0009","10.7808","0.0003","90","","98.312","0.001","90","","2295.58","0.11","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[[aqua(1,10-phenanthroline)copper(II)]-μ-isophthalato] N,N -dimethylformamide solvate monohydrate]","","- C23 H23 Cu N3 O7 -","- C23 H23 Cu N3 O7 -","- C92 H92 Cu4 N12 O28 -","4","1","BR6142","Hong-Ping Xiao; Xin-Hua Li; Mao-Lin Hu","<i>catena</i>-Poly[[[aqua(1,10-phenanthroline)copper(II)]-μ-isophthalato] <i>N,N</i>-dimethylformamide solvate monohydrate]","Acta Crystallographica Section E","2004","60","4","m468","m470","10.1107/S1600536804006592","","","0.71073","MoKα","","0.0425","0.0391","","","0.1149","0.1171","","","","","","1.075","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203374","7.003","0.002","13.219","0.002","23.779","0.004","90","","91.64","0.03","90","","2200.4","0.8","203","2","203","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","10,10-Bis(trimethylsilylethynyl)-9-methylenefluorene","9-[bis(trimethylsilylethynyl)methylene]fluorene","","- C24 H26 Si2 -","- C24 H26 Si2 -","- C96 H104 Si8 -","4","1","BT6415","Jones, Peter G.; Berger, Harald; Bubenitschek, Peter; Hopf, Henning","10,10-Bis(trimethylsilylethynyl)-9-methylenefluorene","Acta Crystallographica Section E","2004","60","4","o490","o491","10.1107/S1600536804004428","","","0.71073","MoKα","","0.1247","0.0595","","","0.1105","0.1374","","","","","","1.011","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203375","11.933","0.002","18.398","0.004","12.509","0.003","90","","90.85","0.03","90","","2746","1","143","2","143","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","10,10-Bis(trimethylsilylethynyl)-9-methylene-fluorene‒ tetracyano-para-quinodimethane (2/1)","9-[bis(trimethylsilylethynyl)methylene]fluorene‒tetracyano-para-quinodimethane (2/1)","","- C60 H56 N4 Si4 -","- C60 H56 N4 Si4 -","- C120 H112 N8 Si8 -","2","0.5","BT6416","Jones, Peter G.; Berger, Harald; Bubenitschek, Peter; Hopf, Henning","10,10-Bis(trimethylsilylethynyl)-9-methylenefluorene‒tetracyano-<i>para</i>-quinodimethane (2/1)","Acta Crystallographica Section E","2004","60","4","o492","o493","10.1107/S160053680400443X","","","0.71073","MoKα","","0.0626","0.0436","","","0.0978","0.1105","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203376","7.888","0.0003","22.9733","0.0009","10.3234","0.0004","90","","111.704","0.001","90","","1738.12","0.12","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(1,4-Diazoniabicyclo[2,2,2]octane)octamolybdate tetrahydrate","","- C12 H36 Mo8 N4 O30 -","- C12 H36 Mo8 N4 O30 -","- C24 H72 Mo16 N8 O60 -","2","0.5","BT6417","Fang, Rui-Qin; Zhang, Xian-Ming; Wu, Hai-Shun; Ng, Seik Weng","Bis(1,4-Diazoniabicyclo[2.2.2]octane) octamolybdate(VI) tetrahydrate","Acta Crystallographica Section E","2004","60","4","m359","m361","10.1107/S1600536804004647","","","0.71073","MoKα","","0.022","0.021","","","0.054","0.054","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203377","8.0122","0.0011","6.9993","0.0006","36.417","0.004","90","","91.945","0.005","90","","2041.1","0.4","291","1","291","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl (Z,Z)-α-(methoxyimino)-2-[({1-[3- (trifluoromethyl)phenyl]ethylidene}amino)oxy]methyl]benzeneacetate","","- C20 H19 F3 N2 O4 -","- C20 H19 F3 N2 O4 -","- C80 H76 F12 N8 O16 -","4","1","BT6418","Banerjee, Kaushik; Ligon, Axel Patrick; Schürmann, Markus; Preut, Hans; Spiteller, Michael","Methyl (<i>Z</i>,<i>Z</i>)-α-(methoxyimino)-2-[({1-[3-(trifluoromethyl)phenyl]ethylidene}amino)oxymethyl]benzeneacetate","Acta Crystallographica Section E","2004","60","4","o525","o526","10.1107/S1600536804004738","","","0.71073","MoKα","","0.1242","0.0339","","","0.0588","0.0691","","","","","","1.007","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2203378","9.4878","0.0008","22.4857","0.0018","12.6805","0.001","90","","101.5","0.002","90","","2650.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2'-(4-Bromobenzoyl)acenaphthene-1-spiro-3'-pyrrolizidine-1'-spiro-3''- indole-2,2''(1H,3''H)-dione monohydrate","","- C32 H25 Br N2 O4 -","- C32 H25 Br N2 O4 -","- C128 H100 Br4 N8 O16 -","4","1","BT6419","Govind, M. M.; Selvanayagam, S.; Velmurugan, D.; Ravikumar, K.; Suresh Babu, A. R.; Raghunathan, R.","2'-(4-Bromobenzoyl)acenaphthene-1-spiro-3'-pyrrolizidine-1'-spiro-3''-indole-2,2''(1<i>H</i>,3''<i>H</i>)-dione monohydrate","Acta Crystallographica Section E","2004","60","4","o604","o606","10.1107/S1600536804005422","","","0.71073","MoKα","","0.1218","0.0586","","","0.1432","0.1735","","","","","","0.985","","","","has coordinates,has Fobs","194389","2020-10-21","18:00:00",""
"2203379","23.285","0.002","7.8966","0.0007","15.1669","0.0014","90","","96.979","0.002","90","","2768.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5,7-Dibromo-1'-methyl-2'-(4-methoxybenzoyl)-1H-indole-3-spiro-2'-pyrrolidine- 3'-spiro-3''-1H-indole-2,2''(3H,3''H)-dione methanol solvate","","- C28 H25 Br2 N3 O5 -","- C28 H25 Br2 N3 O5 -","- C112 H100 Br8 N12 O20 -","4","1","BT6420","P.R.Seshadri; S.Selvanayagam; D.Velmurugan; K.Ravikumar; A.R.Sureshbabu; R.Raghunathan","5,7-Dibromo-1'-methyl-2'-(4-methoxybenzoyl)-1<i>H</i>-indole-3-spiro-2'-pyrrolidine-3'-spiro-3''-1<i>H</i>-indole-2,2''(3<i>H</i>,3''<i>H</i>)-dione methanol solvate","Acta Crystallographica Section E","2004","60","4","o550","o552","10.1107/S1600536804005045","","","0.71073","MoKα","","0.0924","0.0481","","","0.12","0.1412","","","","","","0.986","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203380","5.1304","0.0007","7.6367","0.0011","8.6076","0.0012","90","","105.443","0.002","90","","325.06","0.08","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Polymeric bis(glycolato)nickel(II)","poly[nickel(II)-bis(α-hydroxyacetato-κ^3^O^1^,O^2^:O^1'^)]","","- C4 H6 Ni O6 -","- C4 H6 Ni O6 -","- C8 H12 Ni2 O12 -","2","0.5","BT6422","Qing-Qing Kang; La-Sheng Long; Rong-Bin Huang; Lan-Sun Zheng","Polymeric bis(glycolato)nickel(II)","Acta Crystallographica Section E","2004","60","4","m406","m407","10.1107/S1600536804005744","","","0.71073","MoKα","","0.0218","0.0209","","","0.0555","0.056","","","","","","1.113","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203381","7.1028","0.0007","9.5705","0.001","17.77","0.0019","78.002","0.002","82.925","0.008","78.016","0.008","1151.8","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4,4'-(4,4'-thiodiphenoxy)diphthalonitrile","","- C28 H14 N4 O2 S -","- C28 H14 N4 O2 S -","- C56 H28 N8 O4 S2 -","2","1","BT6423","Petek, Hande; Akdemir, Nesuhi; Özil, Musa; Aǧar, Erbil; Şenel, İsmet","4,4'-(4,4'-Thiodiphenoxy)diphthalonitrile","Acta Crystallographica Section E","2004","60","4","o621","o622","10.1107/S1600536804006178","","","0.71073","MoKα","","0.0743","0.0344","","","0.0612","0.0681","","","","","","0.776","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203382","9.9076","0.0009","11.2342","0.001","18.701","0.0016","90","","92.602","0.002","90","","2079.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","α-{3-[2-(Dimethylammonio)ethyl]-1H-indol-5-yl}-N-methylmethanesulfonamide (sumatriptan) succinate","","- C18 H27 N3 O6 S -","- C18 H27 N3 O6 S -","- C72 H108 N12 O24 S4 -","4","1","BT6424","K. Ravikumar; G. Y. S. K. Swamy; Harihara Krishnan","α-{3-[2-(Dimethylammonio)ethyl]-1<i>H</i>-indol-5-yl}-<i>N</i>-methylmethanesulfonamide succinate (sumatriptan succinate)","Acta Crystallographica Section E","2004","60","4","o618","o620","10.1107/S1600536804005896","","","0.71073","MoKα","","0.0857","0.0639","","","0.1461","0.1576","","","","","","1.101","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203383","8.156","0.004","18.251","0.005","5.172","0.007","90","","90","","90","","769.9","1.1","298","2","298","2","","","","","","","","4","P n a 21","P 2c -2n","33","N,N'-diacetyl-1,3-diazo-2-one","1,3-diacetyl-4-imidazolin-2-one","","- C7 H8 N2 O3 -","- C7 H8 N2 O3 -","- C28 H32 N8 O12 -","4","1","BT6425","Crockett, Rowena; Forrester, Alexander R.; Howie, R. Alan","1,3-Diacetyl-4-imidazolin-2-one","Acta Crystallographica Section E","2004","60","4","o558","o560","10.1107/S1600536804005756","","","0.71073","MoKα","","0.1073","0.0558","","","0.0985","0.1132","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203384","9.6357","0.0005","10.5295","0.0005","17.7932","0.0009","90","","94.953","0.001","90","","1798.54","0.16","115","2","115","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","Dihydronium 2,6-diaminopyridinium tris(2,6-pyridinedicarboxylato)ytterbate(III) dihydrate","","- C31 H34 N9 O16 Yb -","- C31 H34 N9 O16 Yb -","- C62 H68 N18 O32 Yb2 -","2","0.5","CF6321","Rafizadeh, Masoud; Ranjbar, M.; Amani, V.","Dihydronium 2,6-diaminopyridinium tris(2,6-pyridinedicarboxylato)ytterbate(III) dihydrate","Acta Crystallographica Section E","2004","60","4","m479","m481","10.1107/S1600536804006415","","","0.71073","MoKα","","0.0357","0.0283","","","0.0579","0.0589","","","","","","0.894","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203385","8.729","0.001","9.267","0.001","16.942","0.001","90","","99.52","0.02","90","","1351.6","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis{μ-N-[(1-methylimidazol-2-yl)methyl]-β-alanine}bis[dichlorozinc(II)] dihydrate","","- C16 H30 Cl4 N6 O6 Zn2 -","- C16 H30 Cl4 N6 O6 Zn2 -","- C32 H60 Cl8 N12 O12 Zn4 -","2","0.5","CF6326","Yang, Shi-Ping; Chen, Hong-Mei; Zhang, Fan; Chen, Qiong Qiong; Yu, Xi-Bin","Bis{μ-<i>N</i>-[(1-methylimidazol-2-yl)methyl]-β-alanine}bis[dichlorozinc(II)] dihydrate","Acta Crystallographica Section E","2004","60","4","m465","m467","10.1107/S1600536804006610","","","0.71073","MoKα","","0.1494","0.0835","","","0.199","0.233","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203386","9.244","0.003","12.115","0.003","14.2116","0.0019","90","","95.78","0.02","90","","1583.5","0.7","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","2-[(2-ethoxy-3,4-dioxocyclobut-1-en-1-yl)amino]-3-phenylpropaneamide","2-[(2-ethoxy-3,4-dioxocyclobut-1-en-1-yl)amino]-3-phenylpropaneamide","","- C15 H27 N2 O4.5 -","- C15 H17 N2 O4.5 -","- C60 H68 N8 O18 -","4","2","CF6327","Kolev, Tsonko; Petrova, Rosica; Spiteller, Michael","(<i>R</i>)-2-[(2-Ethoxy-3,4-dioxocyclobut-1-en-1-yl)amino]-3-phenylpropanamide hemihydrate","Acta Crystallographica Section E","2004","60","4","o634","o636","10.1107/S1600536804006361","","","0.71073","MoKα","","0.106","0.0416","","","0.1033","0.1336","","","","","","0.888","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203387","15.7919","0.0002","14.3952","0.0002","17.9788","0.0002","90","","90.7217","0.0006","90","","4086.75","0.09","200","","200","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C45 H35 Ir3 O7 W -","- C45 H35 Ir3 O7 W -","- C180 H140 Ir12 O28 W4 -","4","1","CF6329","Anthony C. Willis; Gulliver T. Dalton; Mark G. Humphrey","Heptacarbonylbis(μ~3~-η^2^-diphenylacetylene)(η^5^-pentamethylcyclopentadienyl)triiridiumtungsten","Acta Crystallographica Section E","2004","60","4","m458","m459","10.1107/S1600536804006439","","","0.71073","MoKα","","","0.022","","","","0.0246","","","","","","1.078","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2203388","20.0879","0.0013","11.1018","0.0007","23.756","0.0015","90","","107.055","0.001","90","","5064.9","0.6","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C40 H56 Cl12 Hg2 Ru4 -","- C40 H56 Cl12 Hg2 Ru4 -","- C160 H224 Cl48 Hg8 Ru16 -","4","0.5","CF6331","Lihua Liu; Qian-Feng Zhang; Wa-Hung Leung","Bis{tri-μ-chloro-bis[(η^6^-<i>p</i>-cymene)ruthenium(II)]} di-μ-chloro-bis[dichloromercurate(II)]","Acta Crystallographica Section E","2004","60","4","m506","m508","10.1107/S1600536804007214","","","0.71073","MoKα","","0.0386","0.0332","","","0.0807","0.0836","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203389","8.1768","0.0016","11.858","0.002","14.007","0.003","67.534","0.003","82.032","0.003","89.421","0.004","1241.6","0.4","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H30 B Cl3 F4 Rh2 -","- C20 H30 B Cl3 F4 Rh2 -","- C40 H60 B2 Cl6 F8 Rh4 -","2","1","CF6332","Lihua Liu; Qian-Feng Zhang; Wa-Hung Leung","Tri-μ-chloro-bis[(η^5^-pentamethylcyclopentadienyl)rhodium(III)] tetrafluoroborate","Acta Crystallographica Section E","2004","60","4","m509","m510","10.1107/S1600536804007226","","","0.71073","MoKα","","0.0732","0.0422","","","0.0752","0.084","","","","","","0.961","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203390","9.8702","0.0005","10.0063","0.0005","12.6434","0.0006","101.436","0.001","103.466","0.001","95.981","0.001","1175.37","0.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H4 F6 N2 O4 S -","- C8 H4 F6 N2 O4 S -","- C32 H16 F24 N8 O16 S4 -","4","2","CF6333","Xianghong Huang; Qian-Feng Zhang; Herman H. Y. Sung","2-(2,2,2-Trifluoroacetylamino)pyridin-3-yl trifluoromethanesulfonate","Acta Crystallographica Section E","2004","60","4","o708","o710","10.1107/S1600536804007317","","","0.71073","MoKα","","0.0371","0.032","","","0.0782","0.081","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203391","6.5683","0.0003","11.5851","0.0004","15.1189","0.0005","103.011","0.001","97.442","0.001","96.551","0.001","1099.2","0.07","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Indolyl(triphenylphosphine)gold(I)","","- C25 H20 Au N2 P -","- C25 H20 Au N2 P -","- C50 H40 Au2 N4 P2 -","2","1","CF6334","Li, Dan; Tao, Wu; Ng, Seik Weng","Benzimidaxolyl(triphenylphosphine)gold(I)","Acta Crystallographica Section E","2004","60","4","m399","m400","10.1107/S1600536804005471","","","0.71073","MoKα","","0.044","0.04","","","0.105","0.108","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203392","17.698","0.007","4.475","0.002","12.084","0.005","90","","101.353","0.006","90","","938.3","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,4-methylenedioxybenzaldehyde semicarbazone","","- C9 H9 N3 O3 -","- C9 H9 N3 O3 -","- C36 H36 N12 O12 -","4","1","CF6335","Wang, Jin-Ling; Jia, Yong-Jin; Yu, Ming","The Schiff base 3,4-methylenedioxybenzaldehyde semicarbazone","Acta Crystallographica Section E","2004","60","4","o662","o663","10.1107/S1600536804006634","","","0.71073","MoKα","","0.0732","0.0406","","","0.0879","0.1009","","","","","","1.029","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203393","9.1773","0.0006","12.8141","0.0008","16.377","0.001","96.216","0.001","105.78","0.001","99.425","0.001","1804.5","0.2","163","2","163","2","","","","","","","","6","P -1","-P 1","2","","Aquabis(tetrahydrofuran)hexakis(trifluoroacetato)oxocopper(II)diiron(III)","","- C20 H18 Cu F18 Fe2 O16 -","- C20 H18 Cu0.999 F18 Fe2.001 O16 -","- C40 H36 Cu1.998 F36 Fe4.002 O32 -","2","1","CF6337","Amini, Mostafa M.; Yadavi, Marzieh; Ng, Seik Weng","Aquabis(tetrahydrofuran)hexakis(trifluoroacetato)(μ~3~-oxo)copper(II)diiron(III)","Acta Crystallographica Section E","2004","60","4","m492","m494","10.1107/S1600536804006762","","","0.71073","MoKα","","0.0537","0.0386","","","0.0989","0.1093","","","","","","1.004","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2203394","9.22","0.0006","12.8671","0.0009","16.448","0.001","96.233","0.001","105.756","0.001","99.401","0.001","1828.6","0.2","163","2","163","2","","","","","","","","6","P -1","-P 1","2","","Aquabis(tetrahydrofuran)hexakis(trifluoroacetato)oxozinc(II)diiron(III)","","- C20 H18 F18 Fe2 O16 Zn -","- C20 H18 F18 Fe2.001 O16 Zn0.999 -","- C40 H36 F36 Fe4.002 O32 Zn1.998 -","2","1","CF6338","Amini, Mostafa M.; Yadavi, Marzieh; Ng, Seik Weng","Aquabis(tetrahydrofuran)hexakis(trifluoroacetato)(μ~3~-oxo)zinc(II)diiron(III)","Acta Crystallographica Section E","2004","60","4","m495","m497","10.1107/S1600536804006774","","","0.71073","MoKα","","0.057","0.042","","","0.108","0.119","","","","","","1.031","","","","has coordinates,has disorder","203561","2020-10-21","18:00:00",""
"2203395","34.243","0.002","5.3251","0.0004","18.1469","0.0012","90","","114.83","0.002","90","","3003.1","0.4","105","2","105","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C12 H25.83 N2 O3.91 -","- C12 H25.826 N2 O3.913 -","- C96 H206.608 N16 O31.304 -","8","2","CF6339","Görbitz, Carl Henrik","Nanotubes of <small>L</small>-isoleucyl-<small>L</small>-leucine 0.91-hydrate","Acta Crystallographica Section E","2004","60","4","o626","o628","10.1107/S1600536804006427","","","0.71073","MoKα","","0.0476","0.0383","","","0.0897","0.095","","","","","","1.039","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203396","7.295","0.002","13.117","0.003","8.793","0.002","90","","92.228","0.005","90","","840.8","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","vinamidinium salt derivative","1-Dimethylamino-3-dimethyliminio-2-(p-methoxyphenyl)prop-1-ene perchlorate","","- C14 H21 Cl N2 O5 -","- C14 H21 Cl N2 O5 -","- C28 H42 Cl2 N4 O10 -","2","1","CI6331","Girija, C. R.; Noor Shahina Begum","1-Dimethylamino-3-dimethyliminio-2-(<i>p</i>-methoxyphenyl)prop-1-ene perchlorate","Acta Crystallographica Section E","2004","60","4","o535","o536","10.1107/S1600536804004593","","","0.71073","MoKa","","0.0522","0.0431","","","0.1073","0.1126","","","","","","1.075","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203397","11.3858","0.0018","7.7718","0.0014","18.194","0.003","90","","104.374","0.012","90","","1559.6","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","1-arylated vinamidinium salt.","1-Dimethylamino-3-dimethylimino-1-phenylprop-1-ene perchlorate","","- C13 H19 Cl N2 O4 -","- C13 H19 Cl N2 O4 -","- C52 H76 Cl4 N8 O16 -","4","1","CI6342","Girija, C. R.; Noor Shahina Begum; Sridhar, M. A.; Lokanath, N. K.; Prasad, J. S.","1-Dimethylamino-3-dimethylimino-1-phenylprop-1-ene perchlorate","Acta Crystallographica Section E","2004","60","4","o586","o588","10.1107/S1600536804005173","","","0.71069","MoKα","","0.0851","0.057","","","0.1803","0.2039","","","","","","1.045","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203398","11.601","0.003","12.409","0.002","12.664","0.004","90","","115.501","0.018","90","","1645.5","0.8","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","1-Dimethylamino-3-dimethyliminio-1-(p-methylphenyl)prop-1-ene perchlorate","","- C14 H21 Cl N2 O4 -","- C14 H21 Cl N2 O4 -","- C56 H84 Cl4 N8 O16 -","4","1","CI6343","Girija, C. R.; Noor Shahina Begum; Sridhar, M. A.; Lokanath, N. K.; Prasad, J. S.","1-Dimethylamino-3-dimethyliminio-1-(<i>p</i>-methylphenyl)prop-1-ene perchlorate","Acta Crystallographica Section E","2004","60","4","o589","o591","10.1107/S1600536804005574","","","0.71069","MoKa","","0.1243","0.0751","","","0.2207","0.2718","","","","","","1.083","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203399","8.239","0.003","12.399","0.002","16.152","0.003","90","","93.1","0.02","90","","1647.6","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-Dimethylamino-3-dimethyliminio-1-(p-methoxyphenyl)prop-1-ene perchlorate","","- C14 H21 Cl N2 O5 -","- C14 H21 Cl N2 O5 -","- C56 H84 Cl4 N8 O20 -","4","1","CI6344","Girija, C. R.; Noor Shahina Begum; Sridhar, M. A.; Lokanath, N. K.; Prasad, J. S.","1-Dimethylamino-3-dimethyliminio-1-(<i>p</i>-methoxyphenyl)prop-1-ene perchlorate","Acta Crystallographica Section E","2004","60","4","o592","o594","10.1107/S1600536804005586","","","0.71069","MoKa","","0.0607","0.0497","","","0.1391","0.1481","","","","","","1.062","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203400","22.56","0.008","5.4253","0.0019","15.057","0.005","90","","109.886","0.006","90","","1733","1","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","N-Amino-N-(2,3,4-tri-O-acetyl-β-D-xylopyranosyl)thiocarbamide","","- C12 H19 N3 O7 S -","- C12 H19 N3 O7 S -","- C48 H76 N12 O28 S4 -","4","1","CI6345","Bo Yang; Shu-Sheng Zhang; Yang-Fang Wang; Xue-Mei Li; Kui Jiao","<i>N</i>-Amino-<i>N</i>-(2,3,4-tri-<i>O</i>-acetyl-β-<small>D</small>-xylopyranosyl)thiocarbamide","Acta Crystallographica Section E","2004","60","4","o568","o570","10.1107/S1600536804005641","","","0.71073","MoKα","","0.0804","0.052","","","0.1056","0.1334","","","","","","1.119","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203401","18.777","0.0008","23.3593","0.0013","30.4231","0.0016","90","","90","","90","","13344.1","1.2","293","2","293","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","Poly[[dicopper(I)-tri-μ-4,4'-bipyridyl] diperchlorate dihydrate]","","- C30 H28 Cl2 Cu2 N6 O10 -","- C30 H28 Cl2 Cu2 N6 O10 -","- C480 H448 Cl32 Cu32 N96 O160 -","16","0.5","CI6346","Jian Zhang; Yao Kang; Yi-Hang Wen; Zhao-Ji Li; Ye-Yan Qin; Jian-Kai Cheng; Yuan-Gen Yao","Poly[[dicopper(I)-tri-μ-4,4'-bipyridyl] diperchlorate dihydrate]","Acta Crystallographica Section E","2004","60","4","m504","m505","10.1107/S160053680400546X","","","0.71073","MoKα","","","0.0533","","","0.1396","0.1689","","","","","","1.004","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203402","10.7688","0.0006","10.8408","0.0006","13.3473","0.0007","89.032","0.001","66.477","0.001","88.276","0.001","1428.04","0.14","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Dichloro-bis(1,10-phenanthroline)manganese(II) salicylaldoxime","","- C31 H23 Cl2 Mn N5 O2 -","- C31 H23 Cl2 Mn N5 O2 -","- C62 H46 Cl4 Mn2 N10 O4 -","2","1","CI6347","E Yang; Jian Zhang; Yu-Biao Chen; Yao Kang; Ye-Yan Qin; Zhaoji Li; Jian-Kai Cheng; Rui-Feng Hu; Yi-Hang Wen; Yuan-Gen Yao","Dichlorobis(1,10-phenanthroline)manganese(II)‒salicylaldoxime (1/1)","Acta Crystallographica Section E","2004","60","4","m390","m391","10.1107/S1600536804005185","","","0.71073","MoKα","","","0.0473","","","0.105","0.1169","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203403","20.2331","0.0014","17.2635","0.001","18.3682","0.0011","90","","100.117","0.005","90","","6316.1","0.7","150","2","150","2","","","","","","","","5","C 1 c 1","C -2yc","9","","Hydridotetrakis(triphenylphosphite)cobalt(I)","","- C72 H61 Co O12 P4 -","- C72 H61 Co O12 P4 -","- C288 H244 Co4 O48 P16 -","4","1","CI6351","Jonathan D Crane; Nigel Young","Hydridotetrakis(triphenylphosphito)cobalt(I)","Acta Crystallographica Section E","2004","60","4","m487","m488","10.1107/S1600536804007093","","","0.71073","MoKα","","0.0598","0.0361","","","0.0648","0.0688","","","","","","0.801","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203404","9.181","0.005","17.803","0.005","9.231","0.005","90","","108.882","0.005","90","","1427.6","1.2","100","","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-Benzyl-4-(4-chlorophenyl)-1H-1,2,4-triazole-5(4H)-thione","","- C15 H12 Cl N3 S -","- C15 H12 Cl N3 S -","- C60 H48 Cl4 N12 S4 -","4","1","CI6352","Sema Öztürk; Mehmet Akkurt; Ahmet Cansız; Metin Koparır; Mehmet Şekerci; Frank W. Heinemann","3-Benzyl-4-(4-chlorophenyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2004","60","4","o642","o644","10.1107/S1600536804006828","","","0.71069","MoKα","","0.0765","0.0399","","","0.0654","0.0731","","","","","","1.013","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203405","27.219","0.007","8.081","0.002","20.601","0.005","90","","131.01","0.01","90","","3419.3","1.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[1-(3-bromobenzyl)-3-aminopyridinium] bis(maleonitriledithiolato)nickel(II)","","- C32 H24 Br2 N8 Ni S4 -","- C32 H24 Br2 N8 Ni S4 -","- C128 H96 Br8 N32 Ni4 S16 -","4","0.5","CV6272","Tian, Zheng-Fang; Li, Yi-Zhi; Meng, Qing-Jin; Dang, Dong-Bin","Bis[3-amino-1-(3-bromobenzyl)pyridinium] bis(maleonitriledithiolato)nickel(II)","Acta Crystallographica Section E","2004","60","4","m392","m393","10.1107/S1600536804005343","","","0.71073","MoKα","","0.0672","0.0507","","","0.1243","0.1309","","","","","","0.957","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2203406","8.8485","0.0011","8.9259","0.0007","12.9652","0.0015","70.074","0.009","81.597","0.01","75.041","0.008","928.16","0.18","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-Acetyl-5-(2-methoxyphenyl)-3-(2-methoxystyryl)-2-pyrazoline","","- C21 H22 N2 O3 -","- C21 H22 N2 O3 -","- C42 H44 N4 O6 -","2","1","CV6274","R.V.Krishnakumar; V.Vijayabaskar; S.Perumal; S.Selvaraj; S.Natarajan","1-Acetyl-5-(2-methoxyphenyl)-3-(2-methoxystyryl)-2-pyrazoline","Acta Crystallographica Section E","2004","60","4","o476","o478","10.1107/S1600536804004209","","","1.5418","CuKα","","0.0519","0.0457","","","0.1312","0.1388","","","","","","1.083","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203407","11.6618","0.0009","8.8584","0.0007","19.163","0.002","90","","90","","90","","1979.6","0.3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","anti-1-(Benzylamino)glyoxime","","- C9 H11 N3 O2 -","- C9 H11 N3 O2 -","- C72 H88 N24 O16 -","8","1","CV6275","Yavuz Köysal; Şamil Işık; Nursabah Sarıkavaklı; Fatih Erduran","<i>anti</i>-1-(Benzylamino)glyoxime","Acta Crystallographica Section E","2004","60","4","o515","o516","10.1107/S1600536804004799","","","0.71073","MoKα","","0.0733","0.0341","","","0.0776","0.0853","","","","","","0.799","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203408","8.6333","0.0009","27.515","0.003","7.9705","0.0009","90","","99.781","0.002","90","","1865.8","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dimethyl 3-benzoyl-7-(N,N-dimethylamino)indolizine-1,2-dicarboxylate","","- C21 H20 N2 O5 -","- C21 H20 N2 O5 -","- C84 H80 N8 O20 -","4","1","CV6276","Hema, R.; Parthasarathi, V.; Ravikumar, K.; Sarkunam, K.; Nallu, M.","Dimethyl 3-benzoyl-7-(<i>N,N</i>-dimethylamino)indolizine-1,2-dicarboxylate","Acta Crystallographica Section E","2004","60","4","o479","o480","10.1107/S1600536804004210","","","0.71073","MoKα","","0.059","0.0453","","","0.1234","0.1336","","","","","","1.029","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203409","8.05","0.005","16.942","0.011","17.094","0.011","118.555","0.01","95.033","0.012","97.082","0.011","2003","2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Dimethyl 7-(N,N-dimethylamino)3-(4-methylbenzoyl)indolizine-1,2-dicarboxylate","","- C22 H22 N2 O5 -","- C22 H22 N2 O5 -","- C88 H88 N8 O20 -","4","2","CV6277","Hema, R.; Parthasarathi, V.; Ravikumar, K.; Sarkunam, K.; Nallu, M.","Dimethyl 7-(<i>N</i>,<i>N</i>-dimethylamino)-3-(4-methylbenzoyl)indolizine-1,2-dicarboxylate","Acta Crystallographica Section E","2004","60","4","o537","o538","10.1107/S1600536804004805","","","0.71073","MoKα","","0.0914","0.0572","","","0.1367","0.1558","","","","","","1.026","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203410","11.251","0.002","6.0066","0.0012","15.148","0.003","90","","100.69","0.03","90","","1005.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Amino-3-(phenoxymethyl)-1H-1,2,4-triazole-5(4H)-thione","","- C9 H10 N4 O S -","- C9 H10 N4 O S -","- C36 H40 N16 O4 S4 -","4","1","CV6278","Zhang, Shu-Sheng; Meng, Xiang-Tao; Li, Xue-Mei; Wang, Wei","4-Amino-3-(phenoxymethyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2004","60","4","o595","o596","10.1107/S1600536804006075","","","0.71073","MoKα","","0.0433","0.0367","","","0.0948","0.102","","","","","","1.085","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203411","10.041","0.005","9.389","0.005","11.45","0.006","90","","90","","90","","1079.4","1","273","2","273","2","","","","","","","","5","P n a 21","P 2c -2n","33","","N-Benzoyl-N'-ethylthiourea","","- C10 H12 N2 O S -","- C10 H12 N2 O S -","- C40 H48 N8 O4 S4 -","4","1","CV6279","Yamin, Bohari M.; Kassim, Mohammad; Yusof, M. Sukeri M.; Shah, Nabihah M.","<i>N</i>-Benzoyl-<i>N</i>'-ethylthiourea","Acta Crystallographica Section E","2004","60","4","o556","o557","10.1107/S1600536804005355","","","0.71073","MoKα","","0.077","0.064","","","0.15","0.159","","","","","","1.1","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203412","9.552","0.003","8.028","0.002","22.715","0.007","90","","90","","90","","1741.9","0.9","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","N-p-chlorophenyl acrylamide","N-(4-chlorophenyl)-acrylamide","","- C9 H8 Cl N O -","- C9 H8 Cl N O -","- C72 H64 Cl8 N8 O8 -","8","1","CV6280","Huo, Fang-Jun; Wu, Wei-Wei; Yin, Cai-Xia; Guo, Wei; Xia, Chi-Zhong; Yang, Pin","<i>N</i>-(4-Chlorophenyl)acrylamide","Acta Crystallographica Section E","2004","60","4","o629","o630","10.1107/S1600536804006233","","","0.71073","MoKα","","0.0561","0.0467","","","0.1183","0.1259","","","","","","1.098","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203413","5.7601","0.0011","8.962","0.0019","22.983","0.004","90","","90","","90","","1186.4","0.4","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","N-benzyl-2-methyl-3-thiofuramide","N-benzyl-2-methyl-3-furanthiocarboxanilide","","- C13 H13 N O S -","- C13 H13 N O S -","- C52 H52 N4 O4 S4 -","4","1","CV6281","Pavlović, Gordana; Tralić-Kulenović, Vesna; Popović, Zora","<i>N</i>-Benzyl-2-methylfuran-3-thiocarboxanilide","Acta Crystallographica Section E","2004","60","4","o637","o639","10.1107/S1600536804006324","","","0.71073","MoKα","","0.0508","0.0479","","","0.1116","0.1139","","","","","","1.099","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2203414","8.527","0.003","16.174","0.005","8.753","0.003","90","","100.878","0.006","90","","1185.5","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 Cl N3 O4 -","- C10 H10 Cl N3 O4 -","- C40 H40 Cl4 N12 O16 -","4","1","CV6283","Ya-Mei Guo; Zhi-Gang Geng; Xia Feng","2-(2-Pyridylamino)pyridinium perchlorate displaying a one-dimensional hydrogen-bonding supramolecular chain","Acta Crystallographica Section E","2004","60","4","o645","o646","10.1107/S1600536804006300","","","0.71073","MoKα","","0.1308","0.0695","","","0.1641","0.1995","","","","","","1.017","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2203415","7.5238","0.0002","10.2817","0.0002","13.8084","0.0002","69.467","0.001","79.837","0.001","77.741","0.001","971.42","0.04","160","2","160","2","","","","","","","","5","P -1","-P 1","2","","dimethyl 3-(4-bromobenzoyl)-7-(dimethylamino)indolizine-1,2-dicarboxylate","","- C21 H19 Br N2 O5 -","- C21 H19 Br N2 O5 -","- C42 H38 Br2 N4 O10 -","2","1","CV6286","Hema, R.; Parthasarathi, V.; Sarkunam, K.; Nallu, M.; Linden, Anthony","Dimethyl 3-(4-bromobenzoyl)-7-(<i>N</i>,<i>N</i>-dimethylamino)indolizine-1,2-dicarboxylate","Acta Crystallographica Section E","2004","60","4","o699","o700","10.1107/S1600536804006993","","","0.71073","MoKα","","0.0521","0.0383","","","0.0932","0.1005","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203416","5.0473","0.00001","25.1504","0.0005","41.4912","0.0009","90","","90","","90","","5266.96","0.16","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1'S,2R,3S,4S)-Ethyl 2-hydroxy-4-methyl-3-(1'-phenylethylcarbamoyl)hexanoate","","- C18 H27 N O4 -","- C18 H27 N O4 -","- C216 H324 N12 O48 -","12","3","CV6287","Larionov, Oleg I.; Meijere, Armin de; Yufit, Dmitry S.; Howard, Judith A. K.","(1'<i>S</i>,2<i>R</i>,3<i>S</i>,4<i>S</i>)-Ethyl 2-hydroxy-4-methyl-3-(1'-phenylethylcarbamoyl)hexanoate","Acta Crystallographica Section E","2004","60","4","o681","o683","10.1107/S1600536804006737","","","0.71073","MoKα","","0.0566","0.0499","","","0.1229","0.1261","","","","","","1.152","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203417","8.6329","0.0012","8.0641","0.0011","22.621","0.003","90","","99.92","0.003","90","","1551.3","0.4","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Hydroxyacetophenone 3-hydroxy-2-naphthoylhydrazone","","- C19 H16 N2 O3 -","- C19 H16 N2 O3 -","- C76 H64 N8 O12 -","4","1","CV6290","Wan-Yi Liu; Yi-Zhi Li","2-Hydroxyacetophenone 3-hydroxy-2-naphthoylhydrazone","Acta Crystallographica Section E","2004","60","4","o694","o695","10.1107/S1600536804007123","","","0.71073","MoKα","","0.0751","0.0541","","","0.1279","0.1374","","","","","","1.024","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203418","11.5067","0.0003","13.1916","0.0003","9.1773","0.0002","90","","95.621","0.0009","90","","1386.34","0.06","160","2","160","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-[(7-Acetoxy-4-methylcoumarin-8-yl)methyl]sydnone","","- C15 H12 N2 O6 -","- C15 H12 N2 O6 -","- C60 H48 N8 O24 -","4","1","CV6291","Thamotharan, S.; Parthasarathi, V.; Mallur, Shanta, G.; Kamble, Ravindra, R.; Badami, Bharati; Linden, Anthony","3-[(7-Acetoxy-4-methylcoumarin-8-yl)methyl]sydnone","Acta Crystallographica Section E","2004","60","4","o701","o702","10.1107/S1600536804007135","","","0.71073","MoKα","","0.1033","0.0524","","","0.1278","0.1507","","","","","","1.016","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203419","9.077","0.004","21.777","0.005","10.19","0.01","90","","107.02","0.06","90","","1926","2","293.2","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H31 N O6 -","- C16 H31 N O6 -","- C64 H124 N4 O24 -","4","1","DN6121","Dagoneau Christelle; Jean-Noël Denis; Christian Philouze; Marie-Thérèse Averbuch-Pouchot; Yannick Vallée","(2S<i>R</i>,3S<i>R</i>,4<i>RS</i>)-<i>tert</i>-Butyl 2,3-dihydroxy 4-(<i>tert</i>-butoxycarbonyl)aminohexanoate","Acta Crystallographica Section E","2004","60","4","o510","o512","10.1107/S1600536804004520","","","0.7107","MoKα","","0.0464","0.0464","","0.0664","","0.0664","","","1.686","","","1.686","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203420","9.1356","0.0016","15.359","0.003","15.082","0.003","90","","92.652","0.004","90","","2113.9","0.7","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Rotenone‒acetic acid (2/1)","","- C48 H48 O14 -","- C48 H48 O14 -","- C96 H96 O28 -","2","1","DN6123","Yang, Shi-Ping; Chen, Hong-Mei; Znang, Fan; Chen, Qiong Qiong; Yu, Xi-Bin; Huang, Ji-Guang; Xu, Han-Hong","Rotenone‒acetic acid (2/1)","Acta Crystallographica Section E","2004","60","4","o532","o534","10.1107/S1600536804004817","","","0.71073","MoKα","","0.0993","0.06","","","0.1289","0.1462","","","","","","0.953","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203421","13.1635","0.0011","12.1355","0.0007","18.0309","0.0016","90","","106.665","0.007","90","","2759.4","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tris(1,1,5,5-tetramethyl-2-thiobiuretato)cobalt(III)","","- C18 H36 Co N9 O3 S3 -","- C18 H36 Co N9 O3 S3 -","- C72 H144 Co4 N36 O12 S12 -","4","1","DN6127","Jonathan D Crane; Matthew Whittingham","Tris(1,1,5,5-tetramethyl-2-thiobiuretato)cobalt(III)","Acta Crystallographica Section E","2004","60","4","m350","m351","10.1107/S1600536804004696","","","0.71073","MoKα","","0.0643","0.0328","","","0.0652","0.0696","","","","","","0.803","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203422","8.5418","0.0006","11.1878","0.0008","11.6189","0.0007","66.625","0.006","69.332","0.006","73.642","0.006","940.57","0.12","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Di-μ-chloro-bis{[N,N-bis(3,5-dimethylpyrazol-1-ylmethyl)-1- hydroxyethanamine]copper(II)} dichloride dihydrate","","- C28 H50 Cl4 Cu2 N10 O4 -","- C28 H50 Cl4 Cu2 N10 O4 -","- C28 H50 Cl4 Cu2 N10 O4 -","1","0.5","DN6128","El Kodadi, Mohamed; Fouad, Malek; Ramdani, Abdelkrim; Eddike, Driss; Tillard, Monique; Belin, Claude","Di-μ-chloro-bis{[<i>N</i>,<i>N</i>-bis(3,5-dimethylpyrazol-1-ylmethyl)-1-hydroxyethanamine]copper(II)} dichloride dihydrate","Acta Crystallographica Section E","2004","60","4","m426","m428","10.1107/S1600536804005434","","","0.71073","MoKα","","0.0429","0.0377","","","0.104","0.1089","","","","","","1.099","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203423","9.9819","0.0002","22.3639","0.0004","8.415","0.0001","90","","90","","90","","1878.52","0.06","296","1","","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C22 H20 N2 O3 -","- C22 H20 N2 O3 -","- C88 H80 N8 O12 -","4","1","DN6129","Weiming Xu; Xiu-Rong Hu; Jian-Ming Gu; Xian Huang","5-{2-[3-(4-Methoxyphenyl)-4,5-dihydroisoxazol-5-yl]vinyl}-3-<i>p</i>-tolylisoxazole","Acta Crystallographica Section E","2004","60","4","o676","o677","10.1107/S1600536804006269","","","0.7107","MoKα","","","0.048","","","","0.113","","","","","","1.006","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203424","8.8285","0.0017","20.225","0.003","14.638","0.003","90","","91.353","0.015","90","","2613","0.8","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dichlorotetrakis(tetrahydrofuran)aluminium trichloroethylaluminate","","- C18 H37 Al2 Cl5 O4 -","- C18 H37 Al2 Cl5 O4 -","- C72 H148 Al8 Cl20 O16 -","4","1","DN6130","Sluka, Radek; Nečas, Marek; Šindelář, Pavel","Dichlorotetrakis(tetrahydrofuran)aluminium trichloroethylaluminate","Acta Crystallographica Section E","2004","60","4","m447","m448","10.1107/S1600536804006312","","","0.71073","MoKα","","0.0421","0.0358","","","0.0918","0.0956","","","","","","1.091","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203425","13.502","0.0016","8.4577","0.001","10.1886","0.0012","90","","104.949","0.002","90","","1124.1","0.2","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Tricarbonyliodo(η^5^-methylcyclopentadienyl)tungsten","","- C9 H7 I O3 W -","- C9 H7 I O3 W -","- C36 H28 I4 O12 W4 -","4","0.5","DN6132","Billing, David G.; Coville, Neil J.; Lesia, Joyce; Muhammad D. Bala","Tricarbonyliodo(η^5^-methylcyclopentadienyl)tungsten","Acta Crystallographica Section E","2004","60","4","m477","m478","10.1107/S160053680400635X","","","0.71073","MoKα","","0.0233","0.02","","","0.0463","0.0474","","","","","","1.063","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203426","9.8292","0.0007","16.631","0.001","11.5822","0.0008","90","","109.52","0.01","90","","1784.5","0.2","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Cyclopentyl{2-[(2,6-diisopropylphenyl)amino]-4-[(2,6- diisopropylphenyl)imino]pent-2-enato-κ^2^N,N'}(tetrahydrofuran- κO)magnesium(II)","","- C38 H58 Mg N2 O -","- C38 H58 Mg N2 O -","- C76 H116 Mg2 N4 O2 -","2","1","FL6073","Katherine H. D. Ballem; Kevin M. Smith; Brian O. Patrick","Cyclopentyl{2-[(2,6-diisopropylphenyl)amino]-4-[(2,6-diisopropylphenyl)imino]pent-2-enato-κ^2^<i>N</i>,<i>N</i>'}(tetrahydrofuran-κ<i>O</i>)magnesium(II)","Acta Crystallographica Section E","2004","60","4","m408","m409","10.1107/S1600536804005148","","","0.71073","MoKα","","0.0674","0.0508","","","0.1159","0.1218","","","","","","0.968","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203427","11.427","0.001","12.947","0.001","20.752","0.002","90","","90","","90","","3070.2","0.5","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","[1,2-bis(diphenylphosphino)ethane](2,3-quionoxalinedithiolato)nickel","","- C34 H28 N2 Ni P2 S2 -","- C34 H28 N2 Ni P2 S2 -","- C136 H112 N8 Ni4 P8 S8 -","4","1","FL6084","Ni, Chun-Lin; Li, Yi-Zhi; Ni, Zhao-Ping; Dang, Dong-Bin; Meng, Qin-jing","[1,2-Bis(diphenylphosphino)ethane](2,3-quinoxalinedithiolato)nickel(II)","Acta Crystallographica Section E","2004","60","4","m410","m412","10.1107/S1600536804005999","","","0.71073","MoKα","","0.0615","0.0553","","","0.1526","0.1564","","","","","","1.071","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203428","11.9318","0.0018","14.152","0.002","9.0323","0.0014","90","","90","","90","","1525.2","0.4","100","2","100","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","1,3-Bis(2'-carboxyphenylamine)propane","2,2'-(Propane-1,3-diimino)dibenzoic acid","","- C17 H18 N2 O4 -","- C17 H18 N2 O4 -","- C68 H72 N8 O16 -","4","0.5","FL6087","Rabile, M. Mohamed; Huang, Huan; Ghosh, Dipesh; Van Horn, J. David; Powell, Doug R.","2,2'-(Propane-1,3-diimino)dibenzoic acid","Acta Crystallographica Section E","2004","60","4","o494","o496","10.1107/S1600536804004398","","","0.71073","MoKα","","0.0443","0.0416","","","0.1151","0.1179","","","","","","1.016","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203429","8.426","0.002","12.011","0.003","15.671","0.003","90","","90","","90","","1586","0.6","100","2","100","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","dipotassium rhodizonate","","- C6 K2 O6 -","- C6 K2 O6 -","- C48 K16 O48 -","8","0.25","FL6088","Cowan, John A.; Howard, J.A.K.","Dipotassium rhodizonate","Acta Crystallographica Section E","2004","60","4","m511","m513","10.1107/S160053680400529X","","","0.71073","MoKα","","0.0459","0.038","","","0.0891","0.0928","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203430","17.081","0.003","11.298","0.002","24.554","0.004","90","","108.625","0.002","90","","4490.3","1.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Chlorobis(1,10-phenanthroline)copper(II) perchlorate hemihydrate","Chlorobis(1,10-phenanthroline)copper(II) perchlorate hemihydrate","","- C24 H17 Cl2 Cu N4 O4.5 -","- C24 H17 Cl2 Cu N4 O4.5 -","- C192 H136 Cl16 Cu8 N32 O36 -","8","2","FL6089","Wei, Yibin; Yang, Pin","Chlorobis(1,10-phenanthroline)copper(II) perchlorate hemihydrate","Acta Crystallographica Section E","2004","60","4","m429","m431","10.1107/S1600536804005306","","","0.71073","MoKα","","0.1584","0.0942","","","0.1828","0.2104","","","","","","1.09","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203431","8.699","0.002","12.983","0.002","16.712","0.002","90","","90","","90","","1887.4","0.6","296","2","296","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","N-phenyl-2-furamide","N-phenylfuran-2-carboxamide","","- C11 H9 N O2 -","- C11 H9 N O2 -","- C88 H72 N8 O16 -","8","1","FL6090","Pavlović, Gordana; Tralić-Kulenović, Vesna; Popović, Zora","2-Furancarboxanilide","Acta Crystallographica Section E","2004","60","4","o631","o633","10.1107/S1600536804006245","","","0.71073","MoKα","","0.058","0.0504","","","0.1232","0.1295","","","","","","1.189","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2203432","6.1389","0.0002","7.2316","0.0002","33.9218","0.0014","90","","90","","90","","1505.93","0.09","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(5-methoxycarbonyl)pentyl α-D-mannopyranoside","","- C13 H24 O8 -","- C13 H24 O8 -","- C52 H96 O32 -","4","1","FL6092","Gainsford, Graeme J.; Luboradzki, Roman; Pakulski, Zbigniew","(5-Methoxycarbonyl)pentyl α-<small>D</small>-mannopyranoside","Acta Crystallographica Section E","2004","60","4","o666","o668","10.1107/S1600536804005987","","","0.71073","MoKα","","0.0577","0.0441","","","0.0803","0.0837","","","","","","1.123","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203433","6.876","0.0008","7.8033","0.0012","16.657","0.003","95.45","0.013","95.962","0.008","103.989","0.009","855.8","0.2","293","2","293","2","","","","","","","","6","P 1","P 1","1","","(1H-Benzotriazole-κN^3^)trichlorocobalt(III)‒1H-benzotriazole‒water (1/1/1)","","- C12 H12 Cl3 Co N6 O -","- C12 H12 Cl3 Co N6 O -","- C24 H24 Cl6 Co2 N12 O2 -","2","2","HB6013","Zhang, Ze-Feng; Li, Li-Xin; Wang, Xiao-Qing; Xie, Cheng-Zhi; Wang, Ru-Ji; Shen, Guang-Qiu","(1<i>H</i>-Benzotriazole-κ<i>N</i>^3^)trichlorocobalt(III)‒1<i>H</i>-benzotriazole‒water (1/1/1)","Acta Crystallographica Section E","2004","60","4","m498","m500","10.1107/S1600536804004982","","","0.71073","MoKα","","0.0325","0.0293","","","0.0619","0.0645","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203434","6.1505","0.0006","7.6367","0.0008","9.7197","0.001","95.0132","0.0015","99.9045","0.0015","110.281","0.0014","416.47","0.07","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","trans-Bis(3-amino-1,2,4-triazolium-κN^1^)dichlorocopper(II) tetrachlorocuprate(II) dihydrate","","- C4 H14 Cl6 Cu2 N8 O2 -","- C4 H14 Cl6 Cu2 N8 O2 -","- C4 H14 Cl6 Cu2 N8 O2 -","1","0.5","HB6014","Carlos Sánchez; Juan M. Salas; Miguel Quirós; M. Purificación Sánchez","trans-Bis(3-amino-1,2,4-triazolium-κN^1^)dichlorocopper(II) tetrachlorocuprate(II) dihydrate","Acta Crystallographica, Section E","2004","60","4","m370","m372","10.1107/S1600536804003812","","","0.71073","MoKα","","0.0184","0.0177","","","0.0457","0.0461","","","","","","1.083","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2203435","9.58","0.003","15.176","0.005","17.589","0.006","90","","105.021","0.004","90","","2469.8","1.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","cis-Bis(dicyanamido)bis(1,10-phenanthroline)nickel(II)","","- C28 H16 N10 Ni -","- C28 H16 N10 Ni -","- C112 H64 N40 Ni4 -","4","1","HB6020","A.-Qing Wu; Fa-Kun Zheng; Guo-Cong Guo; Jin-Shun Huang","<i>cis</i>-Bis(dicyanamido)bis(1,10-phenanthroline)nickel(II)","Acta Crystallographica Section E","2004","60","4","m373","m375","10.1107/S1600536804004921","","","0.71073","MoKα","","0.1182","0.0689","","","0.1367","0.1575","","","","","","1.087","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203436","9.655","0.001","10.859","0.001","11.384","0.001","88.695","0.002","79.453","0.002","88.84","0.002","1172.91","0.19","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","Bis{5-methyl-4-[(Z)-(1-naphthylamino)phenylmethylene]-2-phenyl-3H-pyrazol- 3-one-κ^2^N,N'}silver(I) hexafluorophosphate","","- C54 H42 Ag F6 N6 O2 P -","- C54 H42 Ag F6 N6 O2 P -","- C54 H42 Ag F6 N6 O2 P -","1","0.5","HB6021","Lü, Xingqiang; Bao, Feng; Wu, Qing; Kang, Beisheng; Ng, Seik Weng","Bis{5-methyl-4-[(<i>Z</i>)-(1-naphthylamino)phenylmethylene]-2-phenyl-3<i>H</i>-pyrazol-3-one-κ^2^<i>N</i>,<i>N</i>'}silver(I) hexafluorophosphate","Acta Crystallographica Section E","2004","60","4","m362","m363","10.1107/S1600536804004660","","","0.71073","MoKα","","0.055","0.037","","","0.091","0.097","","","","","","0.91","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203437","13.1128","0.0008","6.9843","0.0004","15.3908","0.0009","90","","104.647","0.001","90","","1363.74","0.14","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-Poly[[bromatosilver(I)-μ-4,4'-bipyridine] 2.5-hydrate]","","- C10 H13 Ag Br N2 O5.5 -","- C10 H13 Ag Br N2 O5.5 -","- C40 H52 Ag4 Br4 N8 O22 -","4","1","HB6022","Chun-Xia Ren; Cheng, Li; Xiao-Ming Chen; Seik Weng Ng","<i>catena</i>-Poly[[bromatosilver(I)-μ-4,4'-bipyridine] 2.5-hydrate]","Acta Crystallographica Section E","2004","60","4","m364","m366","10.1107/S1600536804005082","","","0.71073","MoKα","","0.036","0.03","","","0.081","0.084","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2203438","9.3847","0.0007","9.4884","0.0006","9.6936","0.0005","62.15","0.004","81.987","0.004","87.868","0.003","755.36","0.09","167","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C10 H20 Cu N2 O11 -","- C10 H20 Cu N2 O11 -","- C20 H40 Cu2 N4 O22 -","2","1","HB6023","Keene, Tony D.; Hursthouse, Michael B.; Price, Daniel J.","1,4-Diazoniabicyclo[2.2.2]octane aquabis(oxalato-κ^2^<i>O</i>,<i>O</i>')copper(II) dihydrate","Acta Crystallographica Section E","2004","60","4","m378","m380","10.1107/S1600536804005033","","","0.71073","MoKα","","","0.04","","","","0.1033","","","","","","1.051","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2203439","8.7948","0.0002","12.9638","0.0004","13.9288","0.0004","88.187","0.002","89.525","0.002","75.21","0.002","1534.69","0.07","120","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H58 Co N5 O7 -","- C22 H58 Co N5 O7 -","- C44 H116 Co2 N10 O14 -","2","1","HB6024","Keene, Tony D.; Hursthouse, Michael B.; Price, Daniel J.","Tetra-<i>n</i>-butylamine(carbonato-κ^2^<i>O</i>,<i>O</i>')cobalt(III) <i>n</i>-butylcarbamate dihydrate","Acta Crystallographica Section E","2004","60","4","m381","m383","10.1107/S1600536804005070","","","0.71073","MoKα","","","0.0414","","","","0.1076","","","","","","1.029","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203440","8.648","0.004","8.994","0.009","7.294","0.003","97.98","0.05","107","0.03","64.4","0.05","489.2","0.6","297.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C20 H22 Cl2 Cu N2 O2 -","- C20 H22 Cl2 Cu N2 O2 -","- C20 H22 Cl2 Cu N2 O2 -","1","0.5","HB6025","Akitsu, Takashiro; Einaga, Yasuaki","Bis(5-chloro-<i>N</i>-isopropylsalicyldenaminato-κ^2^<i>N</i>,<i>O</i>)copper(II)","Acta Crystallographica Section E","2004","60","4","m436","m438","10.1107/S1600536804005938","","","0.7107","MoKα","","","0.0258","","","","0.1105","","","","","","0.974","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203441","7.2079","0.0009","7.3251","0.001","10.4032","0.0014","88.76","0.011","77.191","0.01","62.442","0.009","472.75","0.12","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","trans-Tetraaquabis(p-nitrobenzoxasulfamato)cobalt(II)","","- C12 H14 Co N4 O14 S2 -","- C12 H14 Co N4 O14 S2 -","- C12 H14 Co N4 O14 S2 -","1","0.5","HB6026","Kazak, Canan; Yazicilar, Turan K.; Yilmaz, Veysel T.","<i>trans</i>-Tetraaquabis(<i>p</i>-nitrobenzoxasulfamato)cobalt(II)","Acta Crystallographica Section E","2004","60","4","m452","m454","10.1107/S1600536804006336","","","0.71073","MoKα","","0.0382","0.0374","","","0.0995","0.1004","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203442","14.1356","0.0008","16.018","0.0009","16.4055","0.0009","90","","108.411","0.001","90","","3524.5","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Di-μ-2-aminopyridinato-bis[(2,2'-bipyridine)platinum(II)] dinitrate tetrahydrate","","- C30 H30 N10 O8 Pt2 -","- C30 H26 N10 O8 Pt2 -","- C120 H104 N40 O32 Pt8 -","4","1","HB6028","Mizota, Mina; Sakai, Ken","Di-μ-2-aminopyridinato-bis[(2,2'-bipyridine)platinum(II)] dinitrate tetrahydrate as a head-to-tail isomer","Acta Crystallographica Section E","2004","60","4","m473","m476","10.1107/S1600536804006877","","","0.71073","MoKα","","0.0929","0.051","","","0.1243","0.1353","","","","","","0.9","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203443","9.504","0.001","11.359","0.001","17.548","0.001","104.69","0.01","97.85","0.01","106.77","0.01","1709","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","14,16-Bis(ethoxycarbonyl)2,11-bis(4-tolylsulfonyl)-2,11-diaza[3.3](1,3)- benzeno(2,6)pyridino[2]phane","","- C35 H37 N3 O8 S2 -","- C35 H37 N3 O8 S2 -","- C70 H74 N6 O16 S4 -","2","1","HG6022","Boomgaarden, Wolfgang; Nieger, Martin","Diaza[3.3]benzenopyridino[2]phane","Acta Crystallographica Section E","2004","60","4","o523","o524","10.1107/S1600536804004751","","","1.54178","CuKα","","0.0598","0.0471","","","0.1209","0.1296","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203444","9.969","0.003","5.9346","0.0016","20.823","0.006","90","","102.025","0.005","90","","1204.9","0.6","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","anhydrous sodium naproxen","Sodium (S)-(+)-6-methoxy-α-methyl-2-naphthaleneacetate","","- C14 H13 Na O3 -","- C14 H13 Na O3 -","- C56 H52 Na4 O12 -","4","2","HG6023","Kim, Young-soo; VanDerveer, Don; Rousseau, Ronald W.; Wilkinson, Angus P.","Anhydrous sodium naproxen","Acta Crystallographica Section E","2004","60","4","m419","m420","10.1107/S1600536804005318","","","0.71073","MoKα","","0.0613","0.0495","","","0.1249","0.1306","","","","","","1.014","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2203445","11.694","0.001","23.256","0.001","18.805","0.001","90","","100.565","0.001","90","","5027.4","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(μ3-Oxo)-bis(μ2-chloro)-dichloro-octaphenyl-tetra-tin, methylene chloride solvate","","- C49 H42 Cl6 O2 Sn4 -","- C49 H42 Cl6 O2 Sn4 -","- C196 H168 Cl24 O8 Sn16 -","4","1","HG6024","Estudiante-Negrete, Fabiola; Morales-Morales, David; Toscano, Rubén A.","Di-μ~2~-chloro-dichlorodi-μ~3~-oxo-octaphenyltetratin dichloromethane solvate","Acta Crystallographica Section E","2004","60","4","m482","m484","10.1107/S1600536804006658","","","0.71073","MoKα","","0.0531","0.033","","","0.0542","0.057","","","","","","0.976","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2203446","8.492","0.0015","12.241","0.002","16.961","0.003","90","","90","","90","","1763.1","0.5","293","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H26 Cu N4 O6 -","- C15 H26 Cu N4 O6 -","- C60 H104 Cu4 N16 O24 -","4","1","HG6025","Choi, Sung-Nak; Park, Shin-Ae; Kim, Wan Cheol; Kang, Sung Kwon","[(‒)-α-Isosparteine]dinitratocopper(II)","Acta Crystallographica Section E","2004","60","4","m416","m418","10.1107/S160053680400618X","","","0.71073","MoKα","","","0.0548","","","","0.1288","","","","","","0.967","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203447","19.0275","0.001","9.8262","0.0005","17.4862","0.001","90","","118.486","0.001","90","","2873.6","0.3","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","fluroen-9-ylidene-(4-methoxy-phenyl)-amine","N-9H-fluoren-9-ylidene-N-(4-methoxyphenyl)amine","","- C20 H15 N O -","- C20 H15 N O -","- C160 H120 N8 O8 -","8","1","HG6026","Glagovich, Neil; Reed, Elizabeth; Crundwell, Guy; Updegraff III, James B.; Zeller, Matthias; Hunter, Allen D.","<i>N</i>-(9<i>H</i>-Fluoren-9-ylidene)-<i>N</i>-(4-methoxyphenyl)amine","Acta Crystallographica Section E","2004","60","4","o623","o625","10.1107/S1600536804005975","","","0.71073","MoKα","","0.0445","0.0423","","","0.1132","0.1152","","","","","","1.081","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203448","12.3892","0.0005","13.1262","0.0005","14.6675","0.0006","83.685","0.002","89.773","0.002","75.016","0.002","2289.45","0.16","293","2","","","","","","","","","","6","P -1","-P 1","2","","","","- C49 H54 Cl O7 P2 Rh -","- C49 H54 Cl O7 P2 Rh -","- C98 H108 Cl2 O14 P4 Rh2 -","2","1","HG6027","Meijboom, Reinout; Muller, Alfred; Roodt, Andreas","<i>trans</i>-Carbonylchlorobis[tris(2,6-dimethylphenyl)phosphito]rhodium(I)","Acta Crystallographica Section E","2004","60","4","m455","m457","10.1107/S1600536804006270","","","0.71073","MoKα","","","0.0436","","","","0.0929","","","","","","0.909","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203449","8.117","0.004","9.977","0.007","10.737","0.006","113.47","0.04","90.49","0.04","93.98","0.05","795","0.9","300","2","300","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H15 Br O4 -","- C17 H15 Br O4 -","- C34 H30 Br2 O8 -","2","1","HG6028","Mocerino, Mauro; Skelton, Brian W.; Stick, Robert V.; White, Allan H.","<i>trans</i>-5-(4-Bromobenzoyloxy)-2-phenyl-1,3-dioxane","Acta Crystallographica Section E","2004","60","4","o664","o665","10.1107/S160053680400666X","","","0.71073","MoKα","","0.118","0.054","","0.153","","0.099","","","1.174","","","1.174","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203450","9.632","0.004","11.612","0.004","12.777","0.005","66.97","0.03","85.63","0.03","79.87","0.03","1294.6","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Aquachlorobis(1,10-phenanthroline)cobalt(II) chloride dimethylformamide hemisolvate","","- C27 H25 Cl2 Co N5 O2 -","- C27 H25 Cl2 Co N5 O2 -","- C54 H50 Cl4 Co2 N10 O4 -","2","1","HG6031","Liu, Ji-Wei; Gao, Shan; Huo, Li-Hua; Ng, Seik Weng","Aquachlorobis(1,10-phenanthroline)cobalt(II) chloride dimethylformamide solvate","Acta Crystallographica Section E","2004","60","4","m501","m503","10.1107/S1600536804007263","","","0.71073","MoKα","","0.061","0.048","","","0.125","0.133","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203451","7.3664","0.001","8.2971","0.001","14.4141","0.0018","85.66","0.01","75.231","0.011","88.387","0.01","849.4","0.19","293","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H12 Br2 N4 Zn -","- C16 H12 Br2 N4 Zn -","- C32 H24 Br4 N8 Zn2 -","2","1","LH6161","Ömer Çelik; Íde, Semra; Kurt, Mustafa; Yurdakul, Şenay","Dibromobis(phthalazine-κ<i>N</i>^2^)zinc(II)","Acta Crystallographica Section E","2004","60","4","m424","m425","10.1107/S1600536804004908","","","0.71073","MoKα","","","0.0537","","","","0.1618","","","","","","0.957","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203452","17.565","0.005","5.682","0.0017","7.804","0.002","90","","97.622","0.006","90","","772","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,4-Bis(benzyloxy)benzene","","- C20 H18 O2 -","- C20 H18 O2 -","- C40 H36 O4 -","2","0.5","LH6174","Donghong He; Shihai Xu; Zhaoxun Lian; Xiangchao Zeng; Shuhao Guo; Xiaojian Liao","1,4-Bis(benzyloxy)benzene","Acta Crystallographica Section E","2004","60","4","o711","o712","10.1107/S1600536804007068","","","0.71069","MoKα","","0.0722","0.0423","","","0.105","0.1376","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203453","25.38","0.002","7.976","0.001","22.95","0.002","90","","97.82","0.01","90","","4602.6","0.8","293","","293","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C49 H50 Cl2 N4 Ni2 O4 S2 -","- C49 H50 Cl2 N4 Ni2 O4 S2 -","- C196 H200 Cl8 N16 Ni8 O16 S8 -","4","0.5","LH6176","Berkessel, Albrecht; Bolte, Michael","<i>rac</i>-Bis[μ-<i>N</i>-salicylidene-<i>N</i>'-(α-phenylsulfanylmethyl-2-oxidobenzyl)propylenediamine-<i>N</i>,<i>N</i>',<i>O</i>,<i>O</i>,<i>O</i>']nickel(II) dichloromethane solvate","Acta Crystallographica Section E","2004","60","4","m387","m389","10.1107/S1600536804004611","","","1.5418","CuKα","","0.1417","0.1268","","","0.3107","0.3327","","","","","","1.41","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203454","8.831","0.002","14.22","0.002","14.256","0.002","90","","103.1","0.01","90","","1743.6","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[1-(3-cyanobenzyl)-3-methylpyrazinium] bis(1,2-dicyanoethene-1,2-dithiolato)nickel(II)","","- C34 H24 N10 Ni S4 -","- C34 H24 N10 Ni S4 -","- C68 H48 N20 Ni2 S8 -","2","0.5","LH6177","Tian, Zheng-Fang; Li, Yi-Zhi; Meng, Qing-Jin; Liu, San-Hui; Ji, Xing-Xiang","Bis[1-(3-cyanobenzyl)-3-methylpyrazinium] bis(1,2-dicyanoethene-1,2-dithiolato)nickel(II)","Acta Crystallographica Section E","2004","60","4","m396","m398","10.1107/S1600536804005616","","","0.71073","MoKα","","0.0589","0.0549","","","0.1326","0.1333","","","","","","1.001","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203455","7.7487","0.0002","10.429","0.0003","11.2007","0.0003","71.8482","0.0013","76.9553","0.0017","75.3167","0.0017","821.34","0.04","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","Fluoren-9-one 4-toluenesulfonylhydrazone","","- C20 H16 N2 O2 S -","- C20 H16 N2 O2 S -","- C40 H32 N4 O4 S2 -","2","1","LH6178","Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Wardell, James L.","Fluoren-9-one 4-toluenesulfonylhydrazone: hydrogen-bonded <i>R</i>{_2^2}(8) dimers are linked into sheets by π‒π stacking interactions","Acta Crystallographica Section E","2004","60","4","o520","o522","10.1107/S1600536804004878","","","0.71073","MoKα","","0.0418","0.0355","","","0.0862","0.0897","","","","","","1.06","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203456","7.902","0.007","7.004","0.005","13.736","0.012","90","","102.38","0.08","90","","742.5","1.1","123","2","123","2","","","","","","","","4","P 1 21 1","P 2yb","4","","cis-3-phenyl-3,3a,4,5-tetrahydrobenzo[g]indazole-2-carboxamide","","- C18 H17 N3 O -","- C18 H17 N3 O -","- C36 H34 N6 O2 -","2","1","LH6179","Oloo, Eliud O.; Nienaber, Kurt; Quail, J. Wilson; Padmanilayam, Maniyan P.; Das, Umashankar; Dimmock, Jonathan R.","<i>cis</i>-3-Phenyl-3,3a,4,5-tetrahydrobenzo[<i>g</i>]indazole-2-carboxamide","Acta Crystallographica Section E","2004","60","4","o610","o612","10.1107/S1600536804005963","","","0.71073","MoKα","","0.0418","0.0312","","","0.0769","0.0816","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203457","6.87","0.003","8.333","0.004","12.707","0.005","78.567","0.007","78.991","0.007","79.361","0.007","691.7","0.5","150","2","","","","","","","","","","3","P -1","-P 1","2","","","","- C20 H14 O2 -","- C20 H14 O2 -","- C40 H28 O4 -","2","1","LH6180","Harry Adams; Isaac Ojea-Jimenez; Simon Jones","The Diels‒Alder adduct of <i>p</i>-benzoquinone and anthracene: 9,10-tetrahydro-9,10[1',2']benzenoanthracene-1',4'(2'<i>H</i>,3'<i>H</i>)-dione","Acta Crystallographica Section E","2004","60","4","o690","o691","10.1107/S160053680400707X","","","0.71073","MoKα","","","0.047","","","","0.1363","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203458","7.6362","0.0006","8.8697","0.0009","10.397","0.001","81.572","0.008","71.486","0.008","82.921","0.007","658.33","0.11","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C5 H4 Li N O3 S -","- C5 H4 Li N O3 S -","- C20 H16 Li4 N4 O12 S4 -","4","2","LH6181","A. van der Lee; M. Barboiu","Lithium pyridine-3-sulfonate","Acta Crystallographica Section E","2004","60","4","m421","m423","10.1107/S1600536804006191","","","0.71073","MoKα","","0.0718","0.0461","","0.0675","0.061","0.0675","","","","","","1.2145","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2203459","13.935","0.001","7.0123","0.0005","18.4739","0.0018","90","","90","","90","","1805.2","0.3","150","2","150","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Bis(1,1,5,5-tetramethyl-2-thiobiuretato)nickel(II)","","- C12 H24 N6 Ni O2 S2 -","- C12 H24 N6 Ni O2 S2 -","- C48 H96 N24 Ni4 O8 S8 -","4","0.5","LH6184","Jonathan D Crane; Matthew Whittingham","Bis(1,1,5,5-tetramethyl-2-thiobiuretato)nickel(II)","Acta Crystallographica Section E","2004","60","4","m449","m451","10.1107/S1600536804006294","","","0.71073","MoKα","","0.0536","0.0295","","","0.0556","0.0595","","","","","","0.874","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203460","26.179","0.009","5.8223","0.0017","7.169","0.003","90","","105.855","0.009","90","","1051.1","0.6","293","2","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,5-Bis(4-pyridyl)-1,3,4-thiadiazole","","- C12 H8 N4 S -","- C12 H8 N4 S -","- C48 H32 N16 S4 -","4","0.5","LH6185","Du, Miao; Zhao, Xiao-Jun; Li, Cheng-Peng","2,5-Bis(4-pyridyl)-1,3,4-thiadiazole","Acta Crystallographica Section E","2004","60","4","o706","o707","10.1107/S1600536804007202","","","0.71073","MoKα","","0.0625","0.0424","","","0.1202","0.1464","","","","","","1.193","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203461","12.486","0.002","13.196","0.0019","12.068","0.002","98.775","0.014","90.839","0.014","98.86","0.012","1940.2","0.5","295","2","295","2","","","","","","","","4","P -1","-P 1","2","icyclohexylaminium 4-nitroanthranilate","N-cyclohexylcyclohexanaminium 2-amino-4-nitrobenzoate","","- C19 H29 N3 O4 -","- C19 H29 N3 O4 -","- C76 H116 N12 O16 -","4","2","LH6187","Graham Smith; Urs D. Wermuth; Peter C. Healy","Dicyclohexylaminium 4-nitroanthranilate","Acta Crystallographica Section E","2004","60","4","o684","o686","10.1107/S1600536804006981","","","0.71069","MoKα","","0.0843","0.0422","","","0.1182","0.1505","","","","","","0.893","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203462","12.03","0.003","18.01","0.005","7.29","0.002","90","","90","","90","","1579.5","0.7","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","guanidinium 5-sulfosalicylate monohydrate","","","- C9 H18 N6 O7 S -","- C9 H18 N6 O7 S -","- C36 H72 N24 O28 S4 -","4","1","LH6188","Graham Smith; Urs D. Wermuth; Peter C. Healy","Bis(guanidinium) 5-sulfosalicylate monohydrate","Acta Crystallographica Section E","2004","60","4","o687","o689","10.1107/S1600536804007081","","","0.71069","MoKα","","0.0683","0.0461","","","0.1176","0.1395","","","","","","0.895","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203463","10.0738","0.0002","15.568","0.0003","20.3943","0.0003","90","","96.673","0.001","90","","3176.75","0.1","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C70 H74 Cl2 O4 Sn4 -","- C70 H74 Cl2 O4 Sn4 -","- C140 H148 Cl4 O8 Sn8 -","2","0.5","LH6189","Mohamed, E. Mothi; Panchanatheswaran, Krishnaswamy; Low, John N.; Glidewell, Christopher","Octabenzyldichlorodi-μ~2~-hydroxo-di-μ~3~-oxo-tetratin toluene disolvate","Acta Crystallographica Section E","2004","60","4","m489","m491","10.1107/S160053680400697X","","","0.71073","MoKα","","0.0595","0.0385","","","0.0806","0.0876","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203464","15.219","0.002","4.7796","0.0004","21.567","0.003","90","","103.9","0.012","90","","1522.9","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-p-Chlorobenzl-4-(p-florobenzylidenamino)-4,5-dihydro-1H-1,2,4- triazol-5-one","","- C16 H12 Cl F N4 O -","- C16 H12 Cl F N4 O -","- C64 H48 Cl4 F4 N16 O4 -","4","1","NA6265","Karakurt, Tuncay; Dinçer, Muharrem; Kahveci, Bahittin; Usta, Asu; Ağar, Erbil; Şaşmaz, Selami","3-(<i>p</i>-Chlorobenzyl)-4-(<i>p</i>-fluorobenzylideneamino)-4,5-dihydro-1<i>H</i>-1,2,4-triazol-5-one","Acta Crystallographica Section E","2004","60","4","o654","o655","10.1107/S1600536804006580","","","0.71073","MoKα","","0.1767","0.0496","","","0.0598","0.0753","","","","","","0.839","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203465","21.8863","0.0016","5.1411","0.0004","15.5619","0.0012","90","","132.601","0.005","90","","1288.9","0.2","293","","293","","","","","","","","","5","C 1 2 1","C 2y","5","","L-histidinium tetrafluorosuccinate","","- C10 H11 F4 N3 O6 -","- C10 H11 F4 N3 O6 -","- C40 H44 F16 N12 O24 -","4","1","NA6294","Akkurt, Mehmet; Öztürk, Sema; Ramajothi, Jayaraman; Büyükgüngör, Orhan; Dhanuskodi, Sivasubramanian","<small>L</small>-Histidinium tetrafluorosuccinate","Acta Crystallographica Section E","2004","60","4","o481","o483","10.1107/S1600536804004180","","","0.71073","MoKα","","0.0223","0.0215","","","0.0553","0.0557","","","","","","1.08","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203466","15.3005","0.0017","18.586","0.002","12.2311","0.0014","90","","125.509","0.002","90","","2831.4","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1-Aminocyclopentanecarboxamide","","- C6 H12 N2 O -","- C6 H12 N2 O -","- C96 H192 N32 O16 -","16","2","NA6295","Song, Qing Bao; Hu, You Hua; Shen, Tian Hua; Jin, Zhi Min","1-Aminocyclopentanecarboxamide","Acta Crystallographica Section E","2004","60","4","o539","o541","10.1107/S1600536804004556","","","0.71073","MoKα","","0.1404","0.0468","","","0.0725","0.106","","","","","","0.937","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203467","22.1158","0.0016","12.8114","0.0009","21.802","0.002","90","","90","","90","","6177.3","0.8","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","4,5-Bis(2-hydroxybenzoic acid methyl ester)phthalonitrile","Dimethyl 2,2'-(4,5-dimercapto-o-phenylenedioxy)dibenzoate","","- C24 H16 N2 O6 -","- C24 H16 N2 O6 -","- C288 H192 N24 O72 -","12","1.5","NA6298","Ocak, Nazan; Büyükgüngör, Orhan; Akdemir, Nesuhi; Ag̃ar, Erbil; Özil, Musa; Erdönmez, Ahmet","Dimethyl 2,2'-(4,5-dicyano-<i>o</i>-phenylenedioxy)dibenzoate","Acta Crystallographica Section E","2004","60","4","o505","o507","10.1107/S1600536804004386","","","0.71073","MoKα","","0.1192","0.0441","","","0.0985","0.1176","","","","","","0.803","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203468","25.1259","0.0019","9.9284","0.0008","7.5207","0.0004","90","","90","","90","","1876.1","0.2","294","2","294","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","2[2,2-Dimethyl[1,3,2]dithiagermetan-4-ylidene]malononitrile","","- C6 H6 Ge N2 S2 -","- C6 H6 Ge N2 S2 -","- C48 H48 Ge8 N16 S16 -","8","1","NA6299","Akkurt, Mehmet; Öztürk, Sema; Rıza, Kök Tevfik; Heinemann, Frank W.","2-(2,2-Dimethyl-1,3,2-dithiagermetan-4-ylidene)malononitrile","Acta Crystallographica Section E","2004","60","4","m357","m358","10.1107/S160053680400488X","","","0.71073","MoKα","","0.1148","0.0456","","","0.0629","0.0732","","","","","","1.045","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203469","24.069","0.003","6.1796","0.0004","19.788","0.002","90","","95.513","0.008","90","","2929.6","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Ethyl 4-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-ylmethyl)piperazine-1-carboxylate","","- C14 H20 N2 O5 -","- C14 H20 N2 O5 -","- C112 H160 N16 O40 -","8","1","NA6300","Ocak, Nazan; Işık, Şamil; Dilsiz Aytemir, Mutlu","Ethyl 4-(3-hydroxy-6-methyl-4-oxo-4<i>H</i>-pyran-2-ylmethyl)piperazine-1-carboxylate","Acta Crystallographica Section E","2004","60","4","o561","o563","10.1107/S1600536804005720","","","0.71073","MoKα","","0.056","0.0491","","","0.1553","0.1621","","","","","","1.099","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203470","8.8185","0.001","10.9462","0.0013","12.8297","0.0014","97.514","0.009","106.713","0.009","109.678","0.009","1080.7","0.2","293","","293","","","","","","","","","4","P -1","-P 1","2","","Dimethyl 5,5-dicyano-2-hydroxy-4,6-diphenylcyclohex-1-ene-1,3-dicarboxylate","","- C24 H20 N2 O5 -","- C24 H20 N2 O5 -","- C48 H40 N4 O10 -","2","1","NA6301","Mehmet Akkurt; Sema Öztürk; Edmont Stoyanov; Orhan Büyükgüngör; Dieter Heber","Dimethyl 5,5-dicyano-2-hydroxy-4,6-diphenylcyclohex-1-ene-1,3-dicarboxylate","Acta Crystallographica Section E","2004","60","4","o517","o519","10.1107/S160053680400491X","","","0.71073","MoKα","","0.0626","0.0367","","","0.0886","0.0956","","","","","","0.894","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203471","4.875","0.001","5.306","0.002","10.669","0.003","101.486","0.004","92.884","0.004","90.339","0.004","270.07","0.14","298","2","298","2","","","","","","","","5","P 1","P 1","1","4-Amino-3-(1,2,3,4,5-pentahydroxypentyl)-1,2,4-1H-triazole-5(4H)-thione","4-Amino-3-(1,2,3,4,5-pentahydroxylpentyl)-1,2,4-1H-triazol-5-thione","","- C7 H14 N4 O5 S -","- C7 H14 N4 O5 S -","- C7 H14 N4 O5 S -","1","1","NA6302","Zhang, Li-Xue; Zhang, An-Jiang; Lei, Xin-Xiang; Zou, Kai-Huang; Ng, Seik Weng","4-Amino-3-(1,2,3,4,5-pentahydroxypentyl)-1,2,4-1<i>H</i>-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2004","60","4","o613","o615","10.1107/S1600536804005732","","","0.71073","MoKα","","0.0611","0.0465","","","0.0869","0.0949","","","","","","0.995","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203472","7.481","0.001","10.453","0.002","12.123","0.002","90","","107.435","0.002","90","","904.5","0.3","298","2","298","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","Tetraaquabis(4-pyridylthioactetato)copper(II)","","- C14 H20 Cu N2 O8 S2 -","- C14 H20 Cu N2 O8 S2 -","- C28 H40 Cu2 N4 O16 S4 -","2","0.5","NA6303","Fang, Rui-Qin; Zhang, Xian-Ming; Wu, Hai-Shun; Ng^a^, Seik Weng","Tetraaquabis(4-pyridylthioacetato)copper(II)","Acta Crystallographica Section E","2004","60","4","m401","m402","10.1107/S1600536804005331","","","0.71073","MoKα","","0.0681","0.059","","","0.1811","0.1859","","","","","","1.196","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203473","7.4059","0.0017","12.973","0.002","15.184","0.003","89.167","0.017","78.006","0.016","80.22","0.016","1405.9","0.5","295","2","295","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H20 Cl2 N8 O2 S2 Zn -","- C24 H20 Cl2 N8 O2 S2 Zn -","- C48 H40 Cl4 N16 O4 S4 Zn2 -","2","1","NA6304","Zhi-Yong Wu; Duan-Jun Xu; Kai-Liang Yin","Dichlorobis(thiourea)zinc(II) bis(4,5-diazafluoren-9-one)","Acta Crystallographica Section E","2004","60","4","m514","m516","10.1107/S1600536804006403","","","0.71073","MoKα","","0.056","0.033","","","0.092","0.103","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203474","11.0956","0.0004","17.2715","0.0007","12.24","0.0005","90","","95.695","0.002","90","","2334.07","0.16","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[[aquazinc(II)]-μ-2,2'-dithiodibenzoato] bis(N,N-dimethylformamide)]","","- C20 H24 N2 O7 S2 Zn -","- C20 H24 N2 O7 S2 Zn -","- C80 H96 N8 O28 S8 Zn4 -","4","1","NA6305","Wang, Shun; Hu Mao-Lin; Chen, Fan","<i>catena</i>-Poly[[[aquazinc(II)]-μ-2,2'-dithiodibenzoato] bis(<i>N</i>,<i>N</i>-dimethylformamide)]","Acta Crystallographica Section E","2004","60","4","m413","m415","10.1107/S160053680400621X","","","0.71073","MoKα","","0.0678","0.0536","","","0.1184","0.1252","","","","","","1.077","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203475","12.0008","0.0011","27.4501","0.0016","12.068","0.003","90","","90","","90","","3975.5","1.1","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-(2,6-dichlorobenzylamino)-3-phenyl-5-p-tolyl-4H-1,2,4-triazole","","- C22 H18 Cl2 N4 -","- C22 H18 Cl2 N4 -","- C176 H144 Cl16 N32 -","8","1","NA6306","Dinçer, Muharrem; Özdemir, Namık; Bekircan, Olcay; Şaşmaz, Selami; Kolaylı, Sevgi; Karaoğlu, Şengül Alpay; Işık, Şamil","4-(2,6-Dichlorobenzylamino)-3-phenyl-5-<i>p</i>-tolyl-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2004","60","4","o651","o653","10.1107/S1600536804006452","","","0.71073","MoKα","","0.1642","0.0517","","","0.0844","0.0937","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203476","7.301","0.0004","11.0134","0.0007","29.823","0.002","90","","90","","90","","2398","0.3","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H18 Cl N O2 -","- C11 H18 Cl N O2 -","- C88 H144 Cl8 N8 O16 -","8","2","NA6307","Ton, Cuong; Bolte, Michael","Phase transition of 3-dimethylammonio-1-phenylpropan-1-one chloride monohydrate","Acta Crystallographica Section E","2004","60","4","o616","o617","10.1107/S1600536804006208","","","0.71073","MoKα","","0.0303","0.0261","","","0.065","0.0657","","","","","","0.905","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203477","8.568","0.001","10.352","0.001","12.44","0.002","103.73","0.01","102.42","0.01","100.16","0.01","1016.2","0.2","296","2","296","2","","","","","","","","7","P -1","-P 1","2","Bis(pyridine-2-carbaldehyde thiosemicarbazonato)cobalt(III) perchlorate","","","- C14 H14 Cl Co N8 O4 S2 -","- C14 H14 Cl Co N8 O4 S2 -","- C28 H28 Cl2 Co2 N16 O8 S4 -","2","1","NG6015","Wang, Heng-Shan; Huang, Ling; Chen, Zhen-Feng; Wang, Xian-Wen; Zhou, Jian; Shi, Shao-Ming; Liang, Hong; Yu, Kai-Bei","Bis(pyridine-2-carbaldehyde thiosemicarbazonato)cobalt(III) perchlorate","Acta Crystallographica Section E","2004","60","4","m354","m356","10.1107/S1600536804004763","","","0.71073","MoKα","","0.0473","0.035","","","0.0879","0.0916","","","","","","1.049","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203478","15.2773","0.0009","10.2049","0.0005","15.4099","0.0007","90","","90","","90","","2402.5","0.2","200.2","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C24 H24 Br2 Mn N4 -","- C24 H24 Br2 Mn N4 -","- C96 H96 Br8 Mn4 N16 -","4","0.5","OB6344","Jun Sakamoto; Naokazu Yoshikawa; Hiroshi Takashima; Keiichi Tsukahara; Nobuko Kanehisa; Yasushi Kai; Keiko Matsumura","<i>cis</i>-Dibromobis(4,4'-dimethyl-2,2'-bipyridine)manganese(II)","Acta Crystallographica Section E","2004","60","4","m352","m353","10.1107/S1600536804004234","","","0.7107","MoKα","","","0.0615","","","","0.1159","","","","","","1.339","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203479","10.7825","0.0007","13.8572","0.0009","14.5242","0.001","85.633","0.001","80.182","0.001","69.582","0.001","2003.7","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-chloro-bis[chloro(tricyclohexylphosphine-κP)mercury(II)]","","- C18 H33 Cl2 Hg P -","- C18 H33 Cl2 Hg P -","- C72 H132 Cl8 Hg4 P4 -","4","2","OB6350","Liu, Lihua; Zhang, Qian-Feng; Leung, Wa-Hung","Di-μ-chloro-bis[chloro(tricyclohexylphosphine-κ<i>P</i>)mercury(II)]","Acta Crystallographica Section E","2004","60","4","m394","m395","10.1107/S1600536804005288","","","0.71073","MoKα","","0.0347","0.0306","","","0.0726","0.0747","","","","","","1.044","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203480","30.764","0.014","4.922","0.002","26.335","0.013","90","","114.332","0.008","90","","3633","3","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","4-Bromo-N-(2-phenyl-1H-indol-7-yl)benzenesulfonamide","","- C20 H15 Br N2 O2 S -","- C20 H15 Br N2 O2 S -","- C160 H120 Br8 N16 O16 S8 -","8","1","OB6351","Huang, Xiang-Hong; Zhang, Qian-Feng; Sung, Herman H. Y.","4-Bromo-<i>N</i>-(2-phenyl-1<i>H</i>-indol-7-yl)benzenesulfonamide","Acta Crystallographica Section E","2004","60","4","o488","o489","10.1107/S1600536804004404","","","0.71073","MoKα","","0.0916","0.0427","","","0.0951","0.1075","","","","","","0.964","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203481","9.511","0.003","16.232","0.004","19.426","0.005","90","","90.6","0.004","90","","2998.9","1.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H44 Mn N10 O16 -","- C12 H44 Mn N10 O16 -","- C48 H176 Mn4 N40 O64 -","4","1","OB6357","Chopra, Deepak; Dagur, Pritesh; Prakash, A. S.; Guru Row, T. N.; Hegde, M. S.","Hexaaquamanganese(II) dinitrate bis(hexamethylenetetramine) tetrahydrate","Acta Crystallographica Section E","2004","60","4","m348","m349","10.1107/S1600536804004337","","","0.71073","MoKα","","0.0683","0.0464","","","0.1078","0.1181","","","","","","1.059","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2203482","19.0206","0.0005","4.8326","0.0001","19.3092","0.0008","90","","97.739","0.001","90","","1758.72","0.09","180","2","180","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","indomethacin methyl ester","Methyl [1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-ylmethyl]acetate","","- C20 H18 Cl N O4 -","- C20 H18 Cl N O4 -","- C80 H72 Cl4 N4 O16 -","4","1","OM6215","Trask, Andrew V.; Shan, Ning; Jones, William; Motherwell, W. D. Sam","Indomethacin methyl ester","Acta Crystallographica Section E","2004","60","4","o508","o509","10.1107/S1600536804004453","","","0.71073","MoKα","","0.0678","0.0474","","","0.1076","0.1173","","","","","","1.043","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203483","17.464","0.0009","9.471","0.0005","29.823","0.0019","90","","104.153","0.002","90","","4783","0.5","130","2","130","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","BPQ-10BT","3,3'-Didecyl-5,5'-bis(4-phenylquinolin-2-yl)-2,2'-bithienyl","","- C58 H64 N2 S2 -","- C58 H64 N2 S2 -","- C232 H256 N8 S8 -","4","1","OM6217","Benedict, Jason B.; Kaminsky, Werner; Tonzola, Christopher J.","3,3'-Didecyl-5,5'-bis(4-phenylquinolin-2-yl)-2,2'-bithienyl","Acta Crystallographica Section E","2004","60","4","o530","o531","10.1107/S1600536804005112","","","0.71073","MoKα","","0.2508","0.0665","","","0.1041","0.1508","","","","","","0.855","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203484","8.8701","0.0009","9.0664","0.0009","11.1751","0.0011","86.38","0.002","79.998","0.002","62.033","0.002","781.51","0.14","100","2","100","2","","","","","","","","5","P -1","-P 1","2","2,3-bis(5'-bromo-2'-thienyl)quinoxaline","2,3-bis(5-bromothien-2-yl)quinoxaline","","- C16 H8 Br2 N2 S2 -","- C16 H8 Br2 N2 S2 -","- C32 H16 Br4 N4 S4 -","2","1","OM6218","Crundwell, Guy; Linehan, Justin; Updegraff III, James B.; Zeller, Matthias; Hunter, Allen D.","2,3-Bis(5-bromothien-2-yl)quinoxaline","Acta Crystallographica Section E","2004","60","4","o656","o657","10.1107/S1600536804006816","","","0.71073","MoKα","","0.0522","0.0443","","","0.1141","0.119","","","","","","0.852","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203485","13.4996","0.0006","5.1922","0.0002","22.4019","0.0013","90","","95.88","0.004","90","","1561.95","0.13","295","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-Phenylimidazoline","","- C9 H10 N2 -","- C9 H10 N2 -","- C72 H80 N16 -","8","2","OM6219","Robert T. Stibrany; Harvey J. Schugar; Joseph A. Potenza","Hydrogen bonding in 2-phenylimidazoline","Acta Crystallographica Section E","2004","60","4","o527","o529","10.1107/S1600536804004623","","","0.71073","MoKα","","0.0828","0.0514","","","0.1306","0.1576","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203486","17.4705","0.0006","11.5964","0.0004","18.6412","0.0007","90","","90","","90","","3776.6","0.2","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2,4,6-Triisopropylphenyl isopropyl sulfone","","- C18 H30 O2 S -","- C18 H30 O2 S -","- C144 H240 O16 S8 -","8","1","OM6220","Sandrock, Paul B.; Meyers, Cal Y.; Rath, Nigam P.; Robinson, Paul D.","Isopropyl 2,4,6-triisopropylphenyl sulfone: an aryl sulfone with unusual atom deviations from the aromatic least-squares plane","Acta Crystallographica Section E","2004","60","4","o544","o546","10.1107/S1600536804004635","","","0.71073","MoKα","","0.065","0.047","","","0.125","0.134","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203487","7.1884","0.0011","9.3158","0.0014","12.1699","0.0018","78.605","0.002","81.335","0.002","78.557","0.002","777.7","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(O,O'-di-p-tolyldithiophosphato-κ^2^S,S')nickel(II)","","- C28 H28 Ni O4 P2 S4 -","- C28 H28 Ni O4 P2 S4 -","- C28 H28 Ni O4 P2 S4 -","1","0.5","OM6221","Zhang, Shu-Shang; Yang, Bo; Wang, Yan-Fang; Li, Xue-Mei; Jiao, Kui; Kassim, Mohammad. B.; Yamin, Bohari. M.","Bis(<i>O,O</i>'-di-<i>p</i>-tolyldithiophosphato-κ^2^<i>S,S</i>')nickel(II)","Acta Crystallographica Section E","2004","60","4","m485","m486","10.1107/S1600536804006440","","","0.71073","MoKα","","0.033","0.03","","","0.081","0.083","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203488","11.425","0.003","12.404","0.004","17.374","0.005","90","","106.951","0.005","90","","2355.2","1.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(N,N-Di-4-tolylamino)benzaldehyde (3-pyridylcarbonyl)hydrazone monohydrate","","- C27 H26 N4 O2 -","- C27 H26 N4 O2 -","- C108 H104 N16 O8 -","4","1","OM6222","Zou, Wuxin; Yu, Haitao; Meng, Jiben","4-(<i>N,N</i>-Di-4-tolylamino)benzaldehyde (3-pyridylcarbonyl)hydrazone monohydrate","Acta Crystallographica Section E","2004","60","4","o671","o673","10.1107/S1600536804006464","","","0.71073","MoKα","","0.0903","0.05","","","0.1177","0.1381","","","","","","1.013","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203489","8.6493","0.0017","32.089","0.006","8.3107","0.0017","90","","101.42","0.03","90","","2260.9","0.8","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^N,N')(isothiocyanato- κN)(methanol)nickel(II) chloride","","- C14 H16 Cl N9 Ni O S5 -","- C14 H16 Cl N9 Ni O S5 -","- C56 H64 Cl4 N36 Ni4 O4 S20 -","4","1","OM6223","Liu, Jia-Geng; Xu, Duan-Jun","Bis(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^<i>N</i>,<i>N</i>')(isothiocyanato-κ<i>N</i>)(methanol)nickel(II) chloride","Acta Crystallographica Section E","2004","60","4","m403","m405","10.1107/S1600536804005367","","","0.71069","MoKα","","0.071","0.039","","","0.071","0.078","","","","","","0.849","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203490","6.0907","0.0005","12.8263","0.001","6.7722","0.0006","90","","100.029","0.001","90","","520.97","0.07","100","2","100","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","Tricarbonyl(η^6^-1,3-dimethylbenzene)chromium","","","- C11 H10 Cr O3 -","- C11 H10 Cr O3 -","- C22 H20 Cr2 O6 -","2","0.5","OM6224","Zeller, Matthias; Hunter, Allen D.; Meta, Chris","Tricarbonyl(η^6^-1,3-dimethylbenzene)chromium","Acta Crystallographica Section E","2004","60","4","m432","m433","10.1107/S1600536804005902","","","0.71073","MoKα","","0.0345","0.032","","","0.0815","0.0828","","","","","","1.116","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203491","11.5948","0.0019","13.44","0.002","13.046","0.002","90","","90","","90","","2033","0.5","273","2","273","2","","","","","","","","4","P n m a","-P 2ac 2n","62","Tricarbonyl(η^6^-1,3-dimethoxybenzene)chromium","","","- C11 H10 Cr O5 -","- C11 H10 Cr O5 -","- C88 H80 Cr8 O40 -","8","1","OM6225","Zeller, Matthias; Hunter, Allen D.; Takas, Nathan J.","Tricarbonyl(η^6^-1,3-dimethoxybenzene)chromium","Acta Crystallographica Section E","2004","60","4","m434","m435","10.1107/S1600536804005914","","","0.71073","MoKα","","0.0487","0.031","","","0.0805","0.089","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203492","8.808","0.003","24.579","0.007","11.984","0.004","90","","97.248","0.006","90","","2573.7","1.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H32 N2 O7 -","- C28 H32 N2 O7 -","- C112 H128 N8 O28 -","4","1","RN6012","Wei, Tai-Bao; Zhou, Yan-Qing; Zhang, You-Ming; Zong, Guo-Qiang","4'-Acetylbenzo-15-crown-5 2-naphthyloxyacetylhydrazone","Acta Crystallographica Section E","2004","60","4","o678","o680","10.1107/S1600536804006671","","","0.71073","MoKα","","0.1457","0.0594","","","0.1184","0.1489","","","","","","1.011","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203493","7.1316","0.0006","21.225","0.002","7.1164","0.0006","90","","110.77","0.006","90","","1007.19","0.16","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Amino-3-p-chlorobenzyl-4,5-dihydro-1,2,4-triazol-5-one","","- C9 H9 Cl N4 O -","- C9 H9 Cl N4 O -","- C36 H36 Cl4 N16 O4 -","4","1","SU6078","Burcu Arslan; Canan Kazak; Bahittin Kahveci; Erbil Aǧar; Selami S̨as̨maz","4-Amino-3-<i>p</i>-chlorobenzyl-4,5-dihydro-1,2,4-triazol-5-one","Acta Crystallographica Section E","2004","60","4","o578","o579","10.1107/S1600536804005690","","","0.71073","MoKα","","0.0505","0.037","","","0.1101","0.1154","","","","","","1.03","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203494","25.4591","0.0011","14.1058","0.0007","13.2386","0.0006","90","","99.223","0.003","90","","4692.8","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Hexacarbonyl[μ~2~-η^3^-N-(3-thienylmethylidene)-4- (trimethylsilyl)aniline]diiron","","- C20 H17 Fe2 N O6 S Si -","- C20 H17 Fe2 N O6 S Si -","- C160 H136 Fe16 N8 O48 S8 Si8 -","8","2","SU6079","Imhof, Wolfgang; Berger, Daniel","Hexacarbonyl[μ~2~-η^3^-<i>N</i>-(3-thienylmethylidene)-4-(trimethylsilyl)aniline]diiron","Acta Crystallographica Section E","2004","60","4","m384","m386","10.1107/S1600536804004325","","","0.71073","MoKα","","0.0541","0.0379","","","0.0998","0.1076","","","","","","0.997","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203495","4.9519","0.0001","10.8758","0.0002","12.9078","0.0003","111.985","0.001","95.578","0.001","94.095","0.001","637.17","0.02","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","N,N'-Bis(2-carboxyethyl)-1,4,5,8-naphthalenetetracarboxylic diimine dimethylformamide disolvate","","- C26 H28 N4 O10 -","- C26 H28 N4 O10 -","- C26 H28 N4 O10 -","1","0.5","SU6080","Fallon, Gary D.; Langford, Steven J.; Lee, Marcia A.-P.","<i>N</i>,<i>N</i>'-Bis(2-carboxyethyl)-1,4,5,8-naphthalenetetracarboxylic diimine dimethylformamide disolvate","Acta Crystallographica Section E","2004","60","4","o542","o543","10.1107/S1600536804004350","","","0.71073","MoKα","","0.0685","0.042","","","0.0978","0.1078","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203496","28.637","0.014","7.14","0.003","19.799","0.011","90","","124.688","0.014","90","","3329","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N-(4-methylpiperazinyl)-4-acetamidophenylsulfonamide hydrate","","- C13 H22 N4 O4 S -","- C13 H22 N4 O4 S -","- C104 H176 N32 O32 S8 -","8","1","SU6081","Guo, Ming-Lin","4-Acetamido-<i>N</i>-(4-methylpiperazinyl)benzenesulfonamide monohydrate","Acta Crystallographica Section E","2004","60","4","o574","o575","10.1107/S1600536804005446","","","0.71073","MoKα","","0.0553","0.0424","","","0.1052","0.1144","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203497","10","0.002","9.9641","0.0016","11.661","0.004","90","","97.502","0.008","90","","1152","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-Ammonio-1-methylpiperazin-1-ium oxalate dihydrate","","- C7 H19 N3 O6 -","- C7 H19 N3 O6 -","- C28 H76 N12 O24 -","4","1","SU6082","Guo, Ming-Lin","4-Ammonio-1-methylpiperazin-1-ium oxalate dihydrate","Acta Crystallographica Section E","2004","60","4","o576","o577","10.1107/S1600536804005458","","","0.71073","MoKα","","0.0497","0.0369","","","0.0912","0.0996","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203498","12.854","0.007","14.457","0.009","26.686","0.011","90","","100.06","0.04","90","","4883","5","240","2","240","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","N-(10-Bromoanthracen-9-ylmethyl)-N-[2-(5,5-dimethyl-1,3,2-dioxaborinan-2- yl)benzyl]methylamine","","- C28 H29 B Br N O2 -","- C28 H29 B Br N O2 -","- C224 H232 B8 Br8 N8 O16 -","8","1","SU6083","Barkhuizen, David A.; Howie, R. Alan; Maguire, Glenn E.M.; Rademeyer, Melanie","<i>N</i>-(10-Bromoanthracen-9-ylmethyl)-<i>N</i>-[2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzyl]methylamine at 240K","Acta Crystallographica Section E","2004","60","4","o571","o573","10.1107/S1600536804005410","","","0.71073","MoKα","","0.0936","0.0377","","","0.0747","0.0846","","","","","","0.866","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203499","5.2484","0.0007","8.125","0.001","23.398","0.003","90","","93.422","0.002","90","","996","0.2","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N,N'-bis(2-pyridylethyl)pyromellitic diimide","","- C24 H18 N4 O4 -","- C24 H18 N4 O4 -","- C48 H36 N8 O8 -","2","0.5","SU6084","Lü, Xingqiang; Su, Chengyong; Kang, Beisheng; Ng, Seik Weng","<i>N</i>,<i>N</i>'-Bis(2-pyridylethyl)pyromellitic diimide","Acta Crystallographica Section E","2004","60","4","o566","o567","10.1107/S1600536804005409","","","0.71073","MoKα","","0.069","0.043","","","0.108","0.124","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203500","25.671","0.005","9.252","0.002","18.329","0.004","90","","106.27","0.03","90","","4178.9","1.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-benzyl-6-diethylamino-4-phenyl-2H-1,3,5-thiadiazine-2-carboxylate","","- C22 H25 N3 O2 S -","- C22 H25 N3 O2 S -","- C176 H200 N24 O16 S8 -","8","1","SU6085","Emilio Rodriguez-Fernandez; Rafael Del-Campo; Julio J. Criado; Jaun L. Manzano; Francisca Sanz","The antifungal agent methyl 2-benzyl-6-diethylamino-4-phenyl-2<i>H</i>-1,3,5-thiadiazine-2-carboxylate","Acta Crystallographica Section E","2004","60","4","o713","o715","10.1107/S160053680400724X","","","1.5418","CuKα","","0.0619","0.0469","","0.1181","0.1084","","","","1.148","1.185","1.185","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203501","10.391","0.001","12.553","0.002","11.773","0.001","90","","118.961","0.01","90","","1343.6","0.3","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H20 O3 -","- C15 H20 O3 -","- C60 H80 O12 -","4","1","SU6087","Ángel Aguirre-Pérez; Ivan Pérez-Sánchez; Santiago García-Granda","(1<i>RS</i>,3<i>SR</i>,4<i>SR</i>)-3-Methoxy-1-methyl-5-methylene-3-phenyl-1,4-cyclohexanediol","Acta Crystallographica Section E","2004","60","4","o658","o659","10.1107/S1600536804006646","","","1.5418","CuKα","","0.0479","0.0397","","","0.11","0.1185","","","","","","0.925","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203502","8.3514","0.0012","6.7324","0.0005","13.3203","0.0019","90","","104.275","0.011","90","","725.81","0.16","150","2","150","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","2-(Adamantan-1-yl)-5-methylbenzo[d][1,3]oxazin-4-one","","- C19 H21 N O2 -","- C19 H21 N O2 -","- C38 H42 N2 O4 -","2","0.5","SU6090","Jonathan D Crane; Eleanor Rogerson","2-(Adamantan-1-yl)-5-methylbenzo[<i>d</i>][1,3]oxazin-4-one","Acta Crystallographica Section E","2004","60","4","o669","o670","10.1107/S1600536804006907","","","0.71073","MoKα","","0.0725","0.0475","","","0.1312","0.1411","","","","","","1.001","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203503","14.0313","0.0008","9.1124","0.0005","15.0553","0.0009","90","","102.703","0.001","90","","1877.84","0.19","163","2","163","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","(1)","Ethyl (E)-2-(4-oxo-1,3-thiazinan-2-ylidene)ethanoate","","- C8 H11 N O3 S -","- C8 H11 N O3 S -","- C64 H88 N8 O24 S8 -","8","2","TK6154","Baranac, Marija; Marković, Rade; Steel, Peter J.","Ethyl (<i>E</i>)-2-(4-oxo-1,3-thiazinan-2-ylidene)ethanoate","Acta Crystallographica Section E","2004","60","4","o484","o485","10.1107/S1600536804004313","","","0.71073","MoKα","","0.048","0.035","","","0.093","0.099","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203504","11.116","0.002","10.48","0.002","11.369","0.002","90","","94.88","0.03","90","","1319.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(triethanolamine)cobalt(II) benzene-1,4-dioxydiacetate","","- C22 H38 Co N2 O12 -","- C22 H38 Co N2 O12 -","- C44 H76 Co2 N4 O24 -","2","0.5","TK6159","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Ng, Seik Weng","Bis(triethanolamine)cobalt(II) benzene-1,4-dioxydiacetate","Acta Crystallographica Section E","2004","60","4","m462","m464","10.1107/S1600536804006609","","","0.71073","MoKα","","0.085","0.056","","","0.152","0.165","","","","","","0.98","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203505","7.3772","0.0017","13.453","0.002","12.085","0.002","90","","92.026","0.018","90","","1198.6","0.4","100","0.1","100","0.1","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Bis(dimethyl sulfoxide-κO)bis(1-phenylbutane-1,3-dionate-κ^2^O,O')nickel(II)","","- C24 H30 Ni O6 S2 -","- C24 H30 Ni O6 S2 -","- C48 H60 Ni2 O12 S4 -","2","0.5","WK6011","Ernest Meštrović; Ivan Halasz; Dejan-Krešimir Bučar; Marijana Žgela","Bis(dimethyl sulfoxide-κ<i>O</i>)bis(1-phenylbutane-1,3-dionato-κ^2^<i>O</i>,<i>O</i>')nickel(II)","Acta Crystallographica Section E","2004","60","4","m367","m369","10.1107/S1600536804004854","","","0.71073","MoKα","","0.0724","0.0351","","","0.0556","0.0637","","","","","","0.95","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203506","10.068","0.0007","7.008","0.0005","14.03","0.0013","90","","106.32","0.003","90","","950.02","0.13","180","2","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C10 H11 B Fe O2 -","- C10 H11 B Fe O2 -","- C40 H44 B4 Fe4 O8 -","4","1","WK6014","Bresner, Christopher; Aldridge, Simon; Fallis, Ian A.; Ooi, Li-Ling","Hydrogen-bonding motifs in the solid-state structure of ferroceneboronic acid","Acta Crystallographica Section E","2004","60","4","m441","m443","10.1107/S1600536804006014","","","0.71073","MoKα","","","0.0545","","","","0.1054","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203507","8.5218","0.001","12.044","0.001","17.028","0.002","90","","101.599","0.005","90","","1712","0.3","130","2","130","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","Poly[[[(1,10-phenanthroline-κ^2^N,N')cobalt(II)]-μ^3^-5-hydroxyisophthalato- κ^4^O,O':O'':O'''] monohydrate]","","- C20 H14 Co N2 O6 -","- C20 H14 Co N2 O6 -","- C80 H56 Co4 N8 O24 -","4","1","WK6015","Xin-Yi Cao; Jian Zhang; Yao Kang; Jian-Kai Cheng; Zhao-Ji Li; Xiao-Qin Wan; Yuan-Gen Yao","Poly[[[(1,10-phenanthroline-κ^2^<i>N,N</i>')cobalt(II)]-μ~3~-5-hydroxyisophthalato-κ^4^<i>O,O</i>':<i>O</i>'':<i>O</i>'''] monohydrate]","Acta Crystallographica Section E","2004","60","4","m460","m461","10.1107/S1600536804006348","","","0.71073","MoKα","","0.036","0.034","","","0.088","0.089","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203508","11.497","0.003","5.538","0.001","11.603","0.003","90","","117.792","0.005","90","","653.5","0.3","120","","120","","","","","","","","","4","P 1 21 1","P 2yb","4","Benzyl 4-C-nitrosomethyl β-D-arabinopyranoside","(2R,3S,4S,5R)-2-(Benzyloxy)-5-(nitromethyl)tetrahydro-2H-pyran-3,4,5-triol","","- C13 H17 N O7 -","- C13 H17 N O7 -","- C26 H34 N2 O14 -","2","1","WK6016","Jens Andersch; Mikael Bols; Alan Hazell","Benzyl 4-<i>C</i>-nitrosomethyl-β-<small>D</small>-arabinopyranoside","Acta Crystallographica Section E","2004","60","4","o660","o661","10.1107/S1600536804006488","","","0.71073","MoKα","","","0.058","","","","0.052","","","","","","0.989","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203509","10.3884","0.0007","23.2621","0.0014","11.1685","0.0007","90","","108.633","0.001","90","","2557.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","41'-Methyl-4'-(3,4,5-trimethoxyphenyl)dispiro[indene-2,3'-pyrrolidine- 2',3''-indole]-1,2'',3(1''H)-trione","","- C29 H26 N2 O6 -","- C29 H26 N2 O6 -","- C116 H104 N8 O24 -","4","1","WN6212","P. R. Seshadri; S. Selvanayagam; D. Velmurugan; K. Ravikumar; A. R. Sureshbabu; K. Parthasarathy; R. Raghunathan","1'-Methyl-4'-(3,4,5-trimethoxyphenyl)dispiro[indene-2,3'-pyrrolidine-2',3''-indole]-1,2'',3(1''<i>H</i>)-trione","Acta Crystallographica Section E","2004","60","4","o553","o555","10.1107/S1600536804004957","","","0.71073","MoKα","","0.0943","0.0587","","","0.1483","0.1698","","","","","","0.998","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203510","7.9022","0.0007","11.9197","0.001","12.0382","0.001","84.444","0.002","84.649","0.002","84.176","0.002","1118.76","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-N-methyl-spiro [2-2']-acenaphthen-1'-one-spiro-[3-2""] indan-1"",3""-dione- 4-phenyl pyrrolidine","","- C30 H21 N O3 -","- C30 H21 N O3 -","- C60 H42 N2 O6 -","2","1","WN6213","M. M. Govind; S. Selvanayagam; D. Velmurugan; K. Ravikumar; A. R. Sureshbabu; R. Raghunathan","1'-Methyl-4'-phenylacenaphthene-1-spiro-2'-pyrrolidine-3'-spiro-2''-indan-2,1'',3''-trione","Acta Crystallographica Section E","2004","60","4","o547","o549","10.1107/S1600536804004969","","","0.71073","MoKα","","0.0657","0.0515","","","0.1395","0.1513","","","","","","1.004","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203511","7.696","0.005","21.23","0.013","11.005","0.007","90","","106.404","0.01","90","","1724.9","1.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9,10'-bis(3-ethylimidazolium-1-ylmethyl)-9,9':10,10'-bianthracenyl diiodide","","- C40 H38 I2 N4 -","- C40 H38 I2 N4 -","- C80 H76 I4 N8 -","2","0.5","WN6216","Liu Qing-Xiang; Song Hai-bin; Xu Feng-bo; Li Qing-shan; Zhang Zheng-zhi","The photodimer of 1-(anthracen-9-ylmethyl)-3-ethylimidazolium iodide","Acta Crystallographica Section E","2004","60","4","o674","o675","10.1107/S1600536804006749","","","0.71073","MoKα","","0.0515","0.031","","","0.0623","0.0688","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203512","27.701","0.012","4.551","0.002","9.953","0.004","90","","95.418","0.007","90","","1249.1","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N,N'-Bis(4-bromophenyl)urea","","- C13 H10 Br2 N2 O -","- C13 H10 Br2 N2 O -","- C52 H40 Br8 N8 O4 -","4","0.5","WN6218","Lin, Qi; Zhang, You-Ming; Wei, Tai-bao; Wang, Hai","<i>N</i>,<i>N</i>'-Bis(4-bromophenyl)urea","Acta Crystallographica Section E","2004","60","4","o696","o698","10.1107/S1600536804005495","","","0.71073","MoKα","","0.0681","0.0419","","","0.1004","0.1099","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203513","12.867","0.0005","14.2568","0.0006","14.2196","0.0006","90","","94.728","0.002","90","","2599.6","0.19","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-phenyl-2-phthalimidoethanone","","- C16 H11 N O3 -","- C16 H11 N O3 -","- C128 H88 N8 O24 -","8","2","WN6221","Zhang, Xingguo; Zhong, Ping; Hu, Maolin; Hu, Huanan","1-Phenyl-2-phthalimidoethanone","Acta Crystallographica Section E","2004","60","4","o692","o693","10.1107/S1600536804005653","","","0.71073","MoKα","","0.0682","0.051","","","0.1181","0.1272","","","","","","1.043","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203514","6.981","0.002","13.72","0.004","14.863","0.005","90","","90","","90","","1423.6","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3-(α-Hydroxy-2-methoxylbenzylidene)-1-isopropylpyrrolidine-2,4-dione","","- C15 H17 N O4 -","- C15 H17 N O4 -","- C60 H68 N4 O16 -","4","1","WN6222","You-Quan Zhu; Hai-Bin Song; Chang-Sheng Yao; Ying Gao; Fang-Zhong Hu; Xiao-Mao Zou; Hua-Zheng Yang","3-(α-Hydroxy-2-methoxylbenzylidene)-1-isopropylpyrrolidine-2,4-dione","Acta Crystallographica Section E","2004","60","4","o599","o601","10.1107/S1600536804005951","","","0.71073","MoKα","","0.0575","0.0379","","","0.0829","0.0908","","","","","","1.072","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203515","5.10093","0.00007","5.10093","0.00007","4.4551","0.00007","90","","90","","120","","100.389","0.005","295","","295","","","","","","","","","5","P -6 m 2","P -6 2","187","","potassium calcium flurine-carbonate","","- C Ca F K O3 -","- C Ca F K O3 -","- C Ca F K O3 -","1","0.0833333","WN6225","Chen, Xiaolong; He, Meng; Xu, Yanping; Li Heqing; Tu Qingyun","KCaF(CO~3~), from X-ray Powder Data","Acta Crystallographica, Section E","2004","60","4","i50","i51","10.1107/S1600536804005069","","","1.54056","CuKα~1~","","","","","","","","","","2.26","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2203516","5.568","0.002","6.366","0.002","11.62","0.003","102.21","0.02","95.59","0.02","106.68","0.01","380.1","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Hexaaquacobalt(II) benzene-1,4-dioxydiacetate","","- C10 H20 Co O12 -","- C10 H20 Co O12 -","- C10 H20 Co O12 -","1","0.5","WN6226","Liu, Ji-Wei; Huo, Li-Hua; Gao, Shan; Ng, Seik Weng","Hexaaquacobalt(II) benzene-1,4-dioxydiacetate","Acta Crystallographica Section E","2004","60","4","m439","m440","10.1107/S160053680400594X","","","0.71073","MoKα","","0.046","0.044","","","0.126","0.127","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203517","29.633","0.007","29.633","0.007","12.035","0.003","90","","90","","120","","9152","4","105","2","105","2","","","","","","","","4","P 62","P 62","171","","L-Leucyl-L-isoleucine 0.75-hydrate","","- C12 H25.5 N2 O3.76 -","- C12.0025 H25.528 N2 O3.7615 -","- C288.06 H612.672 N48 O90.276 -","24","4","WN6230","Görbitz, Carl Henrik","<small>L</small>-Leucyl-<small>L</small>-isoleucine 0.75 hydrate","Acta Crystallographica Section E","2004","60","4","o647","o650","10.1107/S1600536804006518","","","0.71073","MoKα","","0.0937","0.0534","","","0.1182","0.1389","","","","","","1.057","","","","has coordinates,has disorder,has Fobs","194389","2020-10-21","18:00:00",""
"2203518","8.2094","0.0018","14.203","0.003","8.1261","0.0018","90","","114.807","0.003","90","","860.1","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H12 Br N5 -","- C4 H12 Br N5 -","- C16 H48 Br4 N20 -","4","1","WN6232","Lu, Liping; Zhang, Hongmei; Feng, Sisi; Zhu, Miaoli","<i>N,N</i>-Dimethylbiguanidium bromide","Acta Crystallographica Section E","2004","60","4","o640","o641","10.1107/S160053680400652X","","","0.71073","MoKα","","0.0422","0.0337","","","0.0729","0.075","","","","","","0.97","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203519","11.7056","0.0009","6.992","0.0005","14.6897","0.0011","90","","92.052","0.001","90","","1201.52","0.15","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 H12 Br2 -","- C14 H12 Br2 -","- C56 H48 Br8 -","4","1","WN6234","Cem Cüneyt Ersanlı; Ufuk Çoruh; Tuncer Hökelek; Vázquez-López, Ezequiel M.; Arif Daştan; Ahmet Erdönmez","(1<i>RS</i>,8<i>SR</i>,9<i>RS</i>,10<i>RS</i>,11<i>RS</i>,12<i>RS</i>)-10,11-Dibromotetracyclo[6.4.2.0^2,7^.0^9,12^]tetradeca-2,4,6,13-tetraene","Acta Crystallographica Section E","2004","60","4","o703","o705","10.1107/S1600536804007305","","","0.71073","MoKα","","0.0573","0.0355","","","0.0776","0.0819","","","","","","0.908","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203520","7.804","0.001","12.078","0.002","19.007","0.003","90","","90","","90","","1791.5","0.5","289","2","289","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Kamebacetal A","(1S,2S,8S,9R,11R,15S,16S,18R)-15,18-dihydroxy-16-methoxy-12,12-dimethyl- 6-methylene-17-oxapentacyclo[7.6.2.1^5,8^.0^1,11^.0^2,8^]octadecan-7-one","","- C21 H30 O5 -","- C21 H30 O5 -","- C84 H120 O20 -","4","1","WW6140","Shi, Hao; Sun, Cui Rong; Pan, Yuan Jiang","The natural diterpenoid kamebacetal A","Acta Crystallographica Section E","2004","60","4","o500","o502","10.1107/S1600536804004416","","","0.71073","MoKα","","0.085","0.0426","","","0.0783","0.0893","","","","","","0.883","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203521","9.194","0.004","7.515","0.004","16.635","0.008","90","","93.784","0.007","90","","1146.9","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","7-Chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid","","- C13 H9 Cl F N O3 -","- C13 H9 Cl F N O3 -","- C52 H36 Cl4 F4 N4 O12 -","4","1","WW6159","Song, Jian; Zhang, Shun-Xia; Lou, Ke-Xia","7-Chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid","Acta Crystallographica Section E","2004","60","4","o503","o504","10.1107/S1600536804004477","","","0.71073","MoKα","","0.0608","0.0398","","","","0.0939","","","","","","1.043","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203522","10.5346","0.0007","10.9409","0.0007","11.0568","0.0007","83.315","0.002","70.256","0.003","63.245","0.002","1070.09","0.12","273","2","273","2","","","","","","","","3","P -1","-P 1","2","Kadsuranin","5,6,7,8-tetrahydro-1,2,3,13-tetramethoxy-6,7- dimethylbenzo[3,4]cycloocta[1,2-f][1,3]benzodioxole","","- C23 H28 O6 -","- C23 H28 O6 -","- C46 H56 O12 -","2","1","WW6164","Wang, Li-Wei; Chen, Tao; Sun, Hong-Xiang; Xiong, Yi; Zhao, Yu","Kadsuranin: a lignan from the fruit of <i>Schisandra chinensis</i>","Acta Crystallographica Section E","2004","60","4","o513","o514","10.1107/S1600536804004659","","","0.71073","MoKα","","0.1299","0.0831","","","0.1776","0.1964","","","","","","1.101","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203523","12.746","0.004","11.657","0.004","7.25","0.002","90","","95.479","0.004","90","","1072.3","0.6","183","2","183","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-[Hydroxy(4-nitrophenyl)methyl]-cyclopent-2-en-1-one","2-[Hydroxy(4-nitrophenyl)methyl]-cyclopent-2-en-1-one","","- C12 H11 N O4 -","- C12 H11 N O4 -","- C48 H44 N4 O16 -","4","1","WW6165","Huo, Fangjun; Yin, Caixia; Guo, Wei; Xia, Chizhong","2-[Hydroxy(4-nitrophenyl)methyl]cyclopent-2-en-1-one","Acta Crystallographica Section E","2004","60","4","o486","o487","10.1107/S1600536804004465","","","0.71073","MoKα","","0.0972","0.0694","","","0.1566","0.1708","","","","","","1.109","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203524","18.975","0.004","25.92","0.005","8.228","0.002","90","","90","","90","","4046.8","1.5","150","2","150","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","5,10,15,20-Tetraphenylporphyrindiium dichloride diacetonitrile monohydrate","","- C48 H40 Cl2 N6 O -","- C48 H40 Cl2 N6 O -","- C192 H160 Cl8 N24 O4 -","4","0.5","WW6167","Larsen, Frank B.; Hansen, Flemming G.; McKenzie, Christine J.","Synchrotron study of a fully protonated tetraphenyl porphyrin","Acta Crystallographica Section E","2004","60","4","o497","o499","10.1107/S1600536804004489","","","0.69","synchrotron","","0.075","0.0518","","","0.1147","0.1252","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203525","7.515","0.001","13.363","0.002","13.285","0.002","90","","93.65","0.01","90","","1331.4","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(μ~2~-azido)-bis(hydrotris(1-pyrazolyl)borato)-di-copper(II)","","- C18 H20 B2 Cu2 N18 -","- C18 H20 B2 Cu2 N18 -","- C36 H40 B4 Cu4 N36 -","2","0.5","WW6170","Wang, Shi; Li, Yi-Zhi; Zuo, Jing-Lin; You, Xiao-Zeng","Di-μ-azido-bis{[hydrotris(pyrazol-1-yl)borato]copper(II)}","Acta Crystallographica Section E","2004","60","4","m376","m377","10.1107/S1600536804004568","","","0.71073","MoKα","","0.0704","0.0488","","","0.1026","0.1098","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203526","15.81","0.003","7.299","0.002","28.55","0.006","90","","90","","90","","3294.6","1.3","173","2","173","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","4-Dimethylamino-6-(1-methyl-4-nitro-1H-pyrrol-2-yl)-1,3,5-triazine-2-amine dimethylformamide solvate","","- C13 H20 N8 O3 -","- C13 H20 N8 O3 -","- C104 H160 N64 O24 -","8","1","WW6174","Lu, Liping; Qin, Shidong; Zhu, Miaoli; Yang, Pin","4-Dimethylamino-6-(1-methyl-4-nitro-1<i>H</i>-pyrrol-2-yl)-1,3,5-triazine-2-amine dimethylformamide solvate","Acta Crystallographica Section E","2004","60","4","o583","o585","10.1107/S160053680400515X","","","0.71073","MoKα","","0.0975","0.0669","","","0.1303","0.1434","","","","","","1.167","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203527","7.36","0.001","15.811","0.003","10.789","0.002","90","","103.82","0.01","90","","1219.2","0.4","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","N-ethoxycarbonyl-N'-(2-methylphenyl)thiourea","N-ethoxycarbonyl-N'-(2-methylphenyl)thiourea","","- C11 H14 N2 O2 S -","- C11 H14 N2 O2 S -","- C44 H56 N8 O8 S4 -","4","1","WW6175","Lin, Qi; Zhang, You-Ming; Wei, Tai-bao; Wang, Hai","<i>N</i>-Ethoxycarbonyl-<i>N</i>'-(2-methylphenyl)thiourea","Acta Crystallographica Section E","2004","60","4","o580","o582","10.1107/S1600536804005161","","","0.71073","MoKα","","0.0565","0.0424","","","0.1094","0.1148","","","","","","1.081","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203528","12.427","0.003","12.833","0.003","6.7816","0.0014","90","","98.62","0.03","90","","1069.3","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Hexaaquazinc(II) bis[(4-oxo-4H-pyridine-1-yl)acetate] dihydrate","","- C14 H28 N2 O14 Zn -","- C14 H28 N2 O14 Zn -","- C28 H56 N4 O28 Zn2 -","2","0.5","WW6176","Shan Gao; Zhu-Yan Zhang; Li-Hua Huo; Hui Zhao; Jing-Gui Zhao","Hexaaquazinc(II) bis[(4-oxo-4<i>H</i>-pyridin-1-yl)acetate] dihydrate","Acta Crystallographica Section E","2004","60","4","m444","m446","10.1107/S1600536804006257","","","0.71073","MoKα","","0.0299","0.0272","","","0.0734","0.0752","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203529","13.8789","0.0015","15.41","0.002","22.705","0.002","90","","90","","90","","4856","0.9","93","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C57 H47 Cl3 O6 S2 -","- C57 H47 Cl3 O6 S2 -","- C228 H188 Cl12 O24 S8 -","4","1","YA6197","Ishizuka, Kentaro; Kawanami, Toshio; Furuno, Hiroshi; Inanaga, Junji","Conspicuous hydrogen bonds linking (<i>R</i>,<i>R</i>)-3',3''-bisBINOL, methyl 2-methylphenyl (<i>R</i>)-sulfoxide and chloroform in the 1:2:1 complex","Acta Crystallographica Section E","2004","60","4","o607","o609","10.1107/S1600536804005768","","","0.71075","MoKα","","","0.033","","","","0.088","","","","","","1.05","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203530","13.8776","0.0013","6.3855","0.0009","8.4","0.001","90","","90","","90","","744.37","0.15","160","","160","","","","","","","","","4","P n a 21","P 2c -2n","33","","(Chloromethyl)trimethylsilane","","- C4 H11 Cl Si -","- C4 H11 Cl Si -","- C16 H44 Cl4 Si4 -","4","1","YA6200","Fraser, Stewart; Parsons, Simon","(Chloromethyl)trimethylsilane at 160K","Acta Crystallographica Section E","2004","60","4","o564","o565","10.1107/S1600536804005276","","","0.71073","MoKα","","0.044","0.04","","0.115","0.112","0.115","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203531","5.782","0.005","6.171","0.008","6.588","0.007","67.99","0.01","71.93","0.01","86.89","0.01","206.7","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","di-μ-azido-μ-1,2-diaminoethane-disilver(I)","","- C2 H8 Ag2 N8 -","- C2 H8 Ag2 N8 -","- C2 H8 Ag2 N8 -","1","0.5","AC6086","Chun-Xia Ren; Bao-Hui Ye; Wen-Hui Feng; Xiao-Ming Chen; Seik Weng Ng","Polymeric di-μ-azido-μ-1,2-diaminoethane-disilver(I)","Acta Crystallographica Section E","2004","60","5","m652","m653","10.1107/S1600536804009456","","","0.71073","MoKα","","0.0509","0.0495","","","0.1494","0.1519","","","","","","1.124","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203532","12.851","0.006","11.527","0.005","10.677","0.004","90","","96.251","0.007","90","","1572.2","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-[4-(4-methylpiperazin-1-ylsulfonyl)phenyl]acetamide hydrate","","- C13 H21 N3 O4 S -","- C13 H21 N3 O4 S -","- C52 H84 N12 O16 S4 -","4","1","AC6088","Guo, Ming-Lin","<i>N</i>-[4-(4-Methylpiperazin-1-ylsulfonyl)phenyl]acetamide monohydrate","Acta Crystallographica Section E","2004","60","5","o736","o737","10.1107/S1600536804007718","","","0.71073","MoKα","","0.0594","0.0389","","","0.1082","0.1308","","","","","","1.085","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203533","11.494","0.006","12.754","0.005","10.252","0.004","90","","116.478","0.006","90","","1345.2","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(4-methylpiperazin-4-ium-1-carbonyl)benzoate monohydrate","","- C13 H18 N2 O4 -","- C13 H18 N2 O4 -","- C52 H72 N8 O16 -","4","1","AC6089","Guo, Ming-Lin","2-(4-Methylpiperazin-4-ium-1-ylcarbonyl)benzoate monohydrate","Acta Crystallographica Section E","2004","60","5","o738","o739","10.1107/S1600536804007706","","","0.71073","MoKα","","0.073","0.0397","","","0.0948","0.1103","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203534","21.738","0.005","9.7","0.002","13.447","0.003","90","","102.442","0.013","90","","2768.8","1.1","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Trimethyltin(IV)2-(N-maleoyl)-2-methylpropionate","Trimethyltin(IV)2-(N-maleoyl)-2-methylpropionate","","- C11 H17 N O4 Sn -","- C11 H17 N O4 Sn -","- C88 H136 N8 O32 Sn8 -","8","2","AC6093","Parvez, Masood; Ahmed, Sajjad; Ali, Saqib; Bhatti, Moazzam H.; Mazhar, Muhammad","Polymeric [2-(<i>N</i>-maleoyl)-2-methylpropionato]trimethyltin(IV)","Acta Crystallographica Section E","2004","60","5","m554","m556","10.1107/S1600536804007974","","","0.71073","MoKα","","0.076","0.039","","","0.07","0.081","","","","","","0.96","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203535","8.849","0.002","9.803","0.002","17.019","0.003","86.25","0.03","86.22","0.03","67.2","0.03","1356.7","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis[2-(cyclopropyliminiomethyl)naphthalato]dithiocyanatozinc(II)","","- C30 H26 N4 O2 S2 Zn -","- C30 H26 N4 O2 S2 Zn -","- C60 H52 N8 O4 S4 Zn2 -","2","1","AC6095","You, Zhong-Lu; Zhu, Hai-Liang; Liu, Wei-Sheng","A butterfly-shaped Schiff base complex: bis[2-(cyclopropyliminiomethyl)naphthalato]dithiocyanatozinc(II)","Acta Crystallographica Section E","2004","60","5","m560","m562","10.1107/S1600536804008335","","","0.71073","MoKα","","0.1244","0.0729","","","0.152","0.1716","","","","","","0.927","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203536","11.5535","0.0019","9.3028","0.0011","11.6612","0.0019","90","","110.097","0.009","90","","1177","0.3","173","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[N-(4-hydroxybenzyl)-D,L-alanine]copper(II) tetrahydrate","","- C20 H32 Cu N2 O10 -","- C20 H32 Cu N2 O10 -","- C40 H64 Cu2 N4 O20 -","2","0.5","BR6143","Lou, Ben-Yong; Xu, Ying; Yuan, Da-Qiang; Han, Lei; Hong, Mao-Chun","Bis[<i>N</i>-(4-hydroxybenzyl)-<small>D,L</small>-alaninato]copper(II) tetrahydrate","Acta Crystallographica Section E","2004","60","5","m522","m523","10.1107/S1600536804007342","","","0.71073","MoKα","","0.0592","0.0423","","","0.0863","0.0938","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203537","21.147","0.002","10.664","0.001","15.949","0.002","90","","109.62","0.01","90","","3387.9","0.7","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- H32 La2 Mo6 O40 Pt -","- La2 Mo6 O40 Pt -","- La8 Mo24 O160 Pt4 -","4","0.5","BR6144","Lee, Uk; Joo, Hea-Chung","La~2~[H~2~PtMo~6~O~24~]·16H~2~O","Acta Crystallographica Section E","2004","60","5","i61","i63","10.1107/S1600536804007445","","","0.71069","MoKα","","0.0371","0.0304","","","0.0693","0.0738","","","","","","1.113","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203538","15.196","0.002","7.2371","0.001","7.5015","0.001","90","","91.476","0.007","90","","824.7","0.19","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","bis(3-carboxypropanaminium) tetrachlorocopper(II)","","- C8 H20 Cl4 Cu N2 O4 -","- C8 H20 Cl4 Cu N2 O4 -","- C16 H40 Cl8 Cu2 N4 O8 -","2","0.5","BR6145","Bao-Ling Yuan; Hua-Chun Lan; Yi-Ping Chen; Yan-Bo Li","Bis(3-carboxypropanaminium) tetrachlorocuprate(II)","Acta Crystallographica Section E","2004","60","5","m617","m619","10.1107/S1600536804008803","","","0.71073","MoKα","","0.0525","0.0448","","","0.1258","0.1346","","","","","","0.966","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203539","7.5703","0.0003","19.5133","0.0013","9.7623","0.0007","90","","111.273","0.004","90","","1343.84","0.15","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Potassium trihydrogen 1,2,4,5-benzenetetracarboxylate trihydrate","","- C10 H11 K O11 -","- C10 H11 K O11 -","- C40 H44 K4 O44 -","4","1","BR6146","Wang, Chunrong; Chen, Xiaojuan; Huang, Changcang; Zhang, Hanhui; Lian, Zhaoxun; Xiao, GuangCan","Potassium trihydrogen 1,2,4,5-benzenetetracarboxylate trihydrate","Acta Crystallographica Section E","2004","60","5","m641","m643","10.1107/S1600536804008815","","","0.71069","MoKα","","0.0454","0.0322","","","0.0787","0.0839","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203540","6.5304","0.0004","6.9483","0.0003","10.9214","0.0006","90","","101.934","0.002","90","","484.85","0.05","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1-Benzyluracil","","- C11 H10 N2 O2 -","- C11 H10 N2 O2 -","- C22 H20 N4 O4 -","2","1","BT6427","Jin-Chang Ding; Miao-Chang Liu; Hua-Yue Wu; Mao-Lin Hu; Hong-Ping Xiao","1-Benzyluracil","Acta Crystallographica Section E","2004","60","5","o837","o838","10.1107/S1600536804009146","","","0.71073","MoKα","","0.0555","0.0542","","","0.1252","0.1257","","","","","","1.266","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203541","10.946","0.0002","15.0522","0.0003","12.8224","0.0003","90","","114.426","0.0008","90","","1923.54","0.07","291","1","291","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H29 I O3 -","- C18 H29 I O3 -","- C72 H116 I4 O12 -","4","1","BT6432","Fresu, Sonia; Schürmann, Markus; Preut, Hans; Eilbracht, Peter","<i>rac</i>-(1<i>R</i>,11<i>S</i>,12<i>S</i>)-12-Iodo-15-oxobicyclo[9.3.1]pentadecane-1-carboxylic acid ethyl ester","Acta Crystallographica Section E","2004","60","5","o833","o834","10.1107/S1600536804008025","","","0.71073","MoKα","","0.0715","0.0396","","","0.101","0.1068","","","","","","0.899","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203542","6.2069","0.001","9.2067","0.0015","10.4197","0.0017","92.724","0.003","94.191","0.003","101.615","0.003","580.5","0.16","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H13 Br O4 S -","- C10 H13 Br O4 S -","- C20 H26 Br2 O8 S2 -","2","1","BT6433","Zeller, Matthias; Hunter, Allen D.; Sampson, Paul; Chumachenko, Nataliya","(4a<i>SR</i>,7<i>SR</i>,9a<i>RS</i>)-9a-Bromo-7-methyl-5,5-dioxo-1,2,4a,6,7,9a-hexahydro-8-oxa-5λ^6^-thia-1,4-benzocyclohepten-9-one","Acta Crystallographica Section E","2004","60","5","o724","o726","10.1107/S1600536804007603","","","0.71073","MoKα","","0.0425","0.0399","","","0.104","0.1069","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203543","6.0895","0.0005","9.1882","0.0007","10.6027","0.0009","89.383","0.001","86.523","0.001","77.697","0.001","578.55","0.08","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H13 Br O4 S -","- C10 H13 Br O4 S -","- C20 H26 Br2 O8 S2 -","2","1","BT6434","Zeller, Matthias; Hunter, Allen D.; Sampson, Paul; Chumachenko, Nataliya","(4a<i>SR</i>,7<i>RS</i>,9a<i>RS</i>)-9a-Bromo-7-methyl-5,5-dioxo-1,2,4a,6,7,9a-hexahydro-8-oxa-5λ^6^-thia-1,4-benzocyclohepten-9-one","Acta Crystallographica Section E","2004","60","5","o727","o728","10.1107/S1600536804007615","","","0.71073","MoKα","","0.0303","0.0294","","","0.0779","0.0784","","","","","","1.062","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203544","10.0232","0.001","10.6255","0.001","11.6726","0.0011","90","","114.062","0.002","90","","1135.13","0.19","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H16 O4 S -","- C11 H16 O4 S -","- C44 H64 O16 S4 -","4","1","BT6435","Zeller, Matthias; Hunter, Allen D.; Sampson, Paul; Chumachenko, Nataliya","(4a<i>SR</i>,7<i>RS</i>,9a<i>SR</i>)-7,9a-Dimethyl-5,5-dioxo-1,2,4a,6,7,9a-hexahydro-8-oxa-5λ^6^-thia-1,4-benzocyclohepten-9-one","Acta Crystallographica Section E","2004","60","5","o729","o730","10.1107/S1600536804007627","","","0.71073","MoKα","","0.0367","0.0354","","","0.0954","0.0966","","","","","","1.102","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203545","10.9599","0.0008","22.4386","0.0016","9.1966","0.0007","90","","113.69","0.001","90","","2071.1","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H14 O4 S -","- C10 H14 O4 S -","- C80 H112 O32 S8 -","8","2","BT6436","Zeller, Matthias; Hunter, Allen D.; Sampson, Paul; Chumachenko, Nataliya","(4a<i>SR</i>,9a<i>SR</i>)-9a-Methyl-5,5-dioxo-1,2,4a,6,7,9a-hexahydro-8-oxa-5λ^6^-thiabenzo-1,4-cyclohepten-9-one","Acta Crystallographica Section E","2004","60","5","o731","o732","10.1107/S1600536804007639","","","0.71073","MoKα","","0.0398","0.0383","","","0.1007","0.1022","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203546","10.2215","0.0011","10.6228","0.0012","12.3584","0.0013","104.178","0.002","97.238","0.002","91.499","0.002","1288.4","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1'-(4-Methoxybenzoyl)acenaphthene-1-spiro-3'-pyrrolizidine-2'-spiro-3''- 1H-indole-2,2''(1H,3''H)-dione","","- C33 H26 N2 O4 -","- C33 H26 N2 O4 -","- C66 H52 N4 O8 -","2","1","BT6438","M. M. Govind; S. Selvanayagam; D. Velmurugan; K. Ravikumar; A. R. Sureshbabu; R. Raghunathan","1'-(4-Methoxybenzoyl)acenaphthene-1-spiro-3'-pyrrolizidine-2'-spiro-3''-1<i>H</i>-indole-2,2''(1<i>H</i>,3''<i>H</i>)-dione","Acta Crystallographica Section E","2004","60","5","o873","o875","10.1107/S1600536804009006","","","0.71073","MoKα","","0.1454","0.0854","","","0.169","0.1958","","","","","","1.089","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203547","46.242","0.004","7.7993","0.0006","15.3204","0.0012","90","","98.958","0.002","90","","5458","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","5,7-Dibromo-4'-(4-bromobenzoyl)-1'-methyl-1H-indole-3-spiro-2'-pyrrolidine- 3'-spiro-3''-1H-indole-2,2''(3H,3''H)-dione methanol solvate","","- C27 H22 Br3 N3 O4 -","- C27 H22 Br3 N3 O4 -","- C216 H176 Br24 N24 O32 -","8","1","BT6439","P. R. Seshadri; S. Selvanayagam; D. Velmurugan; K. Ravikumar; A. R. Sureshbabu; R. Raghunathan","5,7-Dibromo-4'-(4-bromobenzoyl)-1'-methyl-1<i>H</i>-indole-3-spiro-2'-pyrrolidine-3'-spiro-3''-1<i>H</i>-indole-2,2''(3<i>H</i>,3''<i>H</i>)-dione methanol solvate","Acta Crystallographica Section E","2004","60","5","o870","o872","10.1107/S1600536804009304","","","0.71073","MoKα","","0.113","0.0553","","","0.1456","0.1854","","","","","","0.911","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203548","7.4498","0.0003","19.65","0.0007","8.1251","0.0004","90","","114.316","0.004","90","","1083.91","0.09","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","tetrakis(μ-acetato-κ^2^O:O')bis[(2-aminopyridine-κN)copper(II)]","","- C18 H24 Cu2 N4 O8 -","- C18 H24 Cu2 N4 O8 -","- C36 H48 Cu4 N8 O16 -","2","0.5","BT6443","Sieroń, Lesław","Redetermination of tetrakis(μ-acetato-κ^2^<i>O</i>:<i>O</i>')bis[(2-aminopyridine-κ<i>N</i>)copper(II)]","Acta Crystallographica Section E","2004","60","5","m577","m578","10.1107/S1600536804008347","","","0.71073","MoKα","","0.0311","0.0246","","","0.0642","0.0667","","","","","","1.023","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203549","6.2604","0.0012","11.952","0.003","14.775","0.003","113.152","0.016","91.984","0.015","95.864","0.017","1007.8","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4-(2,4-Dichlorobenzylamino)-3-phenyl-5-p-tolyl-4H- 1,2,4-triazole","","- C22 H18 Cl2 N4 -","- C22 H18 Cl2 N4 -","- C44 H36 Cl4 N8 -","2","1","BT6445","Petek, Hande; Şenel, İsmet; Bekircan, Olcay; Aǧar, Erbil; Şaşmaz, Selami","4-(2,4-Dichlorobenzylamino)-3-phenyl-5-<i>p</i>-tolyl-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2004","60","5","o831","o832","10.1107/S1600536804009080","","","0.71073","MoKα","","0.2289","0.0741","","","0.0977","0.133","","","","","","0.925","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203550","7.4378","0.0015","9.165","0.0019","7.1002","0.0014","90","","116.348","0.003","90","","433.72","0.15","105","2","105","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-formylglycine","","- C3 H5 N O3 -","- C3 H5 N O3 -","- C12 H20 N4 O12 -","4","1","BT6447","Görbitz, Carl Henrik; Sagstuen, Einar","<i>N</i>-Formylglycine","Acta Crystallographica Section E","2004","60","5","o841","o843","10.1107/S1600536804009122","","","0.71073","MoKα","","0.0453","0.0431","","","0.1206","0.1224","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203551","10.3879","0.0002","11.5449","0.0003","5.7426","0.0001","90","","90","","90","","688.69","0.03","105","2","105","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","N-acetyl-L-alanine","","- C5 H9 N O3 -","- C5 H9 N O3 -","- C20 H36 N4 O12 -","4","1","BT6448","Görbitz, Carl Henrik; Sagstuen, Einar","<i>N</i>-Acetyl-<small>L</small>-alanine","Acta Crystallographica Section E","2004","60","5","o860","o862","10.1107/S1600536804009353","","","0.71073","MoKα","","0.0413","0.0367","","","0.0975","0.0999","","","","","","1.123","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203552","12.025","0.001","7.877","0.001","12.877","0.001","90","","106.03","0.01","90","","1172.3","0.2","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-(3-Bromophenyl)phthalimide","","- C14 H8 Br N O2 -","- C14 H8 Br N O2 -","- C56 H32 Br4 N4 O8 -","4","1","BT6450","Lo, Kong Mun; Ng, Seik Weng","<i>N</i>-(3-Bromophenyl)phthalimide","Acta Crystallographica Section E","2004","60","5","o848","o849","10.1107/S1600536804009547","","","0.71073","MoKα","","0.0682","0.0357","","","0.0643","0.0753","","","","","","0.989","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203553","8.095","0.002","6.448","0.002","34.733","0.003","90","","96.43","0.02","90","","1801.5","0.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(p-Anisyl)-2-carboxyethanaminium p-toluenesulfonate","","- C17 H21 N O6 S -","- C17 H21 N O6 S -","- C68 H84 N4 O24 S4 -","4","1","BT6451","Lo, Kong Mun; Ng, Seik Weng","1-(<i>p</i>-Anisyl)-2-carboxyethanaminium <i>p</i>-toluenesulfonate","Acta Crystallographica Section E","2004","60","5","o850","o851","10.1107/S1600536804009572","","","0.71073","MoKα","","0.098","0.058","","","0.138","0.166","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203554","8.6302","0.0006","24.801","0.002","13.2751","0.0009","90","","108.702","0.001","90","","2691.3","0.3","163","2","163","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Di-μ-benzylthiolato-κ^4^S:S-bis[dicarbonyl(η^5^- cyclopentadienyl)molydenum(II)]","","- C28 H24 Mo2 O4 S2 -","- C28 H24 Mo2 O4 S2 -","- C112 H96 Mo8 O16 S8 -","4","1","BT6453","Wong, Richard Chee Seng; Ooi, Mei Lee; Lo, Kong Mun; Ng, Seik Weng","Di-μ-phenylmethanethiolatobis[dicarbonyl(η^5^-cyclopentadienyl)molydenum(II)]","Acta Crystallographica Section E","2004","60","5","m687","m689","10.1107/S1600536804009936","","","0.71073","MoKα","","0.0444","0.0252","","","0.0466","0.0499","","","","","","0.902","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203555","11.325","0.001","16.104","0.001","22.723","0.001","74.15","0.01","86.1","0.01","69.52","0.01","3732.9","0.5","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-phenylmethanethiolato-μ-sulfido-bis[carbonyl(η^5^- cyclopentadienyl)molybdenum(III)]","","- C26 H24 Mo2 O2 S3 -","- C26 H24 Mo2 O2 S3 -","- C156 H144 Mo12 O12 S18 -","6","3","BT6454","Wong, Richard Chee Seng; Ooi, Mei Lee; Ng, Seik Weng","Di-μ-phenylmethanethiolato-μ-sulfido-bis[carbonyl(η^5^-cyclopentadienyl)molybdenum(III)]","Acta Crystallographica Section E","2004","60","5","m690","m692","10.1107/S1600536804009948","","","0.71073","MoKα","","0.0996","0.0663","","","0.1957","0.2157","","","","","","1.067","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203556","7.646","0.001","28.05","0.006","7.67","0.001","90","","118.65","0.01","90","","1443.6","0.4","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Dibromophakellin methanol hemisolvate","","- C11.5 H13 Br2 N5 O1.5 -","- C11.495 H12.98 Br2 N5 O1.495 -","- C45.98 H51.92 Br8 N20 O5.98 -","4","2","CF6316","Shi Hai Xu; Xiao Jian Liao; Xiang Chao Zeng; Kai Yang","Dibromophakellin methanol hemisolvate","Acta Crystallographica Section E","2004","60","5","o782","o783","10.1107/S1600536804006622","","","0.71073","MoKα","","0.0804","0.0367","","","0.0624","0.0669","","","","","","0.804","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2203557","11.627","0.001","10.1214","0.0007","25.461","0.002","90","","111.326","0.003","90","","2791.1","0.4","150","","150","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3,5-di-tert-butyl-2-hydroxybenzaldehyde","","- C15 H22 O2 -","- C15 H22 O2 -","- C120 H176 O16 -","8","2","CF6340","Duncan M. Tooke; Anthony L. Spek","3,5-Di-<i>tert</i>-butyl-2-hydroxybenzaldehyde","Acta Crystallographica Section E","2004","60","5","o766","o767","10.1107/S160053680400830X","","","0.71073","MoKα","","0.0788","0.0526","","","0.1292","0.1461","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203558","13.872","0.005","9.578","0.006","9.178","0.001","90","","125.35","0.014","90","","994.6","0.7","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","Bis(L-ornithinium) chloride nitrate sulfate","Bis(L-ornithinium) chlorid nitrate sulfate","","- C10 H28 Cl N5 O11 S -","- C10 H28 Cl N5 O11 S -","- C20 H56 Cl2 N10 O22 S2 -","2","0.5","CI6349","S. Ramaswamy; B. Sridhar; V. Ramakrishnan; R. K. Rajaram","Bis(<small>L</small>-ornithinium) chloride nitrate sulfate","Acta Crystallographica Section E","2004","60","5","o768","o770","10.1107/S1600536804007238","","","0.71073","MoKα","","0.0514","0.0383","","","0.0855","0.097","","","","","","1.182","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203559","8.8249","0.001","11.92","0.0013","17.203","0.0019","90","","103.161","0.002","90","","1762.1","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis[μ-1,3-bis(2-hydroxylbenzoylimino)propane]tricopper(II) bis(perchlorate)","","- C34 H32 Cl2 Cu3 N4 O12 -","- C34 H32 Cl2 Cu3 N4 O12 -","- C68 H64 Cl4 Cu6 N8 O24 -","2","0.5","CI6353","Yang, Shi-Ping; Yang Hong; Chen, Hong-Mei; Zhang, Fan; Chen, Qiong-Qiong; Yu, Xi-Bin","A trinuclear copper complex, [Cu~3~<i>L</i>~2~](ClO~4~)~2~, where H~2~<i>L</i> is 1,3-bis(2-hydroxybenzoylimino)propane","Acta Crystallographica Section E","2004","60","5","m582","m584","10.1107/S1600536804008293","","","0.71073","MoKα","","0.0878","0.053","","","0.0995","0.1104","","","","","","0.955","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203560","6.243","0.005","16.459","0.005","10.084","0.005","90","","101.13","0.04","90","","1016.7","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-poly[[di-μ-benzoato-κ^4^O:O'-disilver(I)]-μ-1,4- diazabicyclo[2.2.2]octane-κ^2^N:N']","","- C20 H22 Ag2 N2 O4 -","- C20 H22 Ag2 N2 O4 -","- C40 H44 Ag4 N4 O8 -","2","0.5","CI6354","Yang, Shi-Ping; Chen, Hong-Mei; Zhang, Fan; Chen, Qiong-Qiong; Yu, Xi-Bin","The chain structure of <i>catena</i>-poly[[di-μ-benzoato-κ^4^<i>O</i>:<i>O</i>'-disilver(I)]-μ-1,4-diazabicyclo[2.2.2]octane-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2004","60","5","m614","m616","10.1107/S1600536804008840","","","0.71073","MoKα","","0.124","0.0546","","","0.1177","0.1478","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203561","7.002","0.004","9.438","0.008","12.658","0.006","79.56","0.05","83.85","0.04","82.98","0.06","813.4","0.9","293","","293","2","","","","","","","","5","P -1","-P 1","2","2-amino-4,6-dimethylpyrimidinium bromide 2-amino-4,6-dimethylpyrimidine monohydrate","2-amino-4,6-dimethylpyrimidinium bromide 2-amino-4,6-dimethylpyrimidine monohydrate","","- C12 H21 Br N6 O -","- C12 H21 Br N6 O -","- C24 H42 Br2 N12 O2 -","2","1","CI6355","Panneerselvam, Pathus; Muthiah, Packianathan Thomas; Francis, Savarimuthu","Co-existence of water-mediated and normal base pairs in a supramolecular ribbon in 2-amino-4,6-dimethylpyrimidinium bromide 2-amino-4,6-dimethylpyrimidine monohydrate","Acta Crystallographica Section E","2004","60","5","o747","o749","10.1107/S1600536804007597","","","0.71073","MoKα","","0.0739","0.0451","","","0.1134","0.136","","","","","","1.14","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203562","5.6556","0.0006","6.3747","0.0007","11.637","0.002","101.809","0.006","96.159","0.008","106.986","0.005","386.45","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Hexaaquamanganese(II) benzene-1,4-dioxyacetate","","- C10 H20 Mn O12 -","- C10 H20 Mn O12 -","- C10 H20 Mn O12 -","1","0.5","CI6356","Liu, Ji-Wei; Gao, Shan; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","Hexaaquamanganese(II) benzene-1,4-dioxyacetate","Acta Crystallographica Section E","2004","60","5","m517","m518","10.1107/S1600536804007354","","","0.71073","MoKα","","0.053","0.05","","","0.167","0.169","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203563","14.217","0.002","14.217","0.002","15.852","0.003","90","","90","","120","","2774.8","0.8","150","2","150","2","","","","","","","","4","R -3 :H","-R 3","148","","Bis(triphenyltelluronium) hexachlorotellurate","","- C36 H30 Cl6 Te3 -","- C36 H30 Cl6 Te3 -","- C108 H90 Cl18 Te9 -","3","0.166667","CI6357","Närhi, Sari M.; Oilunkaniemi, Raija; Laitinen, Risto S.; Ahlgrén, Markku","Bis(triphenyltelluronium) hexachlorotellurate","Acta Crystallographica Section E","2004","60","5","o798","o800","10.1107/S1600536804008050","","","0.71073","MoKα","","0.0373","0.032","","","0.0811","0.0828","","","","","","1.103","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203564","11.264","0.002","12.324","0.003","16.137","0.003","98.05","0.03","110.25","0.03","107.55","0.03","1927.6","1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","{2-[(1,5-Dimethyl-2-phenyl-3-oxo-2,3-dihydro-1H-pyrazol-4- ylimino)methyl]phenoxy}acetic acid‒methanol (2/1)","","- C20.5 H21 N3 O4.5 -","- C20.5 H21 N3 O4.5 -","- C82 H84 N12 O18 -","4","2","CI6358","You, Zhong-Lu; Zhu, Hai-Liang; Liu, Wei-Sheng","{2-[(1,5-Dimethyl-2-phenyl-3-oxo-2,3-dihydro-1<i>H</i>-pyrazol-4-ylimino)methyl]phenoxy}acetic acid methanol hemisolvate","Acta Crystallographica Section E","2004","60","5","o801","o803","10.1107/S1600536804008281","","","0.71073","MoKα","","0.186","0.0677","","","0.0933","0.1228","","","","","","0.889","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203565","19.227","0.004","14.948","0.003","36.427","0.007","90","","90","","90","","10469","4","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","Tris[2-(cyclopropyliminomethyl)phenolato]manganese(III)","","- C30 H30 Mn N3 O3 -","- C30 H30 Mn N3 O3 -","- C480 H480 Mn16 N48 O48 -","16","2","CI6361","You, Zhong-Lu; Zhu, Hai-Liang; Liu, Wei-Sheng","Tris[2-(cyclopropyliminomethyl)phenolato]manganese(III)","Acta Crystallographica Section E","2004","60","5","m603","m605","10.1107/S1600536804009018","","","0.71073","MoKα","","0.1787","0.0686","","","0.1506","0.1842","","","","","","0.897","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203566","9.5319","0.0008","10.1713","0.0009","16.4797","0.0014","85.428","0.001","80.718","0.001","79.379","0.001","1547.7","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","μ-Terephthalato-bis[aquachloro(1,10-phenanthroline)copper(II)] μ-terephthalato-bis[diaqua(1,10-phenanthroline)cuprate(II)] dichloride dihydrate","","- C64 H56 Cl4 Cu4 N8 O16 -","- C64 H56 Cl4 Cu4 N8 O16 -","- C64 H56 Cl4 Cu4 N8 O16 -","1","0.5","CI6362","Fan Chen; Xin-Hua Li; Hong-Ping Xiao; Mao-Lin Hu","μ-Terephthalato-bis[aquachloro(1,10-phenanthroline)copper(II)] μ-terephthalato-bis[diaqua(1,10-phenanthroline)cuprate(II)] dichloride dihydrate","Acta Crystallographica Section E","2004","60","5","m708","m710","10.1107/S1600536804010086","","","0.71073","MoKα","","0.0762","0.0686","","","0.1442","0.1488","","","","","","1.241","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203567","8.364","0.004","9.463","0.005","22.411","0.012","90","","90","","90","","1773.8","1.6","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","catena-Poly[[[2-(2-pyridinyl)-4,4,5,5-tetramethylimidazoline-1- oxyl]thiocyanatonickel(II)]-μ-thiocyanato]","","- C14 H16 N5 Ni O S2 -","- C14 H16 N5 Ni O S2 -","- C56 H64 N20 Ni4 O4 S8 -","4","1","CI6363","Wang, Shu-Ping; Gao, Dong-Zhao; Liao, Dai-Zheng; Jiang, Zong-Hui","A one-dimensional polymeric nickel(II) complex of an imino nitroxide radical with thiocyanate bridges","Acta Crystallographica Section E","2004","60","5","m682","m684","10.1107/S1600536804009717","","","0.71073","MoKα","","0.0789","0.0511","","","0.102","0.1115","","","","","","1.082","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203568","18.7025","0.0015","7.9183","0.0008","10.6063","0.0012","90","","106.007","0.007","90","","1509.8","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","5-Bromo-2-hydroxybenzaldehyde (4-phenyl-1,3-thiazol-2-yl)hydrazone","","- C16 H12 Br N3 O S -","- C16 H12 Br N3 O S -","- C64 H48 Br4 N12 O4 S4 -","4","1","CI6366","Sadık, Genç; Necmi, Dege; \?Ibrahim, Yılmaz; Alaaddin, Çukurovalı; Dinçer, Muharrem","5-Bromo-2-hydroxybenzaldehyde (4-phenyl-1,3-thiazol-2-yl)hydrazone","Acta Crystallographica Section E","2004","60","5","o889","o891","10.1107/S1600536804009705","","","0.71073","MoKα","","0.1153","0.0378","","","0.0666","0.0825","","","","","","0.8","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203569","30.554","0.006","8.424","0.0017","7.727","0.0015","90","","90","","90","","1988.8","0.7","293","2","293","2","","","","","","","","5","C m c 21","C 2c -2","36","","[N,N'-bis(2-hydroxynaphthalmethenylimino)-1,3-propanediaminato]cobalt(II)","","- C25 H20 Co N2 O2 -","- C25 H20 Co N2 O2 -","- C100 H80 Co4 N8 O8 -","4","0.5","CI6367","You, Zhong-Lu; Zhu, Hai-Liang; Liu, Wei-Sheng","[<i>N,N</i>'-Bis(2-hydroxynaphthylmethylene)-1,3-propanediaminato]cobalt(II)","Acta Crystallographica Section E","2004","60","5","m654","m656","10.1107/S1600536804009559","","","0.71073","MoKα","","0.0503","0.0421","","","0.0925","0.0958","","","","","","1.002","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203570","12.387","0.003","12.816","0.003","6.766","0.001","90","","98.42","0.03","90","","1062.5","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Hexaaquacobalt(II) bis[(4-oxo-4H-pyridin-1-yl)acetate] dihydrate","","- C14 H28 Co N2 O14 -","- C14 H28 Co N2 O14 -","- C28 H56 Co2 N4 O28 -","2","0.5","CI6368","Zhu-Yan Zhang; Shan Gao; Li-Hua Huo; Hui Zhao; Jing-Gui Zhao; Ng, Seik Weng","Hexaaquacobalt(II) bis[(4-oxo-4<i>H</i>-pyridin-1-yl)acetate] dihydrate","Acta Crystallographica Section E","2004","60","5","m676","m678","10.1107/S1600536804009675","","","0.71073","MoKα","","0.029","0.027","","","0.079","0.08","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203571","10.55","0.002","7.099","0.001","13.056","0.003","90","","113.7","0.03","90","","895.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetraaquabis[(2-oxo-1,2-dihydropyridin-1-yl)acetato]magnesium(II)","","- C14 H20 Mg N2 O10 -","- C14 H20 Mg N2 O10 -","- C28 H40 Mg2 N4 O20 -","2","0.5","CI6369","Shan Gao; Li-Hua Huo; Zhu-Yan Zhang; Li-Li Kong; Jing-Gui Zhao","Tetraaquabis[(2-oxo-4<i>H</i>-pyridin-1-yl)acetato]magnesium(II)","Acta Crystallographica Section E","2004","60","5","m679","m681","10.1107/S1600536804009687","","","0.71073","MoKα","","0.048","0.043","","","0.12","0.12","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203572","11.8709","0.0009","16.2732","0.001","10.8433","0.0007","90","","94.656","0.006","90","","2087.8","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","NG38","N-[2-(Azepan-1-yl)-9-isopropyl-9H-purin-6-yl]-4-methoxybenzylamine","","- C22 H30 N6 O -","- C22 H30 N6 O -","- C88 H120 N24 O4 -","4","1","CI6370","Trávníček, Zdeněk; Zatloukal, Marek","<i>N</i>-[2-(Azepan-1-yl)-9-isopropyl-9<i>H</i>-purin-6-yl]-4-methoxybenzylamine","Acta Crystallographica Section E","2004","60","5","o924","o926","10.1107/S1600536804010207","","","0.71073","MoKα","","0.0424","0.0352","","","0.0926","0.0968","","","","","","1.063","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203573","14.7692","0.0011","7.4051","0.0005","11.5752","0.0014","90","","106.898","0.008","90","","1211.3","0.2","293","2","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-{4-[(2-Hydroxybenzylidene)amino]phenyl}ethanone","","- C15 H13 N O2 -","- C15 H13 N O2 -","- C60 H52 N4 O8 -","4","1","CV6285","Yüce, Süheyla; Özek, Arzu; Albayrak, Çiǧdem; Odabas̨oǧlu, Mustafa; Büyükgüngör, Orhan","A redetermination of 1-{4-[(2-hydroxybenzylidene)amino]phenyl}ethanone","Acta Crystallographica Section E","2004","60","5","o718","o719","10.1107/S160053680400741X","","","0.71073","MoKα","","0.0587","0.0376","","","0.0931","0.1004","","","","","","0.97","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203574","7.775","0.0002","20.118","0.0005","10.59","0.0003","90","","103.888","0.0015","90","","1608.04","0.07","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Adeninium perchlorate adenine dihydrate","","- C10 H15 Cl N10 O6 -","- C10 H15 Cl N10 O6 -","- C40 H60 Cl4 N40 O24 -","4","1","CV6292","Zeleňák, Vladimír; Vargová, Zuzana; Císařová, Ivana","Adeninium perchlorate adenine dihydrate","Acta Crystallographica Section E","2004","60","5","o742","o744","10.1107/S1600536804007640","","","0.7107","MoKα","","0.0738","0.0421","","","0.1202","0.1376","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203575","6.999","0.005","11.569","0.005","29.441","0.01","90","","90","","90","","2384","2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","17a-Allyl-3β-pyrrolidino-17a-aza-D-homoandrost-5-ene monohydrate","","- C26 H44 N2 O -","- C26 H44 N2 O -","- C104 H176 N8 O4 -","4","1","CV6293","Vasuki, G.; Parthasarathi, V.; Thamotharan, S.; Ramamurthi, K.; Piplani, P.; Jindal, D.P.","17<i>a</i>-Allyl-3β-pyrrolidino-17<i>a</i>-aza-<small>D</small>-homoandrost-5-ene monohydrate","Acta Crystallographica Section E","2004","60","5","o745","o746","10.1107/S160053680400786X","","","0.71073","MoKα","","0.0985","0.0503","","","0.142","0.1689","","","","","","0.955","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203576","11.0826","0.0003","12.1879","0.0003","20.7505","0.0005","90","","90","","90","","2802.85","0.12","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C9 H12 N4 Ni O6 S2 -","- C9 H12 N4 Ni O6 S2 -","- C72 H96 N32 Ni8 O48 S16 -","8","1","CV6294","Jia-Geng Liu; Duan-Jun Xu","Diaqua(2,2'-diamino-4,4'-bi-1,3-thiazole)(malonato)nickel(II)","Acta Crystallographica Section E","2004","60","5","m541","m543","10.1107/S1600536804008013","","","0.71073","MoKα","","0.027","0.024","","","0.058","0.059","","","","","","1.084","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203577","10.9118","0.0003","11.0998","0.0002","17.4255","0.0004","87.9607","0.0009","81.5984","0.0009","75.2901","0.001","2019.47","0.08","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","Dimethyl sulfoxide/chloroform clathrate of (dimethyl sulfoxide)(tetraphenylporphyrinato)zinc(II)","","- C47.79 H38.95 Cl0.63 N4 O1.79 S1.79 Zn -","- C47.79 H38.95 Cl0.63 N4 O1.79 S1.79 Zn -","- C95.58 H77.9 Cl1.26 N8 O3.58 S3.58 Zn2 -","2","1","CV6295","Vinodu, Mikki; Goldberg, Israel","A dimethyl sulfoxide/chloroform clathrate of (dimethyl sulfoxide)(tetraphenylporphyrinato)zinc(II)","Acta Crystallographica Section E","2004","60","5","m579","m581","10.1107/S1600536804008591","","","0.71073","MoKα","","0.0634","0.0428","","","0.1002","0.1118","","","","","","1.017","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203578","10.604","0.005","7.922","0.005","11.116","0.005","90","","117.965","0.005","90","","824.8","0.7","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-Phenyl-1,3,4-thiadiazol-2-amine","","- C8 H7 N3 S -","- C8 H7 N3 S -","- C32 H28 N12 S4 -","4","1","CV6296","Sema Öztürk; Mehmet Akkurt; Ahmet Cansız; Metin Koparır; Mehmet Şekerci; Frank W. Heinemann","2-Amino-5-phenyl-1,3,4-thiadiazole at 110K","Acta Crystallographica Section E","2004","60","5","o820","o821","10.1107/S1600536804008608","","","0.71069","MoKα","","0.0556","0.035","","","0.072","0.0781","","","","","","1.035","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203579","9.9464","0.0009","12.5099","0.0012","12.5779","0.0009","90","","110.585","0.003","90","","1465.1","0.2","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Piperazinium aqua-bis(oxalato)-oxo-vanadium(IV) sesquihydrate","Piperazinium aquabis(oxalato)oxovanadium(IV) sesquihydrate","","- C8 H17 N2 O11.5 V -","- C8 H14 N2 O11.5 V -","- C32 H56 N8 O46 V4 -","4","1","CV6297","Lin, Ling; Wu, Shufang; Huang, Changcang; Zhang, Hanhui; Huang, Xihe; Lian, Zhaoxun","Piperazinium aquabis(oxalato)oxovanadate(IV) sesquihydrate","Acta Crystallographica Section E","2004","60","5","m631","m633","10.1107/S1600536804008918","","","0.71069","MoKα","","0.0585","0.0352","","","0.099","0.1055","","","","","","0.918","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2203580","6.289","0.002","7.679","0.003","12.686","0.005","76.147","0.007","88.002","0.007","70.902","0.007","561.5","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","bis(hydrogen pyrazine-2,3-dicarboxylate)copper(II) N,N'-dimethylformamide disolvate","","- C18 H20 Cu N6 O10 -","- C18 H20 Cu N6 O10 -","- C18 H20 Cu N6 O10 -","1","0.5","CV6298","Guang-Qi Xiang; Nan-Wen Zhu; Mao-Lin Hu; Hong-Ping Xiao; Xiao-Xia Chen","Polymeric bis(hydrogen pyrazine-2,3-dicarboxylato)copper(II) <i>N</i>,<i>N</i>'-dimethylformamide disolvate","Acta Crystallographica Section E","2004","60","5","m647","m649","10.1107/S1600536804009249","","","0.71073","MoKα","","0.099","0.0958","","","0.2619","0.2639","","","","","","1.227","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203581","5.5079","0.0001","13.1233","0.0006","14.3414","0.0007","90","","90","","90","","1036.62","0.07","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","3-(1H-1,2,4-Triazole-3-ylsulfanylmethyl)benzoic acid","","- C10 H9 N3 O2 S -","- C10 H9 N3 O2 S -","- C40 H36 N12 O8 S4 -","4","1","CV6299","Han, Lei; Zhou, You-Fu; Wang, Rui-Hu; Hong, Mao-Chun","3-(1<i>H</i>-1,2,4-Triazol-3-ylsulfanylmethyl)benzoic acid","Acta Crystallographica Section E","2004","60","5","o813","o814","10.1107/S1600536804008785","","","0.71073","MoKα","","0.0852","0.0578","","","0.1152","0.1328","","","","","","1.261","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2203582","6.401","0.002","11.5","0.004","13.932","0.004","90","","91.908","0.005","90","","1025","0.6","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tricarbonyl(η^6^-trifluoromethylbenzene)chromium(0)","","- C10 H5 Cr F3 O3 -","- C10 H5 Cr F3 O3 -","- C40 H20 Cr4 F12 O12 -","4","1","CV6300","Zeller, Matthias; Hunter, Allen D.; Perrine, Cynthia L.; Payton , John","Tricarbonyl(η^6^-trifluoromethylbenzene)chromium(0)","Acta Crystallographica Section E","2004","60","5","m668","m669","10.1107/S1600536804009584","","","0.71073","MoKα","","0.0313","0.0287","","","0.0794","0.0811","","","","","","1.087","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203583","6.4048","0.0008","11.0668","0.0014","12.7124","0.0016","90","","102.94","0.002","90","","878.18","0.19","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H5 Cr F O3 -","- C9 H5 Cr F O3 -","- C36 H20 Cr4 F4 O12 -","4","1","CV6301","Zeller, Matthias; Hunter, Allen D.; Perrine, Cynthia L.; Payton , John","Tricarbonyl(η^6^-fluorobenzene)chromium","Acta Crystallographica Section E","2004","60","5","m650","m651","10.1107/S1600536804009250","","","0.71073","MoKα","","0.0262","0.0251","","","0.0694","0.0704","","","","","","1.083","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203584","7.954","0.0007","8.6902","0.0007","12.4984","0.0008","108.342","0.006","94.66","0.006","96.76","0.007","807.88","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-(4-Chlorophenacyl)-4-methyl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2(1H)- one","","- C19 H20 Cl N O2 -","- C19 H20 Cl N O2 -","- C38 H40 Cl2 N2 O4 -","2","1","CV6302","Dmitry V. Albov; Victor B. Rybakov; Eugene V. Babaev; Leonid A. Aslanov","1-(4-Chlorophenacyl)-4-methyl-6,7,8,9-tetrahydro-5<i>H</i>-cyclohepta[<i>b</i>]pyridin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2004","60","5","o894","o895","10.1107/S1600536804009730","","","1.5418","CuKα","","0.0448","0.0411","","","0.1032","0.1059","","","","","","1.059","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2203585","6.659","0.001","5.811","0.001","25.992","0.007","90","0.02","91.51","0.02","90","","1005.4","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","ethyl 3-(3,4-dihydroxyphenyl)-2-propenoate","","- C11 H12 O4 -","- C11 H12 O4 -","- C44 H48 O16 -","4","1","CV6303","Chun-Nian Xia; Wei-Xiao Hu; Guo-Wu Rao","Ethyl 3-(3,4-dihydroxyphenyl)-2-propenoate","Acta Crystallographica Section E","2004","60","5","o913","o914","10.1107/S1600536804009961","","","0.71073","MoKα","","0.0511","0.0343","","","0.0931","0.1026","","","","","","1.078","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203586","22.979","0.005","8.718","0.0017","15.697","0.003","90","","90","","90","","3144.6","1.1","293","2","298","2","","","","","","","","3","C m c a","-C 2ac 2","64","","1,2,3,5,6,7,8,9-Octachloro-cyclopenta[def]phenanthren-4-one","","- C15 Cl8 O -","- C15 Cl8 O -","- C120 Cl64 O8 -","8","","CV6304","Ying Peng; Su-Yuan Xie; Shun-Liu Deng; Rong-Bin Huang; Lan-Sun Zheng","1,2,3,5,6,7,8,9-Octachlorocyclopenta[<i>def</i>]phenanthren-4-one","Acta Crystallographica Section E","2004","60","5","o899","o900","10.1107/S1600536804009973","","","0.71073","MoKα","","0.0849","0.0498","","","0.0975","0.1099","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203587","7.5389","0.0012","10.3932","0.0013","14.8992","0.0013","90","","93.881","0.006","90","","1164.7","0.3","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H12 N2 O3 -","- C13 H12 N2 O3 -","- C52 H48 N8 O12 -","4","1","DN6131","Arıcı, Cengiz; Ülkü, Dinçer; Saçmacı, Mustafa; Üngören, Ş. Hakan; Akçamur, Yunus","4-Acetyl-5-methyl-1-phenyl-1<i>H</i>-pyrazole-3-carboxylic acid","Acta Crystallographica Section E","2004","60","5","o865","o867","10.1107/S1600536804009377","","","0.71073","MoKα","","0.0925","0.0402","","","0.0928","0.1086","","","","","","1","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203588","6.191","0.0006","25.697","0.002","13.245","0.0011","90","","92.249","0.005","90","","2105.5","0.3","180","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H24 N2 Si2 -","- C20 H24 N2 Si2 -","- C80 H96 N8 Si8 -","4","1","DN6133","Khan, Muhammad S.; Ahrens, Birte; Male, Louise; Raithby, Paul R.","5,5'-Bis(trimethylsilylethynyl)-2,2'-bipyridine","Acta Crystallographica Section E","2004","60","5","o915","o916","10.1107/S1600536804010128","","","0.71073","MoKα","","0.0915","0.045","","","0.0958","0.1103","","","","","","0.995","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203589","7.927","0.002","8.185","0.002","10.018","0.002","65","0.02","72.01","0.02","62.82","0.02","518.6","0.2","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","1-(3,4-dimethoxyphenyl)propane-1,2-dione","","- C11 H12 O4 -","- C11 H12 O4 -","- C22 H24 O8 -","2","1","FL6091","Hartung, Jens; Špehar, Kristina; Svoboda, Ingrid; Fuess, Hartmut","An axially chiral 1,2-diketone: 1-(3,4-dimethoxyphenyl)propane-1,2-dione","Acta Crystallographica Section E","2004","60","5","o750","o751","10.1107/S1600536804007755","","","0.71073","MoKα","","0.0985","0.0443","","","0.1076","0.1339","","","","","","0.843","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203590","6.169","0.002","5.41","0.002","22.606","0.004","90","","95.97","0.02","90","","750.4","0.4","300","2","300","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Indan-1,2-dione 2-oxime","","- C9 H7 N O2 -","- C9 H7 N O2 -","- C36 H28 N4 O8 -","4","1","FL6093","Hartung, Jens; Špehar, Kristina; Svoboda, Ingrid; Fuess, Hartmut","An instance of tandem hydrogen bonding: the geometry of indan-1,2-dione 2-oxime in the solid state","Acta Crystallographica Section E","2004","60","5","o752","o753","10.1107/S1600536804007767","","","0.71073","MoKα","","0.0758","0.0439","","","0.0943","0.1067","","","","","","1.044","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203591","7.126","0.001","7.898","0.001","13.684","0.002","77.698","0.009","85.43","0.01","65.21","0.009","683.09","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-[(2-Hydroxy-5-methylphenylamino)methylene]naphthalen-2(1H)-one","","- C18 H15 N O2 -","- C18 H15 N O2 -","- C36 H30 N2 O4 -","2","1","FL6094","Özek, Arzu; Yüce, Süheyla; Albayrak, Çiǧdem; Odabaşoǧlu, Mustafa; Büyükgüngör, Orhan","1-[(2-Hydroxy-5-methylphenylamino)methylene]naphthalen-2(1<i>H</i>)-one","Acta Crystallographica Section E","2004","60","5","o828","o830","10.1107/S1600536804008827","","","0.71073","MoKα","","0.1041","0.0468","","","0.1056","0.1209","","","","","","0.878","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203592","6.3452","0.0002","18.6256","0.0006","12.1664","0.0004","90","","92.284","0.002","90","","1436.72","0.08","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-Aminoclyhexanol, (4-hydroxyclyhexyl)-carbamic acid (1:1)","4-ammoniocyclohexanol‒(4-hydroxycyclohexyl)carbamate (1/1)","","- C13 H26 N2 O4 -","- C13 H26 N2 O4 -","- C52 H104 N8 O16 -","4","1","FL6095","Archan Dey; Gautam R. Desiraju; Raju Mondal; Judith A. K.Howard","A 1:1 molecular complex of 4-aminocyclohexanol and (4-hydroxycyclohexyl)carbamic acid","Acta Crystallographica Section E","2004","60","5","o857","o859","10.1107/S1600536804009134","","","0.71073","MoKα","","0.0544","0.0372","","","0.0918","0.1021","","","","","","1.014","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203593","6.441","0.001","9.4467","0.0003","9.6323","0.0001","88.518","0.002","74.744","0.002","76.66","0.002","549.8","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Poly[diaqua(μ~6~-benzene-1,2,4,5-tetracarboxylato)(μ~6~-2,5- dicarboxybenzene-1,4-dicarboxylato)dilanthanum(III)]","","- C20 H10 La2 O18 -","- C20 H10 La2 O18 -","- C20 H10 La2 O18 -","1","0.5","FL6096","Yi-Hang Wen; Jian Zhang; Zhao-Ji Li; Ye-Yan Qin; Yao Kang; Rui-Feng Hu; Jian-Kai Cheng; Yuan-Gen Yao","Poly[diaqua(μ~6~-benzene-1,2,4,5-tetracarboxylato)(μ~6~-2,5-dicarboxybenzene-1,4-dicarboxylato)dilanthanum(III)]","Acta Crystallographica Section E","2004","60","5","m535","m537","10.1107/S1600536804007779","","","0.71073","MoKα","","","0.0291","","","0.0732","0.0781","","","","","","0.997","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203594","13.355","0.007","10.261","0.005","18.159","0.01","90","","107.946","0.009","90","","2367","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-{[1-(Methoxycarbonyl)-3-(methylsulfanyl)propylamino](phenyl)methylidene} 3-methyl-1-phenylpyrazol-5(4H)-one","","- C24 H27 N3 O3 S -","- C24 H27 N3 O3 S -","- C96 H108 N12 O12 S4 -","4","1","FL6098","Hai-Zhen Xu; You-Quan Zhu; Xin Zhang; Xu Chen; Hua-Ling Zhu","4-{[1-(Methoxycarbonyl)-3-(methylsulfanyl)propylamino](phenyl)methylidene}3-methyl-1-phenylpyrazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2004","60","5","o835","o836","10.1107/S1600536804009158","","","0.71073","MoKα","","0.1453","0.0628","","","0.152","0.199","","","","","","1.027","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203595","20.027","0.001","18.774","0.001","29.771","0.002","90","","90","","90","","11193.5","1.1","110","2","110","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","Tetrakis(2,2'-bipyridine)tetra-μ~3~-hydroxo-di-μ-trifluoroacetato- tetracobalt(II) diiodide diacetonitrile monohydrate","","- C48 H44 Co4 F6 I2 N10 O9 -","- C48 H44 Co4 F6 I2 N10 O9 -","- C384 H352 Co32 F48 I16 N80 O72 -","8","1","FL6099","Zhao, Hanhua; Bacsa, John; Kim R. Dunbar","Tetrakis(2,2'-bipyridine)tetra-μ~3~-hydroxo-di-μ-trifluoroacetato-tetracobalt(II) diiodide diacetonitrile monohydrate: a compound containing a tetranuclear `cubane'-type cobalt(II) core","Acta Crystallographica Section E","2004","60","5","m637","m640","10.1107/S1600536804008979","","","0.71073","MoKα","","0.0914","0.0582","","","0.1246","0.1388","","","","","","1.038","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203596","10.732","0.001","12.442","0.001","15.523","0.001","106.244","0.002","73.645","0.002","102.621","0.002","1887.4","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","μ-1,2-Bis(dicyclohexylphosphino)ethane-κ^2^P:P'- bis{[1,2-bis(dicyclohexylphosphino)ethane-κ^2^P,P']palladium(0)}","","- C78 H144 P6 Pd2 -","- C78 H144 P6 Pd2 -","- C78 H144 P6 Pd2 -","1","0.5","FL6100","Boyle, Robert C.; Mague, Joel T.; Fink, Mark J.","μ-1,2-Bis(dicyclohexylphosphino)ethane-κ^2^<i>P</i>:<i>P</i>'-bis{[1,2-bis(dicyclohexylphosphino)ethane-κ^2^<i>P,P</i>']palladium(0)}","Acta Crystallographica Section E","2004","60","5","m625","m627","10.1107/S1600536804008980","","","0.71073","MoKα","","0.0607","0.0413","","","0.0848","0.0893","","","","","","0.941","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203597","13.171","0.002","4.798","0.001","13.276","0.003","90","","117.12","0.02","90","","746.7","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","1-naphthol","1-naphthalenol","","- C10 H8 O -","- C10 H8 O -","- C40 H32 O4 -","4","1","FL6101","Rozycka-Sokolowska, Ewa; Marciniak, Bernard; Pavlyuk, Volodymyr","Redetermination of 1-naphthalenol","Acta Crystallographica Section E","2004","60","5","o884","o885","10.1107/S1600536804009225","","","0.71069","MoKα","","0.0519","0.0374","","","0.1055","0.1125","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203598","9.597","0.002","10.09","0.002","13.577","0.003","90","","94.187","0.002","90","","1311.2","0.5","183","2","183","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","1,2-dimethyl-3-(2-nitrophenyl)-4,5-dihydroimidazolium iodide","1,2-Dimethyl-3-(2-nitrophenyl)-4,5-dihydroimidazolium iodide","","- C11 H14 I N3 O2 -","- C11 H14 I N3 O2 -","- C44 H56 I4 N12 O8 -","4","1","FL6102","Li, Dong-Hong; Hao, Jun-Sheng; Huo, Fang-Jun; Huang, Shu-Ping; Zhang, Yong-Bin; Xia, Chi-Zhong","1,2-Dimethyl-3-(2-nitrophenyl)-4,5-dihydroimidazolium iodide","Acta Crystallographica Section E","2004","60","5","o844","o845","10.1107/S160053680400916X","","","0.71073","MoKα","","0.0232","0.0211","","","0.0529","0.0539","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203599","10.7353","0.0006","11.3832","0.0002","16.0107","0.0001","76.41","0.03","71.56","0.02","62.855","0.018","1642.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H32 Mn N2 O10 -","- C36 H32 Mn N2 O10 -","- C72 H64 Mn2 N4 O20 -","2","1","HB6012","Jian Wang; Liu Ping; Yun Chen; Zheng Liu","Aquabis(<i>p</i>-methoxybenzoato)(1,10-phenanthroline)manganese(II) <i>p</i>-methoxybenzoic acid","Acta Crystallographica Section E","2004","60","5","m628","m630","10.1107/S1600536804003332","","","0.71073","MoKα","","0.0651","0.0508","","","0.1173","0.1272","","","","","","1.098","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203600","6.0875","0.0001","9.308","0.0002","9.6876","0.0002","115.97","0.001","91.039","0.001","102.127","0.002","478.68","0.018","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H22 Au2 B2 I2 N4 -","- C8 H22 Au2 B2 I2 N4 -","- C8 H22 Au2 B2 I2 N4 -","1","0.5","HB6029","Kaska, William C.; Mayer, Hermann A.; Elsegood, Mark R. J.; Horton, Peter N.; Hursthouse, Michael B.; Redshaw, Carl; Humphrey, Simon M.","[{(H~3~C)~3~NB(H)~2~NC}~2~Au][AuI~2~]: a linear chain polymer of gold(I) iodide with an unusual isocyanoborane ligand showing aurophilic behaviour","Acta Crystallographica Section E","2004","60","5","m563","m565","10.1107/S1600536804008098","","","0.71073","MoKα","","0.0516","0.0486","","","0.1226","0.1252","","","","","","1.059","","","","has coordinates,has Fobs","249787","2020-10-21","18:00:00",""
"2203601","8.2935","0.0012","14.9729","0.001","9.7568","0.0011","90","","101.192","0.011","90","","1188.5","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(4,5-diazafluorene-9-one)dicyanamidocopper(II)","","- C26 H12 Cu N10 O2 -","- C26 H12 Cu N10 O2 -","- C52 H24 Cu2 N20 O4 -","2","0.5","HB6030","Yang, Hui-Juan; Kou, Hui-Zhong; Gao, Fei; Cui, Ai-Li; Wang, Ru-Ji","Bis(4,5-diazafluoren-9-one)dicyanamidocopper(II)","Acta Crystallographica Section E","2004","60","5","m611","m613","10.1107/S1600536804008876","","","0.71073","MoKα","","0.0604","0.0434","","","0.0925","0.1018","","","","","","1.098","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203602","7.573","0.0008","12.4729","0.0014","13.5236","0.0013","90.205","0.004","101.633","0.005","100.889","0.006","1227.5","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H25 N7 Ni S3 -","- C22 H25 N7 Ni S3 -","- C44 H50 N14 Ni2 S6 -","2","1","HB6031","Han, Lei; Xu, Ying; Lou, Ben-Yong; Hong, Mao-Chun","Benzyltrimethylammonium tris(pyrimidine-2-thiolato-κ^2^<i>N,S</i>)nickelate(II)","Acta Crystallographica Section E","2004","60","5","m566","m567","10.1107/S1600536804008128","","","0.71073","MoKα","","0.0359","0.031","","","0.0677","0.07","","","","","","1.043","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2203603","10.0927","0.0005","11.0827","0.0005","24.4798","0.001","78.116","0.002","79.305","0.002","74.21","0.002","2553.9","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Bis[μ-3-(N'-methyl-4,4'-bipyridinium-1-yl)propionamidato]bis[cis- diammineplatinum(II)] hexaperchlorate dihydrate","","- C28 H48 Cl6 N10 O28 Pt2 -","- C28 H44 Cl6 N10 O27.5 Pt2 -","- C56 H88 Cl12 N20 O55 Pt4 -","2","1","HB6032","Sakai, Ken; Yokoyama, Yoshimi; Hama,Hideki; Kato, Kaoru; Ikuta, Yoshie; Tsubomura, Taro; Tanase, Tomoaki","Bis[μ-3-(<i>N</i>'-methyl-4,4'-bipyridinium-1-yl)propionamidato]bis[<i>cis</i>-diammineplatinum(II)] hexaperchlorate dihydrate: a head-to-tail isomer","Acta Crystallographica Section E","2004","60","5","m664","m667","10.1107/S1600536804009523","","","0.71073","MoKα","","0.2556","0.0603","","","0.0878","0.1206","","","","","","0.791","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203604","10.2967","0.0011","14.4563","0.0009","15.3929","0.0014","90","","95.429","0.008","90","","2281","0.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","trans-Bis(ethylenediamine)bis(p-nitrobenzoxasulfamato)copper(II)","","- C16 H22 Cu N8 O10 S2 -","- C16 H22 Cu N8 O10 S2 -","- C64 H88 Cu4 N32 O40 S8 -","4","0.5","HB6033","Kazak, Canan; Yilmaz, Veysel T.; Yazicilar, Turan K.","<i>trans</i>-Bis(ethylenediamine)bis(<i>p</i>-nitrobenzoxasulfamato)copper(II)","Acta Crystallographica Section E","2004","60","5","m593","m595","10.1107/S1600536804008773","","","0.71073","MoKα","","0.0487","0.0352","","","0.0889","0.0907","","","","","","0.907","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203605","13.185","0.003","11.229","0.002","8.73","0.0017","90","","106.7","0.03","90","","1238","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Dichlorobis(4-pyridone-κO)cobalt(II)","","- C10 H10 Cl2 Co N2 O2 -","- C10 H10 Cl2 Co N2 O2 -","- C40 H40 Cl8 Co4 N8 O8 -","4","0.5","HB6034","Gao, Shan; Lu, Zhen-Zhong; Huo, Li-Hua; Zhao, Hui; Zhao, Jing-Gui","Dichlorobis(4-pyridone-κ<i>O</i>)cobalt(II)","Acta Crystallographica Section E","2004","60","5","m609","m610","10.1107/S1600536804008943","","","0.71073","MoKα","","0.0311","0.0287","","","0.0732","0.0745","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203606","7.383","0.002","12.286","0.003","13.91","0.003","85.97","0.03","83.51","0.03","84.07","0.03","1244.8","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis{(acetato-κO)(diacetyl monoxime benzoylhydrazonato-κ^3^O,O',N)- (quinoline-κN)zinc(II)} quinoline solvate","","- C26.5 H25.5 N4.5 O4 Zn -","- C26.5 H25.5 N4.5 O4 Zn -","- C53 H51 N9 O8 Zn2 -","2","1","HB6035","Gao, Shan; Huo, Li-Hua; Liu, Ji-Wei; Wang, Chong; Zhao, Jing-Gui; Ng, Seik Weng","(Acetato-κ<i>O</i>)(diacetyl monoxime benzoylhydrazonato-κ^3^<i>O</i>,<i>O</i>',<i>N</i>)(quinoline-κ<i>N</i>)zinc(II) quinoline hemisolvate","Acta Crystallographica Section E","2004","60","5","m644","m646","10.1107/S1600536804009389","","","0.71073","MoKα","","0.071","0.051","","","0.125","0.135","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203607","9.7455","0.0007","10.0846","0.0007","14.9766","0.001","81.475","0.006","72.856","0.006","63.805","0.005","1261.76","0.17","293","","293","2","","","","","","","","6","P -1","-P 1","2","","Chloro[(N,N-dimethylamino)methylphenyl- κ^2^C^2^,N](triphenylstibine)palladium(II)","","- C27 H27 Cl N Pd Sb -","- C27 H27 Cl N Pd Sb -","- C54 H54 Cl2 N2 Pd2 Sb2 -","2","1","HB6036","Ayfer Mentes; Büyükgüngör, Orhan","Chloro[(<i>N,N</i>-dimethylamino)methylphenyl-κ^2^<i>C</i>^2^,<i>N</i>](triphenylstibine)palladium(II)","Acta Crystallographica Section E","2004","60","5","m601","m602","10.1107/S1600536804008931","","","0.71073","MoKα","","0.0403","0.0231","","","0.0422","0.0442","","","","","","0.853","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203608","17.226","0.003","10.622","0.002","12.096","0.002","90","","105.42","0.03","90","","2133.6","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dichloro(methanol-κO)[3-methoxysalicylaldehyde (4-methoxybenzoyl)hydrazonato-κ^3^O,O',N]iron(III) methanol solvate","","- C18 H23 Cl2 Fe N2 O6 -","- C18 H23 Cl2 Fe N2 O6 -","- C72 H92 Cl8 Fe4 N8 O24 -","4","1","HB6037","Huo, Li-Hua; Gao, Shan; Liu, Ji-Wei; Li, Jing; Zhao, Hui; Zhao, Jing-Gui","Dichloro(methanol-κ<i>O</i>)[3-methoxysalicylaldehyde (4-methoxybenzoyl)hydrazonato-κ^3^<i>O,O</i>',<i>N</i>]iron(III) methanol solvate","Acta Crystallographica Section E","2004","60","5","m673","m675","10.1107/S160053680400950X","","","0.71073","MoKα","","0.123","0.065","","","0.153","0.187","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203609","10.503","0.007","4.436","0.003","12.571","0.008","90","","111.161","0.008","90","","546.2","0.6","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 N2 O4 -","- C10 H10 N2 O4 -","- C20 H20 N4 O8 -","2","0.5","HG6030","Bruce, Michael I.; Kramarczuk Kathy A.; Skelton, Brian W.; White, Allan H.","Diethyl <i>trans</i>-1,2-dicyanoethene-1,2-dicarboxylate at <i>ca</i> 150K","Acta Crystallographica Section E","2004","60","5","o716","o717","10.1107/S1600536804007500","","","0.71073","MoKα","","0.085","0.055","","0.142","","0.142","","","1.095","","","1.095","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203610","9.432","0.0003","9.181","0.0004","14.937","0.0005","90","","94.369","0.002","90","","1289.71","0.08","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[bis(pyridine-κN)cobalt(II)]-μ-oxalato] 0.25-hydrate]","","- C12 H10.5 Co N2 O4.25 -","- C12 H10 Co N2 O4.25 -","- C48 H40 Co4 N8 O17 -","4","1","HG6032","Mikki Vinodu; Israel Goldberg","<i>catena</i>-Poly[[bis(pyridine-κ<i>N</i>)cobalt(II)]-μ-oxalato] 0.25-hydrate]","Acta Crystallographica Section E","2004","60","5","m527","m529","10.1107/S1600536804007512","","","0.71073","MoKα","","0.0557","0.0389","","","0.1024","0.1145","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203611","10.2616","0.0012","10.5057","0.0012","21.264","0.002","95.064","0.009","93.438","0.009","102.158","0.009","2224.9","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2,3,4,6-Tetraphenyl-2H-pyrazolo[3,4-d]pyridazin-7(6H)-one","","- C29 H20 N4 O -","- C29 H20 N4 O -","- C116 H80 N16 O4 -","4","2","HG6033","Dinçer, Muharrem; Özdemir, Namık; Yıldırım, İsmail; Demir, Elif; Akçamur, Yunus; Işık, Şamil","2,3,4,6-Tetraphenyl-2<i>H</i>-pyrazolo[3,4-<i>d</i>]pyridazin-7(6<i>H</i>)-one","Acta Crystallographica Section E","2004","60","5","o807","o809","10.1107/S1600536804008657","","","0.71073","MoKα","","0.095","0.05","","","0.0815","0.0885","","","","","","0.808","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203612","12.387","0.003","12.816","0.003","6.766","0.001","90","","98.42","0.03","90","","1062.5","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Hexaaquanickel(II) bis[(4-oxo-4H-pyridin-1-yl)acetate] dihydrate","","- C14 H28 N2 Ni O14 -","- C14 H28 N2 Ni O14 -","- C28 H56 N4 Ni2 O28 -","2","0.5","HG6034","Zhu-Yan Zhang; Shan Gao; Li-Hua Huo; Hui Zhao; Jing-Gui Zhao; Ng, Seik Weng","Hexaaquanickel(II) bis[(4-oxo-4<i>H</i>-pyridin-1-yl)acetate] dihydrate","Acta Crystallographica Section E","2004","60","5","m544","m545","10.1107/S1600536804007986","","","0.71073","MoKα","","0.033","0.029","","","0.076","0.078","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203613","8.056","0.0016","23.95","0.003","7.8057","0.0016","90","","117.069","0.014","90","","1341.1","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(1-Indanyloxy)phthalonitrile","","- C17 H12 N2 O -","- C17 H12 N2 O -","- C68 H48 N8 O4 -","4","1","HG6038","Dinçer, Muharrem; Özdemir, Namık; Akdemir, Nesuhi; Özdil, Musa; Ağar, Erbil; Büyükgüngör, Orhan","4-(1-Indanyloxy)phthalonitrile","Acta Crystallographica Section E","2004","60","5","o896","o898","10.1107/S1600536804009699","","","0.71073","MoKα","","0.1609","0.0398","","","0.0559","0.0665","","","","","","0.741","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203614","24.189","0.007","7.747","0.002","13.31","0.004","90","","120.943","0.005","90","","2139.2","1.1","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","Talatisidine","20-N-Ethyl-1,8,14-trihydroxy-16β,18-dimethoxylycoctonine","","- C23 H37 N O5 -","- C23 H37 N O5 -","- C92 H148 N4 O20 -","4","1","LH6183","Shaheen, Farzana; Ahmad, Manzoor; Anjum, Shazia; Rahman, Azhar Abdul; Fun, Hoong-Kun; Ahmad, Habib; Choudhary, M. Iqbal; Atta-ur-Rahman","20-<i>N</i>-Ethyl-1,8,14-trihydroxy-16β,18-dimethoxylycoctonine","Acta Crystallographica Section E","2004","60","5","o774","o776","10.1107/S1600536804008189","","","0.71073","MoKα","","0.0652","0.063","","","0.1302","0.1311","","","","","","1.281","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203615","8.8736","0.0006","9.6117","0.0007","12.5601","0.0009","69.48","0.005","81.12","0.006","68.915","0.005","935.62","0.12","293","2","293","","","","","","","","","5","P -1","-P 1","2","","Tetracarbonyl{2-[1-(2,6-dimethylphenylimino)ethyl]pyridine- κ^2^N,N'}molybdenum(0)","","- C19 H16 Mo N2 O4 -","- C19 H16 Mo N2 O4 -","- C38 H32 Mo2 N4 O8 -","2","1","LH6186","Ayfer Mentes; Büyükgüngör, Orhan","Tetracarbonyl{2-[1-(2,6-dimethylphenylimino)ethyl]pyridine-κ^2^<i>N,N</i>'}molybdenum(0)","Acta Crystallographica Section E","2004","60","5","m530","m531","10.1107/S1600536804007482","","","0.71073","MoKα","","0.0265","0.0226","","","0.0586","0.0595","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203616","12.088","0.005","20.492","0.009","6.289","0.003","90","","90","","90","","1557.8","1.2","110","2","","","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C8 H10 O4 -","- C8 H10 O4 -","- C64 H80 O32 -","8","2","LH6190","Darensbourg, Donald J.; Billodeaux, Damon R.; Ganguly, Poulomi","<i>cis</i>-Perhydro-1,4-benzodioxin-2,3-dione","Acta Crystallographica Section E","2004","60","5","o868","o869","10.1107/S1600536804009055","","","0.71073","MoKα","","","0.0608","","","","0.1407","","","","","","1.113","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203617","9.327","0.003","15.836","0.006","20.691","0.009","90","","101.186","0.014","90","","2998","2","170","2","170","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Astemizole tetrachlorocobaltate(II)","{3-[(4-fluorophenyl)methyl]-1H-benzimidazol-2-ylidene}{1-[2-(4- methoxyphenyl)ethyl]-4-piperidin-1-io}ammonium tetrachlorocobaltate(II)","","- C28 H33 Cl4 Co F N4 O -","- C28 H33 Cl4 Co F N4 O -","- C112 H132 Cl16 Co4 F4 N16 O4 -","4","1","LH6193","Parvez, Masood","Astemizole tetrachlorocobaltate(II)","Acta Crystallographica Section E","2004","60","5","m557","m559","10.1107/S1600536804007743","","","0.71073","MoKα","","0.143","0.065","","","0.13","0.157","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203618","9.061","0.002","10.378","0.002","11.464","0.002","78.01","0.03","67.79","0.03","81.41","0.03","973.3","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","trans-Bis{2-[3-(cyclohexylamino)propyliminomethyl]naphthalato}cobalt(III) chlorate","","- C40 H50 Cl Co N4 O6 -","- C40 H50 Cl Co N4 O6 -","- C40 H50 Cl Co N4 O6 -","1","0.5","LH6194","You, Zhong-Lu; Zhu, Hai-Liang; Liu, Wei-Sheng","<i>trans</i>-Bis{2-[3-(cyclohexylamino)propyliminomethyl]naphtholato}cobalt(III) perchlorate","Acta Crystallographica Section E","2004","60","5","m587","m589","10.1107/S1600536804008414","","","0.71073","MoKα","","0.1038","0.0752","","","0.1976","0.2129","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203619","11.371","0.009","12.369","0.011","11.61","0.008","90","","107.12","0.06","90","","1561","2","293","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H21 Br Fe O2 -","- C15 H21 Br Fe O2 -","- C60 H84 Br4 Fe4 O8 -","4","1","LH6195","Holger B. Friedrich; Martin O. Onani; Melanie Rademeyer","Bromopropyldicarbonyl(η^5^-pentamethylcyclopentadienyl)iron(II)","Acta Crystallographica Section E","2004","60","5","m551","m553","10.1107/S1600536804007962","","","0.71073","MoKα","","0.0597","0.0442","","","0.1091","0.12","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203620","9.0245","0.0018","18.407","0.004","13.516","0.003","90","","90","","90","","2245.2","0.8","298","2","298","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","1,2,3,4,4b,4c,6,7,8,9,9b,9c-Dodecachloro-4b,4c,9b,9c- tetrahydrocyclobuta[1,2-a;3,4-a']diindene-5,10-dione","","- C18 Cl12 O2 -","- C18 Cl12 O2 -","- C72 Cl48 O8 -","4","0.5","LH6196","Ying Peng; Su-Yuan Xie; La-Sheng Long; Rong-Bin Huang; Lan-Sun Zheng","1,2,3,4,4b,4c,6,7,8,9,9b,9c-Dodecachloro-4b,4c,9b,9c-tetrahydrocyclobuta[1,2-<i>a</i>;3,4-<i>a</i>']diindene-5,10-dione","Acta Crystallographica Section E","2004","60","5","o762","o763","10.1107/S1600536804008177","","","0.71073","MoKα","","0.04","0.0321","","","0.087","0.0895","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203621","10.097","0.002","10.358","0.002","8.665","0.002","103.08","0.02","101.93","0.02","78.1","0.02","851.5","0.3","295","2","295","2","","","","","","","","3","P -1","-P 1","2","","(Z)-2,3-bis(3,4-dimethoxyphenyl)-2-propen-1-ol","","- C19 H22 O5 -","- C19 H22 O5 -","- C38 H44 O10 -","2","1","LH6198","Stomberg, Rolf; Albinsson, Bo; Langer, Vratislav; Li, Shiming; Lundquist, Knut","(<i>Z</i>)-2,3-Bis(3,4-dimethoxyphenyl)-2-propen-1-ol","Acta Crystallographica Section E","2004","60","5","o804","o806","10.1107/S1600536804008578","","","0.71069","MoKα","","0.0989","0.0344","","","0.0839","0.1069","","","","","","0.999","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203622","7.9959","0.0007","6.8268","0.0007","17.2125","0.0017","90","","92.67","0.002","90","","938.55","0.16","103","1","103","1","","","","","","","","4","C 1 m 1","C -2y","8","","1-[1-(4-isopropylcyclohexyl)piperidin-4-yl]indolin-2-one","","- C22 H32 N2 O -","- C22 H32 N2 O -","- C44 H64 N4 O2 -","2","0.5","LH6199","Deschamps, Jeffrey R.; Parrish, Damon; Zaveri, Nurulain T.; Jiang, Faming","1-[1-(<i>trans</i>-4-Isopropylcyclohexyl)piperidin-4-yl]indolin-2-one, one of a novel series of nociceptin receptor ligands","Acta Crystallographica Section E","2004","60","5","o791","o792","10.1107/S1600536804008682","","","0.71073","MoKα","","0.0349","0.0339","","","0.0926","0.0932","","","","","","1.111","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203623","7.7262","0.0004","19.8316","0.001","23.6182","0.0013","90","","90","","90","","3618.8","0.3","103","2","103","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H24 Cl N O3 -","- C21 H24 Cl N O3 -","- C168 H192 Cl8 N8 O24 -","8","2","LH6200","Parrish, Damon; Chen, Weibin; Coop, Andrew; Deschamps, Jeffrey R.","7β-Chloro-6,14-<i>endo</i>-etheno-6,7,8,14-tetrahydrothebaine","Acta Crystallographica Section E","2004","60","5","o793","o794","10.1107/S1600536804008670","","","0.71073","MoKα","","0.1009","0.0541","","","0.0972","0.121","","","","","","1.227","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203624","9.334","0.002","11.78","0.002","16.303","0.003","103.54","0.03","104.82","0.03","97.78","0.03","1648","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Triaquabis(benzene-1,3-dioxyacetato)sodium(I) hexaaquachromium(III) pentahydrate","","- C20 H44 Cr Na O26 -","- C20 H44 Cr Na O26 -","- C40 H88 Cr2 Na2 O52 -","2","1","LH6201","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui; Zhao, Jing-Gui","Hexaaquachromium(III) triaquabis(benzene-1,3-dioxyacetato)sodate(I) pentahydrate","Acta Crystallographica Section E","2004","60","5","m622","m624","10.1107/S1600536804009067","","","0.71073","MoKα","","0.063","0.041","","","0.098","0.107","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203625","9.95","0.006","12.06","0.01","12.81","0.01","61.95","0.03","80.65","0.04","73.92","0.03","1302.6","1.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis[bis(1,10-phenanthroline)aquachlorozinc(II)] benzene-1,4-dioxyacetate dihydrate","","- C58 H48 Cl2 N8 O10 Zn2 -","- C58 H48 Cl2 N8 O10 Zn2 -","- C58 H48 Cl2 N8 O10 Zn2 -","1","0.5","LH6202","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui; Zhao, Jing-Gui","Bis[aquachlorobis(1,10-phenanthroline)zinc(II)] benzene-1,4-dioxyacetate dihydrate","Acta Crystallographica Section E","2004","60","5","m620","m621","10.1107/S1600536804009079","","","0.71073","MoKα","","0.058","0.042","","","0.097","0.104","","","","","","1.04","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203626","9.238","0.002","10.435","0.002","19.12","0.004","90","","91.456","0.011","90","","1842.5","0.7","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","catena-Poly[[trimethyltin(IV)]-μ-2,3-bis(4-chlorophenyl)propenoato-κ^2^O:O']","catena-Poly[[trimethyltin(IV)]-μ-2,3-bis(4-chlorophenyl)propenoato-κ^2^O:O']","","- C18 H18 Cl2 O2 Sn -","- C18 H18 Cl2 O2 Sn -","- C72 H72 Cl8 O8 Sn4 -","4","1","LH6203","Sadiq-ur-Rehman; Shouldice, Stephen R.; Ali, Saqib; Badshah, Amin; Parvez, Masood","<i>catena</i>-Poly[[trimethyltin(IV)]-μ-2,3-bis(4-chlorophenyl)propenoato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2004","60","5","m670","m672","10.1107/S1600536804009468","","","0.71073","MoKα","","0.035","0.029","","","0.071","0.073","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203627","8.6555","0.0011","8.6555","0.0011","7.8351","0.0009","90","","90","","120","","508.35","0.11","173","2","173","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- C6 H16 I N -","- C6 H16 I N -","- C12 H32 I2 N2 -","2","0.166667","LH6204","Lerner, Hans-Wolfram; Schödel, Frauke; Echensberger, David; Bolte, Michael","Rerefinement of triethylammonium iodide from new intensity data at low temperature","Acta Crystallographica Section E","2004","60","5","o863","o864","10.1107/S1600536804009183","","","0.71073","MoKα","","0.0298","0.0253","","","0.069","0.0712","","","","","","1.087","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203628","16.8447","0.0016","13.392","0.002","8.3779","0.0008","90","","95.211","0.008","90","","1882.1","0.4","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3-Phenylpyrazolium nitrate","","- C9 H9 N3 O3 -","- C9 H9 N3 O3 -","- C72 H72 N24 O24 -","8","1","LH6205","Haghiri, Alireza; Lerner, Hans-Wolfram; Wagner, Matthias; Bolte, Michael","3-Phenylpyrazolium nitrate","Acta Crystallographica Section E","2004","60","5","o876","o877","10.1107/S160053680400964X","","","0.71073","MoKα","","0.0592","0.0367","","","0.0768","0.0815","","","","","","0.9","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203629","16.4482","0.0014","19.9095","0.0017","6.7549","0.0006","90","","90","","90","","2212.1","0.3","291","2","291","2","","","","","","","","4","I b a m","-I 2 2c","72","","2-Methoxycarbonyl-4-nitroacetanilide","","- C10 H10 N2 O5 -","- C10 H10 N2 O5 -","- C80 H80 N16 O40 -","8","0.5","LH6206","Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Wardell, James L.","2-Methoxycarbonyl-4-nitroacetanilide: π-stacked chains linked in pairs by C—H···O hydrogen bonds","Acta Crystallographica Section E","2004","60","5","o852","o854","10.1107/S1600536804009195","","","0.71073","MoKα","","0.0903","0.0501","","","0.1176","0.1302","","","","","","1.008","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203630","14.9014","0.0012","12.0241","0.001","17.2103","0.0014","90","","91.288","0.002","90","","3082.9","0.4","180","2","180","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(1R,2R)-1,3-Bis(tert-butyldimethylsilyloxy)-2-(4-hydroxybutanamido)- 1-(4-nitrophenyl)propane","","- C25 H46 N2 O6 Si2 -","- C25 H46 N2 O6 Si2 -","- C100 H184 N8 O24 Si8 -","4","2","LH6210","Johansson, Dorte; Larsen, Frank B.; Bond, Andrew D.; Nielsen, Poul","(1<i>R</i>,2<i>R</i>)-1,3-Bis(<i>tert</i>-butyldimethylsilyloxy)-2-(4-hydroxybutanamido)-1-(4-nitrophenyl)propane","Acta Crystallographica Section E","2004","60","5","o907","o908","10.1107/S1600536804009870","","","0.7107","MoKα","","0.1012","0.0564","","","0.1284","0.148","","","","","","1.029","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203631","8.2492","0.0004","10.4014","0.0005","9.385","0.0005","90","","105.171","0.004","90","","777.2","0.07","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H9 N3 O3 -","- C6 H9 N3 O3 -","- C24 H36 N12 O12 -","4","1","LH6211","Tooke, Duncan M.; Spek, Anthony L.; Reedijk, Jan; Kannappan, Ramu","(2-Pyridylmethyl)ammonium nitrate","Acta Crystallographica Section E","2004","60","5","o911","o912","10.1107/S1600536804010013","","","0.71073","MoKα","","0.0777","0.0429","","","0.0847","0.0972","","","","","","1.052","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203632","3.868","0.0014","5.643","0.002","8.364","0.003","100.843","0.016","100.289","0.018","105.706","0.014","167.44","0.11","150","","150","","","","","","","","","3","P -1","-P 1","2","","","","- C6 H8 O4 -","- C6 H8 O4 -","- C6 H8 O4 -","1","0.5","LH6212","Kooijman, Huub; Sprengers, Jeroen W.; Agerbeek, Melvin J.; Elsevier, Cornelis J.; Spek, Anthony L.","Dimethyl fumarate","Acta Crystallographica Section E","2004","60","5","o917","o918","10.1107/S1600536804010177","","","0.71073","MoKα","","0.0486","0.0445","","","0.1174","0.1219","","","","","","1.109","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203633","6.8037","0.0006","7.7391","0.0008","11.9131","0.0009","84.539","0.008","74.277","0.006","78.323","0.007","590.77","0.09","298","2","","","","","","","","","","4","P 1","P 1","1","","(8aR,SS)-Dimethyl 3,5,6,7,8,8a-hexahydro-4-{[(1S)-exo-2-hydroxy-7,7- dimethylbicyclo[2.2.1]heptan-1-yl]methylsulfinyl}-1,2-naphthalenedicarboxylate","","- C24 H34 O6 S -","- C24 H34 O6 S -","- C24 H34 O6 S -","1","1","NA6310","Bruno, Giuseppe; Rotondo, Archimede; Nicoló, Francesco; Aversa, Maria Chiara; Barattucci, Anna; Bonaccorsi, Paola; Giannetto, Placido","(8a<i>R</i>,S<i>S</i>)-Dimethyl 3,5,6,7,8,8a-hexahydro-4-{[(1<i>S</i>)-<i>exo</i>-2-hydroxy-7,7-dimethylbicyclo[2.2.1]heptan-1-yl]methylsulfinyl}-1,2-naphthalenedicarboxylate","Acta Crystallographica Section E","2004","60","5","o733","o735","10.1107/S1600536804007366","","","0.71073","MoKα","","","0.0424","","","","0.1005","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203634","8.2135","0.0003","9.2262","0.0003","10.9944","0.0003","90","","108.041","0.0015","90","","792.19","0.04","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","Methyl 3,6-anhydro-4-azido-5,7-O-(S)-benzylidene-2,4-dideoxy-D-talo-heptonate","","- C15 H17 N3 O5 -","- C15 H17 N3 O5 -","- C30 H34 N6 O10 -","2","1","NA6311","Newton, Christoper R.; Horne, Graeme; Fleet, George W.J.; Nash, Robert J.; Cooper, Richard I.","Methyl 3,6-anhydro-4-azido-5,7-<i>O</i>-(<i>S</i>)-benzylidene-2,4-dideoxy-<small>D</small>-<i>talo</i>-heptonate","Acta Crystallographica Section E","2004","60","5","o839","o840","10.1107/S1600536804008165","","","0.71073","MoKα","","0.0495","0.0353","","0.0919","0.0848","0.0919","","","","","","0.8876","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203635","7.3137","0.0001","10.6657","0.0002","12.6476","0.0003","90","","90","","90","","986.59","0.03","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-C-Hydroxymethyl-2,3-O-isopropylidene-D-ribono-1,5-lactam","","- C9 H14 N O5 -","- C9 H14 N O5 -","- C36 H56 N4 O20 -","4","1","NA6312","Newton, Christopher R.; Iezzi, Simone Michela; Fleet, George W. J.; Blériot, Yves; Watkin, David J.","2-<i>C</i>-Hydroxymethyl-2,3-<i>O</i>-isopropylidene-<small>D</small>-ribono-1,5-lactam","Acta Crystallographica Section E","2004","60","5","o909","o910","10.1107/S1600536804008141","","","0.71073","MoKα","","0.0401","0.0346","","0.0871","0.0848","0.0871","","","","","","0.9789","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203636","7.878","0.002","10.584","0.004","11.184","0.004","68.25","0.03","86.54","0.02","84.4","0.02","861.7","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","ammonium quercetin-5'-sulfonate formamide solvate","ammonium 2,3-dihydroxy-5-(3,5,7-trihydroxy-4-oxo-4H-1-benzopyran-2-yl)benzenesulfonate formamide solvate","","- C16 H16 N2 O11 S -","- C16 H16 N2 O11 S -","- C32 H32 N4 O22 S2 -","2","1","NA6313","Mazur, Liliana; Tokarska, Joanna; Koziol, Anna E.; Kopacz, Maria","Ammonium quercetin-5'-sulfonate formamide solvate","Acta Crystallographica Section E","2004","60","5","o779","o781","10.1107/S1600536804008153","","","1.54178","CuKα","","0.1314","0.0489","","","0.1156","0.1425","","","","","","1.001","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203637","8.034","0.002","13.412","0.003","21.624","0.005","76.25","0.05","82.28","0.05","89.73","0.05","2241.8","1.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Tetrakis(2,3,5,6-tetrafluoro-4-iodophenyoxymethyl)methane bis(pyridine N-oxide) monohydrate","","- C39 H20 F16 I4 N2 O7 -","- C39 H20 F16 I4 N2 O7 -","- C78 H40 F32 I8 N4 O14 -","2","1","NA6314","Emanuela Guido; Pierangelo Metrangolo; Tullio Pilati; Giuseppe Resnati","Tetrakis(2,3,5,6-tetrafluoro-4-iodophenyloxymethyl)methane bis(pyridine <i>N</i>-oxide) monohydrate","Acta Crystallographica Section E","2004","60","5","o788","o790","10.1107/S1600536804008438","","","0.71073","MoKα","","0.0538","0.0381","","","0.0923","0.0993","","","","","","0.913","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203638","6.4818","0.0006","10.6714","0.0008","10.9799","0.0011","90","","90","","90","","759.48","0.12","296","1","296","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","D-Galactono-1,4-lactone","D-Galactonic 1,4-lactone","","- C6 H10 O6 -","- C6 H10 O6 -","- C24 H40 O24 -","4","1","NA6315","Amador, Patricia; Flores, Henoc; Bernès, Sylvain","<small>D</small>-Galactono-1,4-lactone: a case of wrong absolute configuration surviving three decades","Acta Crystallographica Section E","2004","60","5","o904","o906","10.1107/S1600536804009882","","","0.71073","MoKα","","0.0287","0.0266","","","0.0744","0.0763","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203639","6.3741","0.0008","19.042","0.002","11.1476","0.0014","90","","102.178","0.01","90","","1322.6","0.3","293","","293","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1-(2-piperidinoethyl)benzimidazole","","- C14 H19 N3 -","- C14 H19 N3 -","- C56 H76 N12 -","4","1","NA6316","Sevim Türktekin; Mehmet Akkurt; Nihat Şireci; Hasan Küçükbay; Orhan Büyükgüngör","1-(2-Piperidinoethyl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2004","60","5","o817","o819","10.1107/S1600536804008669","","","0.71073","MoKα","","0.1098","0.0405","","","0.0876","0.1045","","","","","","0.803","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203640","8.9029","0.0002","9.4731","0.0003","18.0856","0.0002","90","","90","","90","","1525.3","0.06","293","2","293","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","(Ethylenediamine-κ^2^N)(triethylenetetramine-κ^4^N)nickel hexafluorogermanate","","- C8 H26 F6 Ge N6 Ni -","- C8 H26 F6 Ge N6 Ni -","- C32 H104 F24 Ge4 N24 Ni4 -","4","0.5","NA6318","Guo-Ming Wang; Yan-Qiong Sun; Guo-Yu Yang","(Ethylenediamine-κ^2^<i>N</i>)(triethylenetetramine-κ^4^<i>N</i>)nickel hexafluorogermanate","Acta Crystallographica Section E","2004","60","5","m705","m707","10.1107/S1600536804009791","","","0.71073","MoKα","","0.0589","0.0534","","","0.1225","0.1259","","","","","","1.144","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203641","8.762","0.002","14.937","0.004","8.542","0.007","90","","109.659","0.006","90","","1052.8","0.9","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Methoxy-4-methyl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine","","- C12 H17 N O -","- C12 H17 N O -","- C48 H68 N4 O4 -","4","1","NA6319","Dmitry V. Albov; Victor B. Rybakov; Eugene V. Babaev; Ivan V. Fedyanin; Leonid A. Aslanov","2-Methoxy-4-methyl-6,7,8,9-tetrahydro-5<i>H</i>-cyclohepta[<i>b</i>]pyridine","Acta Crystallographica Section E","2004","60","5","o892","o893","10.1107/S1600536804009651","","","0.71073","MoKα","","0.1029","0.0672","","","0.1492","0.165","","","","","","0.898","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203642","21.177","0.004","12.291","0.003","5.627","0.001","90","","90","","90","","1464.6","0.5","150","2","150","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C18 H16 O4 -","- C18 H16 O4 -","- C72 H64 O16 -","4","1","NA6320","Arrieta, Antonio F.; Arvid Mostad","5-(4-Hydroxy-3-methoxyphenyl)-1-phenylpent-4-ene-1,3-dione","Acta Crystallographica Section E","2004","60","5","o919","o921","10.1107/S1600536804010037","","","0.71073","MoKα","","0.037","0.032","","","0.084","0.09","","","","","","1.084","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203643","9.7125","0.0015","6.8262","0.0016","15.285","0.003","90","","121.233","0.011","90","","866.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4-dimethyl-1,5,6,7-tetrahydro-2H-cyclopenta[b]pyridin-2-one","","- C10 H13 N O -","- C10 H13 N O -","- C40 H52 N4 O4 -","4","1","NA6323","Dmitry V. Albov; Victor B. Rybakov; Eugene V. Babaev; Leonid A. Aslanov","1,4-Dimethyl-1,5,6,7-tetrahydro-2<i>H</i>-cyclopenta[<i>b</i>]pyridin-2-one","Acta Crystallographica Section E","2004","60","5","o922","o923","10.1107/S1600536804010025","","","1.5418","CuKα","","0.0471","0.0448","","","0.103","0.1033","","","","","","0.87","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203644","9.984","0.003","11.082","0.004","12.196","0.005","112.954","0.004","110.05","0.004","94.017","0.003","1134.4","0.7","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","Bis{1-[(E)-2-pyridinylmethylidene]semicarbazide}cobalt(II) diperchlorate monohydrate","","- C14 H18 Cl2 Co N8 O11 -","- C14 H18 Cl2 Co N8 O11 -","- C28 H36 Cl4 Co2 N16 O22 -","2","1","NG6017","Jian Zhou; Zhen-Feng Chen; Yan-Shu Tan; Xian-Wen Wang; Yu-Hui Tan; Hong Liang; Yong Zhang","Bis{1-[(<i>E</i>)-2-pyridinylmethylidene]semicarbazide}cobalt(II) diperchlorate monohydrate","Acta Crystallographica Section E","2004","60","5","m519","m521","10.1107/S1600536804007494","","","0.71073","MoKα","","0.0659","0.0509","","","0.0992","0.1047","","","","","","1.137","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203645","11.05","0.009","18.502","0.01","9.916","0.005","90","","95.08","0.05","90","","2019","2","297","1","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H44 Cu N6 O4 -","- C46 H44 Cu N6 O4 -","- C92 H88 Cu2 N12 O8 -","2","0.5","NG6018","Akitsu, Takashiro; Einaga, Yasuaki","<i>trans</i>-Bis(5,5-diphenylhydantoinato)bis(2-phenylethylamine)copper(II)","Acta Crystallographica Section E","2004","60","5","m524","m526","10.1107/S1600536804007378","","","0.7107","MoKα","","","0.0472","","","","0.1515","","","","","","1.029","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203646","10.168","0.005","10.945","0.005","11.492","0.006","68.232","0.007","89.066","0.008","85.532","0.008","1184","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","{N,N'-Bis[(5-chloro-2-hydroxyphenyl)phenylmethylene]ethylendiaminato}nickel(II)","","- C28 H20 Cl2 N2 Ni O2 -","- C28 H20 Cl2 N2 Ni O2 -","- C56 H40 Cl4 N4 Ni2 O4 -","2","1","NG6023","He-Dong Bian; Xiao-E Yang; Qing Yu; Hong Liang; Hong-Gen Wang","{<i>N,N</i>'-Bis[(5-chloro-2-hydroxyphenyl)phenylmethylene]ethylendiaminato}nickel(II)","Acta Crystallographica Section E","2004","60","5","m685","m686","10.1107/S1600536804009663","","","0.71073","MoKα","","0.1075","0.0579","","","0.1248","0.1476","","","","","","1.003","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203647","9.529","0.001","11.471","0.001","12.633","0.002","94.391","0.009","95.409","0.008","102.888","0.005","1333.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(Acetato-κO)[benzoylacetone (4-methoxybenzoyl)hydrazonato- κ^3^O,O',N](quinoline-κN)zinc(II)","","- C29 H27 N3 O5 Zn -","- C29 H27 N3 O5 Zn -","- C58 H54 N6 O10 Zn2 -","2","1","NG6024","Gao, Shan; Huo, Li-Hua; Liu, Ji-Wei; Chi, Jia-Long; Zhao, Hui","(Acetato-κ<i>O</i>)[benzoylacetone (4-methoxybenzoyl)hydrazonato-κ^3^<i>O,O</i>',<i>N</i>](quinoline-κ<i>N</i>)zinc(II)","Acta Crystallographica Section E","2004","60","5","m693","m695","10.1107/S1600536804009808","","","0.71073","MoKα","","0.059","0.045","","","0.113","0.12","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203648","7.731","0.002","18.334","0.004","12.931","0.003","90","","100.07","0.03","90","","1804.6","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Acetato-κO)[N-(diacetyl monooxime)-N'-benzoylhydrazonato-κ^3^O,N,N'](1H-imidazole-κN^3^)zinc(II)","","- C16 H19 N5 O4 Zn -","- C16 H19 N5 O4 Zn -","- C64 H76 N20 O16 Zn4 -","4","1","NG6025","Huo, Li-Hua; Gao, Shan; Liu, Ji-Wei; Wang, Chong; Zhao, Jing-Gui","(Acetato-κ<i>O</i>)[<i>N</i>-(diacetyl monooxime)-<i>N</i>'-benzoylhydrazonato-κ^3^<i>O</i>,<i>N</i>,<i>N</i>'](1<i>H</i>-imidazole-κ<i>N</i>^3^)zinc(II)","Acta Crystallographica Section E","2004","60","5","m696","m698","10.1107/S1600536804009912","","","0.71073","MoKα","","0.047","0.036","","","0.084","0.089","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203649","9.3724","0.0002","21.9527","0.0004","11.4474","0.0002","90","","111.493","0.001","90","","2191.51","0.07","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetrakis[1-tert-butyl-1H-imidazole-2(3H)-thione-κS]palladium(II) dichloride dichloromethane disolvate","","- C30 H52 Cl6 N8 Pd S4 -","- C30 H52 Cl6 N8 Pd S4 -","- C60 H104 Cl12 N16 Pd2 S8 -","2","0.5","NG6026","Yu-Ling Wang; Wen-Hua Bi; Xing Li; Rong Cao","Tetrakis[1-<i>tert</i>-butyl-1<i>H</i>-imidazole-2(3<i>H</i>)-thione-κ<i>S</i>]palladium(II) dichloride dichloromethane disolvate","Acta Crystallographica Section E","2004","60","5","m699","m700","10.1107/S1600536804009900","","","0.71073","MoKα","","0.0542","0.0437","","","0.0991","0.1064","","","","","","1","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203650","9.811","0.003","9.59","0.003","18.87","0.005","90","","102.893","0.005","90","","1730.7","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl 2-{[(2E)-3-phenylprop-2-enoyl]amino}- 4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate","","- C19 H19 N O3 S -","- C19 H19 N O3 S -","- C76 H76 N4 O12 S4 -","4","1","OB6360","Vasu; K. A. Nirmala; Deepak Chopra; S. Mohan; J.Saravanan","Methyl 2-{[(2<i>E</i>)-3-phenylprop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate","Acta Crystallographica Section E","2004","60","5","o756","o757","10.1107/S1600536804008104","","","0.71073","MoKα","","0.0586","0.0446","","","0.1145","0.1256","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203651","22.201","0.001","8.1176","0.0003","11.8485","0.0005","90","","104.48","0.001","90","","2067.49","0.15","293","1","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Oxo-N-phenylthiazolidine-3-carboxamide","","- C10 H10 N2 O2 S -","- C10 H10 N2 O2 S -","- C80 H80 N16 O16 S8 -","8","2","OB6361","Weng, Jian-Quan; Shen, De-Long; Tan, Cheng-Xia; Liu, Hui-Jun","2-Oxo-<i>N</i>-phenylthiazolidine-3-carboxamide","Acta Crystallographica Section E","2004","60","5","o822","o823","10.1107/S1600536804008621","","","0.7107","MoKα","","","0.041","","","","0.108","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203652","16.915","0.003","14.003","0.003","10.142","0.002","90","","121.018","0.003","90","","2058.7","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Methyl 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate","","- C10 H13 N O2 S -","- C10 H13 N O2 S -","- C80 H104 N8 O16 S8 -","8","1","OB6362","Vasu; K. A. Nirmala; Deepak Chopra; S. Mohan; J.Saravanan","Methyl 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate","Acta Crystallographica Section E","2004","60","5","o758","o759","10.1107/S1600536804008219","","","0.71073","MoKα","","0.1047","0.0777","","","0.1781","0.1897","","","","","","1.176","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203653","11.458","0.0017","7.5134","0.0012","16.307","0.003","90","","110.014","0.002","90","","1319.1","0.4","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H17 I N2 O -","- C12 H17 I N2 O -","- C48 H68 I4 N8 O4 -","4","1","OB6363","Li, Dong-Hong; Tong, Hong-Bo; Huang, Shuping; Hao, Junsheng; Zhang, Yongbin; Xia, Chi-Zhong","3-(4-Methoxyphenyl)-1,2-dimethyl-4,5-dihydroimidazolium iodide","Acta Crystallographica Section E","2004","60","5","o855","o856","10.1107/S1600536804009213","","","0.71073","MoKα","","0.0296","0.0258","","","0.061","0.0627","","","","","","1.043","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203654","8.0124","0.0013","7.3743","0.0008","22.69","0.004","90","","93.043","0.013","90","","1338.8","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-[(4-Nitrophenylamino)methylene]napthalen-2(1H)-one","","- C17 H12 N2 O3 -","- C17 H12 N2 O3 -","- C68 H48 N8 O12 -","4","1","OB6364","Özek, Arzu; Yüce, Süheyla; Albayrak, Çiǧdem; Odabaşoǧlu, Mustafa; Büyükgüngör, Orhan","1-[(4-Nitrophenylamino)methylene]naphthalen-2(1<i>H</i>)-one","Acta Crystallographica Section E","2004","60","5","o826","o827","10.1107/S1600536804008864","","","0.71073","MoKα","","0.1109","0.0529","","","0.124","0.1451","","","","","","0.823","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203655","10.022","0.005","7.373","0.005","19.156","0.005","90","","91.556","0.005","90","","1415","1.2","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","ergosterol peroxide","5α,8α-epidioxyergosta-6,22-dien-3β-ol methanol solvate","","- C29 H48 O4 -","- C29 H48 O4 -","- C58 H96 O8 -","2","1","RN6014","Wang, Jian-Feng; Huang, Yao-Jian; Fang, Mei-Juan; Xie, Wen-Ling; Su, Wen-Jin; Zhao, Yu-Fen","5α,8α-Epidioxyergosta-6,22-dien-3β-ol (ergosterol peroxide) methanol solvate","Acta Crystallographica Section E","2004","60","5","o764","o765","10.1107/S160053680400813X","","","0.71073","MoKα","","0.1318","0.0685","","","0.1409","0.1698","","","","","","1.088","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203656","12.9575","0.0015","9.819","0.0011","20.974","0.003","90","","101.483","0.002","90","","2615.1","0.6","150","2","150","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","chlorobis(nicotinamide-κN)(1,4,7-trithiacyclononane-κ^3^S)ruthenium(II) hexafluorophosphate monohydrate","","- C18 H26 Cl F6 N4 O3 P Ru S3 -","- C18 H26 Cl F6 N4 O3 P Ru S3 -","- C72 H104 Cl4 F24 N16 O12 P4 Ru4 S12 -","4","1","SU6086","Adams, Harry; Shan, N.; Thomas, J.","Hydrogen bonding in thiacrown complexes: chlorobis(nicotinamide-κ<i>N</i>)(1,4,7-trithiacyclononane-κ^3^<i>S</i>)ruthenium(II) hexafluorophosphate monohydrate","Acta Crystallographica Section E","2004","60","5","m662","m663","10.1107/S1600536804009602","","","0.71073","MoKα","","0.0591","0.0432","","","0.1074","0.1163","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203657","7.151","0.001","13.229","0.003","16.044","0.003","90","","95.18","0.03","90","","1511.6","0.5","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","1-hydroxy-2,3,4,7-tetramethoxyxanthone","1-hydroxy-2,3,4,7-tetramethoxy-9H-xanthen-9-one","","- C17 H16 O7 -","- C17 H16 O7 -","- C68 H64 O28 -","4","1","SU6088","Gao-Feng Shi; Run-Hua Lu; Yun-Shang Yang; Chun-lei Li; Ai-Mei Yang; Li-Xiang Cai","1-Hydroxy-2,3,4,7-tetramethoxyxanthone from<i>Swertia Chirayita</i>","Acta Crystallographica Section E","2004","60","5","o878","o880","10.1107/S1600536804009171","","","0.71073","MoKα","","0.2285","0.052","","","0.1161","0.1652","","","","","","0.978","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203658","13.1276","0.0006","23.4257","0.001","22.4129","0.001","90","","102.66","0.002","90","","6724.9","0.5","110","2","110","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C75 H60 N3 Nd O4 P4 S3 -","- C75 H60 N3 Nd O4 P4 S3 -","- C300 H240 N12 Nd4 O16 P16 S12 -","4","1","SU6089","Feazell, Rodney P.; Gary, John Brannon; Kautz, Jason A.; Klausmeyer, Kevin K.; Wong, Ching Wah; Zancanella, Manuel","Triisothiocyanatotetrakis(triphenylphosphine oxide)neodymium(III)","Acta Crystallographica Section E","2004","60","5","m532","m534","10.1107/S1600536804006701","","","0.71073","MoKα","","0.037","0.0264","","","0.0631","0.0666","","","","","","1.039","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203659","5.1062","0.0005","22.352","0.002","7.4014","0.0009","90","","108.235","0.005","90","","802.33","0.15","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","(o-Tolyloxy)acetic acid","(2-Methylphenoxy)acetic acid","","- C9 H10 O3 -","- C9 H10 O3 -","- C36 H40 O12 -","4","1","SU6091","Philip J. Cox; Geraldine Hickey","(2-Methylphenoxy)acetic acid","Acta Crystallographica Section E","2004","60","5","o771","o773","10.1107/S1600536804007883","","","0.71073","MoKα","","0.0996","0.0781","","","0.2108","0.2304","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203660","13.0672","0.0004","6.7829","0.0003","19.2623","0.0008","90","","97.381","0.003","90","","1693.14","0.12","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H19 N O5 -","- C19 H19 N O5 -","- C76 H76 N4 O20 -","4","1","SU6092","Evain, Michel; Pauvert, Mickaël; Collet, Sylvain; Guingant, Andre","Methyl 1-benzoyl-3-hydroxy-4-methoxy-1,2,3,4-tetrahydroquinoline-2-carboxylate","Acta Crystallographica Section E","2004","60","5","o754","o755","10.1107/S1600536804007871","","","0.71069","MoKα","","0.1087","0.0581","","","0.1104","0.1243","","","","","","1.44","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2203661","8.9287","0.0004","13.2618","0.0006","15.188","0.0008","90","","98.505","0.001","90","","1778.64","0.15","180","2","180","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","(2-(N,N-dimethylamino)-5-methylphenyl)-diphenylmethanol","","","- C22 H23 N O -","- C22 H23 N O -","- C88 H92 N4 O4 -","4","1","SU6094","Kranholm, Louise B.; Bond, Andrew D.; McKenzie, Christine J.","[2-(<i>N,N</i>-Dimethylamino)-5-methylphenyl]-diphenylmethanol","Acta Crystallographica Section E","2004","60","5","o846","o847","10.1107/S1600536804009614","","","0.7107","MoKα","","0.0647","0.0481","","","0.1378","0.1528","","","","","","1.083","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203662","7.0796","0.0012","7.0238","0.0011","25.238","0.004","86.954","0.014","85.952","0.014","82.653","0.013","1240.3","0.3","293","","293","2","","","","","","","","3","P -1","-P 1","2","","3,5-Diphenyl-1-methyl-1H-1,2,4-triazole","","- C15 H13 N3 -","- C15 H13 N3 -","- C60 H52 N12 -","4","2","TK6158","Yazıcı, Serap; Işık, Şamil; Aǧar, Erbil; Alpay Karaoǧlu, Şengül; Bekircan, Olcay; Kolaylı, Sevgi; Şenel, I̧smet; Orhan Büyükgüngör","1-Methyl-3,5-diphenyl-1<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2004","60","5","o815","o816","10.1107/S160053680400861X","","","0.71073","MoKα","","0.158","0.051","","","0.115","0.141","","","","","","0.72","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203663","13.856","0.01","14.172","0.01","15.863","0.011","95.181","0.012","101.862","0.012","119.151","0.011","2595","3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(2-{2-[α-(5-chloro-2-oxidophenyl)benzylideneamino]phenyliminomethyl}- 5-hydroxyphenolato)nickel(II) methanol disolvate","","- C28 H25 Cl N2 Ni O5 -","- C28 H25 Cl N2 Ni O5 -","- C112 H100 Cl4 N8 Ni4 O20 -","4","2","TK6160","Zhu, Bixue; Ruang, Wenjuan; Zhu, Zhiang","A nickel(II) complex of an unsymmetrical tetradentate Schiff base","Acta Crystallographica Section E","2004","60","5","m634","m636","10.1107/S160053680400902X","","","0.71073","MoKα","","0.104","0.053","","","0.108","0.129","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203664","11.7692","0.0011","4.3678","0.0004","10.8889","0.001","90","","93.588","0.001","90","","558.65","0.09","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6,6'-Bis(chloromethyl)-2,2'-bipyridine","","- C12 H10 Cl2 N2 -","- C12 H10 Cl2 N2 -","- C24 H20 Cl4 N4 -","2","0.5","TK6161","Leonard F. Lindoy; John C. McMurtrie; Jason R. Price","6,6'-Bis(chloromethyl)-2,2'-bipyridine","Acta Crystallographica Section E","2004","60","5","o886","o888","10.1107/S1600536804008852","","","0.71073","MoKα","","0.027","0.025","","","0.068","0.069","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203665","18.787","0.004","10.576","0.002","9.097","0.002","90","","95.51","0.03","90","","1799.1","0.7","293","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(flufenamato-O)bis(3-pyridylmethanol-N,O)copper(II) complex","","- C40 H32 Cu F6 N4 O6 -","- C40 H32 Cu F6 N4 O6 -","- C80 H64 Cu2 F12 N8 O12 -","2","0.5","WK6012","Lörinc, Štefan; Koman, Marian; Melník, Milan; Moncoľ, Ján; Ondrušová, Darina","Bis(flufenamato-κ<i>O</i>)bis(3-pyridylmethanol-κ^2^<i>N,O</i>)copper(II)","Acta Crystallographica Section E","2004","60","5","m590","m592","10.1107/S1600536804008086","","","0.71073","MoKα","","0.052","0.039","","","0.089","0.095","","","","","","1.099","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2203666","8.728","0.002","4.847","0.001","21.935","0.004","90","","97.22","0.03","90","","920.6","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3-carboxylphenoxyacetic acid monohydrate","","- C9 H10 O6 -","- C9 H10 O6 -","- C36 H40 O24 -","4","1","WK6017","Chang-Sheng Gu; Ji-Wei Liu; Li-Hua Huo; Hui Zhao; Jing-Gui Zhao; Shan Gao","3-Carboxyphenoxyacetic acid monohydrate","Acta Crystallographica Section E","2004","60","5","o760","o761","10.1107/S1600536804008062","","","0.71073","MoKα","","0.066","0.045","","","0.11","0.117","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203667","12.538","0.006","5.319","0.002","7.327","0.004","90","","116.02","0.05","90","","439.1","0.4","295","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- Co H6 K2 O8 P2 -","- Co H6 K2 O8 P2 -","- Co2 H12 K4 O16 P4 -","2","0.25","WM6012","Ouarsal, Rachid; Essehli, Rachid; Lachkar, Mohammed; Zenkouar, Mohammed; Dusek, Michal; Fejfarova, Karla; El Bali, Brahim","Dipotassium cobalt(II) bishydrogenphosphite(III) dihydrate, K~2~Co(HPO~3~)~2~.2H~2~O","Acta Crystallographica, Section E","2004","60","5","i66","i68","10.1107/S1600536804007895","","","0.71069","MoKα","","0.0355","0.022","","","0.0634","0.0695","","","","","","1.22","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2203668","14.5859","0.0001","14.6371","0.0001","15.6526","0.0002","67.4428","0.0005","69.0664","0.0004","64.1181","0.0004","2703.11","0.04","150","","","","","","","","","","","6","P -1","-P 1","2","","","","- C32 H64 Cu4 I6 K2 O16 -","- C32 H64 Cu4 I6 K2 O16 -","- C64 H128 Cu8 I12 K4 O32 -","2","1","WM6013","Heléne Paulsson; Andreas Fischer; Lars Kloo","Bis[bis(12-crown-4)potassium] hexaiodotetracuprate(I)","Acta Crystallographica Section E","2004","60","5","m548","m550","10.1107/S1600536804007780","","","0.71073","MoKα","","0.0381","0.027","","","0.0573","0.0614","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203669","7.7036","0.0015","7.7036","0.0015","4.019","0.0014","90","","90","","120","","206.56","0.09","293","2","293","2","","","","","","","","3","P -6 2 m","P -6 -2","189","","Cerium palladium indide","","- Ce In Pd -","- Ce In Pd -","- Ce3 In3 Pd3 -","3","0.25","WM6014","Tursina, Anna I.; Nesterenko, Sergei N.; Seropegin, Yuri D.","Intermetallic CePdIn","Acta Crystallographica Section E","2004","60","5","i64","i65","10.1107/S1600536804008566","","","0.71073","MoKα","","0.0491","0.0397","","","0.1036","0.1122","","","","","","0.795","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203670","16.949","0.003","7.368","0.001","13.54","0.003","90","","128.09","0.03","90","","1330.8","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","caesium cobalt oxalate hydrate","Dicaesium cobalt(II) dioxalate tetrahydrate","","- C4 H8 Co Cs2 O12 -","- C4 H8 Co Cs2 O12 -","- C16 H32 Co4 Cs8 O48 -","4","0.5","WM6015","Schwendtner, Karolina; Kolitsch, Uwe","Cs~2~Co^II^(C~2~O~4~)~2~.4H~2~O","Acta Crystallographica, Section E","2004","60","5","m659","m661","10.1107/S1600536804009626","","","0.71073","MoKα","","0.0187","0.0173","","","0.0412","0.0419","","","","","","1.08","","","","has coordinates","277836","2022-09-14","17:02:02",""
"2203671","8.34","0.003","14.467","0.005","17.675","0.006","90","","94.2","0.008","90","","2126.8","1.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9,10-Bis(propylammoniomethyl)anthracene dichloride","","- C22 H30 Cl2 N2 -","- C22 H30 Cl2 N2 -","- C88 H120 Cl8 N8 -","4","1","WN6217","Liu, Qing-Xing; Song, Hai-bin; Li, Zheng-ming","9,10-Bis(propylammoniomethyl)anthracene dichloride","Acta Crystallographica Section E","2004","60","5","o777","o778","10.1107/S1600536804008190","","","0.71073","MoKα","","0.1968","0.0597","","","0.1319","0.1751","","","","","","0.856","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203672","9.519","0.003","12.924","0.004","19.027","0.006","90","","90.744","0.005","90","","2340.6","1.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N,N-Bis(4-chlorophenyl)-4-(2-naphthalen-1-ylvinyl)aniline","","- C30 H21 Cl2 N -","- C30 H21 Cl2 N -","- C120 H84 Cl8 N4 -","4","1","WN6227","Li, Wei; Liu, Dong-Zhi; Zhou, Xue-Qin; Cao, Xiao-Dan","<i>N,N</i>-Bis(4-chlorophenyl)-4-(2-naphthalen-1-ylvinyl)aniline","Acta Crystallographica Section E","2004","60","5","o786","o787","10.1107/S160053680400844X","","","0.71073","MoKα","","0.085","0.0425","","","0.0874","0.1043","","","","","","1.009","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203673","5.0699","0.0001","6.6184","0.0001","12.3638","0.0007","94.71","0.03","98.5","0.03","110.185","0.016","381.13","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H12 Co N2 O10 -","- C14 H12 Co N2 O10 -","- C14 H12 Co N2 O10 -","1","0.5","WN6228","Xu, Ying; Han, Lei; Lou, Ben-Yong; Hong, Mao-Chun","Diaquabis(pyridine-2,5-dicarboxylato)cobalt(II)","Acta Crystallographica Section E","2004","60","5","m585","m586","10.1107/S1600536804008426","","","0.71073","MoKα","","0.0504","0.039","","","0.0935","0.1236","","","","","","1.197","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203674","7.4562","0.0005","20.3619","0.0014","15.8017","0.001","90","","90","","90","","2399.1","0.3","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C16 H26 N10 Ni O9 -","- C16 H26 N10 Ni O9 -","- C64 H104 N40 Ni4 O36 -","4","0.5","WN6231","A-Qing Wu; Guang-Hua Guo; Fa-Kun Zheng; Guo-Cong Guo; Jin-Shun Huang","Bis(picolinato-κ^2^<i>N,O</i>)bis(urea-κ<i>O</i>)nickel(II) urea disolvate monohydrate","Acta Crystallographica Section E","2004","60","5","m571","m573","10.1107/S1600536804008487","","","0.71073","MoKα","","0.069","0.0418","","","0.0918","0.109","","","","","","1.012","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203675","10.365","0.006","8.827","0.005","11.001","0.006","90","","104.93","0.02","90","","972.5","1","173.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","tert-butoxycarbonyl-L-alanyl-L-lactic acid benzyl ester","","- C18 H25 N O6 -","- C18 H25 N O6 -","- C36 H50 N2 O12 -","2","1","WN6233","Oku, Hiroyuki; Suda, Tomohiro; Yamada, Keiichi; Katakai, Ryoichi","A short depsipeptide: <i>tert</i>-butoxycarbonyl-<small>L</small>-alanyl-<small>L</small>-lactic acid benzyl ester (Boc-<small>L</small>-Ala-<small>L</small>-Lac-OBzl)","Acta Crystallographica Section E","2004","60","5","o720","o721","10.1107/S1600536804007299","","","1.5418","CuKα","","","0.07","","","","0.182","","","","","","0.935","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203676","23.387","0.005","30.418","0.007","7.3816","0.0016","90","","97.714","0.003","90","","5204","2","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Chlorobis(1,10-phenanthroline)copper(II) chloride methanol 4.5-hydrate","","- C25 H29 Cl2 Cu N4 O5.5 -","- C25 H29 Cl2 Cu N4 O5.5 -","- C200 H232 Cl16 Cu8 N32 O44 -","8","1","WN6237","Lu, Liping; Qin, Shidong; Yang, Pin; Zhu, Miaoli","Chlorobis(1,10-phenanthroline)copper(II) chloride methanol solvate 4.5-hydrate","Acta Crystallographica Section E","2004","60","5","m574","m576","10.1107/S1600536804008323","","","0.71073","MoKα","","0.1193","0.0973","","","0.2485","0.2789","","","","","","1.06","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2203677","7.6344","0.0004","7.7017","0.0004","16.268","0.0009","89.224","0.002","77.873","0.002","69.352","0.001","873.19","0.08","180","2","180","2","","","","","","","","4","P -1","-P 1","2","Diethyl 2,5-di(triisopropylsilylethynyl)terephthalate","","","- C34 H54 O4 Si2 -","- C34 H54 O4 Si2 -","- C34 H54 O4 Si2 -","1","0.5","WN6238","Nicolaisen, Berit; Bond, Andrew D.; Nielsen, Mogens Brøndsted","Diethyl 2,5-bis(triisopropylsilylethynyl)terephthalate","Acta Crystallographica Section E","2004","60","5","o784","o785","10.1107/S1600536804008311","","","0.71073","MoKα","","0.0584","0.0448","","","0.1226","0.1336","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203678","15.8433","0.0012","6.6557","0.0014","20.1339","0.001","90","","112.814","0.005","90","","1957","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","6',6'-dichloro-3,3''etheno-3,4,3'',4''-tetrahydro-2H-1,3-benzoxazine-2-spiro- 2'-(2λ^5^,4λ^5^,6λ^5^-cyclotriphosphazene)-4'-spiro-2''-2H-1,3-benzoxazine","","- C16 H16 Cl2 N5 O2 P3 -","- C16 H16 Cl2 N5 O2 P3 -","- C64 H64 Cl8 N20 O8 P12 -","4","1","WN6239","Tercan, Barış; Hökelek, Tuncer; Bilge, Selen; Natsagdorj, Amgalan; Demiriz, Şemsay; Kılıç, Zeynel","6',6'-Dichloro-3,3''-etheno-3,4,3'',4''-tetrahydro-2<i>H</i>-1,3-benzoxazine-2-spiro-2'-(2λ^5^,4λ^5^,6λ^5^-cyclotriphosphazene)-4'-spiro-2''-2<i>H</i>-1,3-benzoxazine","Acta Crystallographica Section E","2004","60","5","o795","o797","10.1107/S160053680400858X","","","0.71073","MoKα","","0.159","0.0574","","","0.1288","0.1652","","","","","","0.981","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203679","10.005","0.015","29.38","0.04","10.323","0.016","90","","111.04","0.02","90","","2832","7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aquabis(N-benzoylalaninato-κO)(1,10-phenanthroline-κ^2^N,N')zinc(II)","","- C32 H30 N4 O7 Zn -","- C32 H30 N4 O7 Zn -","- C128 H120 N16 O28 Zn4 -","4","1","WN6241","Fu, Ai-Yun; Sun, Yong-Ling; Wang, Da-Qi; Zhang, Wen-Sheng; Ren, An-Kun","Aquabis(<i>N</i>-benzoylalaninato-κ<i>O</i>)(1,10-phenanthroline-κ^2^<i>N,N</i>')zinc(II)","Acta Crystallographica Section E","2004","60","5","m701","m702","10.1107/S1600536804009833","","","0.71073","MoKα","","0.0673","0.0409","","","0.0865","0.0934","","","","","","0.994","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203680","13.968","0.005","14.602","0.005","15.271","0.004","90","","118.24","0.02","90","","2744","1.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-(2-Chlorophenyl)-2-p-tolyl-1,3,4-thiadiazole","","- C15 H11 Cl N2 S -","- C15 H11 Cl N2 S -","- C120 H88 Cl8 N16 S8 -","8","2","WN6242","Huang, Huaming; Yu, Haitao; Chen, Peili; Meng, Jiben","5-(2-Chlorophenyl)-2-<i>p</i>-tolyl-1,3,4-thiadiazole","Acta Crystallographica Section E","2004","60","5","o881","o883","10.1107/S1600536804009742","","","0.71073","MoKα","","0.1571","0.0576","","","0.1004","0.126","","","","","","1.013","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203681","9.7345","0.0014","9.7893","0.0016","11.4276","0.0015","87.225","0.01","67.328","0.009","72.767","0.011","957","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","hexaaquamanganese bis[diazidobis(dimethylglyoximato)cobaltate] dihydrate","","- C16 H44 Co2 Mn N20 O16 -","- C16 H44 Co2 Mn N20 O16 -","- C16 H44 Co2 Mn N20 O16 -","1","0.5","WW6135","Liu, Xuanwen; Zhang, BaoFeng; Wang, Xiaoqing; Shen, Guangqiu; Wang, Ru-Ji; Shen, Dezhong","A new heterometallic complex: [Mn(H~2~O)~6~][Co(dmg)~2~(N~3~)~2~]~2~·2H~2~O, where dmg is dimethylglyoximate","Acta Crystallographica Section E","2004","60","5","m538","m540","10.1107/S1600536803029465","","","0.71073","MoKα","","0.0363","0.0313","","","0.0736","0.0771","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203682","7.145","0.003","8.915","0.004","9.375","0.004","71.896","0.006","80.025","0.007","85.109","0.007","558.7","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H9 Cl F N O3 -","- C12 H9 Cl F N O3 -","- C24 H18 Cl2 F2 N2 O6 -","2","1","WW6161","Song, Jian; Xue, Fu-Hua; Lou, Ke-Xia","7-Chloro-1-ethyl-6-fluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid","Acta Crystallographica Section E","2004","60","5","o824","o825","10.1107/S1600536804005926","","","0.71073","MoKα","","0.0531","0.0365","","","","0.1043","","","","","","1.055","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203683","23.624","0.011","7.779","0.005","14.307","0.014","90","","90.72","0.06","90","","2629","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N-(4-Amino-2-methylphenyl)-4-chlorophthalimide","","- C15 H11 Cl N2 O2 -","- C15 H11 Cl N2 O2 -","- C120 H88 Cl8 N16 O16 -","8","1","WW6172","Banthia, Sandip; Samanta, Anunay","<i>N</i>-(4-Amino-2-methylphenyl)-4-chlorophthalimide","Acta Crystallographica Section E","2004","60","5","o740","o741","10.1107/S1600536804007536","","","0.71073","MoKα","","0.1147","0.0534","","","0.1183","0.147","","","","","","1.007","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203684","10.006","0.003","10.318","0.003","10.371","0.003","82.63","0.005","62.925","0.005","63.291","0.005","847.7","0.5","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","4-(3,4-Dimethylphenyl)-3,5-di-2-pyridyl-4H-1,2,4-triazole","","- C20 H17 N5 -","- C20 H17 N5 -","- C40 H34 N10 -","2","1","WW6178","Shao, Si-Chang; Liu, Hui-Jun; Zhang, Shu-Ping; Yang, Song; Hao, Fu-Ying; Li, Cheng-Peng; Zhu, Hai-Liang","4-(3,4-Dimethylphenyl)-3,5-di-2-pyridyl-4H-1,2,4-triazole","Acta Crystallographica, Section E","2004","60","5","o722","o723","10.1107/S1600536804006002","","","0.71073","MoKα","","0.0963","0.0494","","","0.1137","0.1232","","","","","","0.998","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2203685","7.692","0.0008","12.94","0.001","13.229","0.001","68.958","0.003","75.775","0.004","79.76","0.006","1185.41","0.18","296.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C20 H18 Cl2 F6 Ir N6 P -","- C20 H18 Cl2 F6 Ir N6 P -","- C40 H36 Cl4 F12 Ir2 N12 P2 -","2","1","WW6188","Yoshikawa, Naokazu; Sakamoto, Jun; Kanehisa, Nobuko; Kai, Yasushi; Takashima, Hiroshi; Tsukahara, Keiichi","<i>cis</i>-Dichlorobis(di-2-pyridylamine)iridium(III) hexafluorophosphate","Acta Crystallographica Section E","2004","60","5","m546","m547","10.1107/S1600536804007846","","","0.7107","MoKα","","","0.0558","","","","0.1279","","","","","","1.719","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203686","19.705","0.004","10.328","0.002","11.148","0.002","90","","97.95","0.03","90","","2247","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethanol(ethoxy)[3-methoxysalicylaldehyde (4-methoxybenzoyl)hydrazonato- κ^3^O,N,O']oxovanadium(V)","","- C20 H25 N2 O7 V -","- C20 H25 N2 O7 V -","- C80 H100 N8 O28 V4 -","4","1","WW6191","Huo, Li-Hua; Gao, Shan; Liu, Ji-Wei; Zhao, Hui; Ng, Seik Weng","Ethanol(ethoxy)[3-methoxysalicylaldehyde (4-methoxybenzoyl)hydrazonato-κ^3^<i>O,N,O</i>']oxovanadium(V)","Acta Crystallographica Section E","2004","60","5","m606","m608","10.1107/S1600536804008839","","","0.71073","MoKα","","0.1","0.06","","","0.132","0.148","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203687","9.339","0.002","9.793","0.002","12.251","0.003","79.21","0.03","86.28","0.03","69.76","0.03","1032.7","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Bis[(μ~2~-salicylato-O,O,O')(salicylato-O,O')] tetraimidazole-dicadmium","Bis(μ-salicylato-κ^3^O,O':O')bis[(imidazole-κN^3^)(salicylato- κ^2^O,O')cadmium(II)]","","- C40 H36 Cd2 N8 O12 -","- C40 H36 Cd2 N8 O12 -","- C40 H36 Cd2 N8 O12 -","1","0.5","WW6193","Huo, Li-Hua; Gao, Shan; Gu, Chang-Sheng; Lu, Zhen-Zhong; Zhao, Hui; Zhao, Jing-Gui","Bis(μ-salicylato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>')bis[(imidazole-κ<i>N</i>^3^)(salicylato-κ^2^<i>O</i>,<i>O</i>')cadmium(II)]","Acta Crystallographica Section E","2004","60","5","m596","m598","10.1107/S1600536804008700","","","0.71073","MoKα","","0.032","0.026","","","0.06","0.062","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203688","22.268","0.006","12.924","0.004","14.674","0.004","90","","123.375","0.004","90","","3526.6","1.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tetrakis(μ-acetato-O:O')bis[(2-benzylidene-6,7-dihydro-5H-thiazolo[3,2-a] pyrimidin-3-one)cobalt(II)]","","- C34 H36 Co2 N4 O10 S2 -","- C34 H36 Co2 N4 O10 S2 -","- C136 H144 Co8 N16 O40 S8 -","4","0.5","YA6198","Wang, Dong-Hua; Li, Xun; Liu, Xin-Gang","Tetra-μ-acetato-κ^8^<i>O</i>:<i>O</i>'-bis[(2-benzylidene-6,7-dihydro-5<i>H</i>-thiazolo[3,2-<i>a</i>]pyrimidin-3-one-κ<i>N</i>)cobalt(II)]","Acta Crystallographica Section E","2004","60","5","m703","m704","10.1107/S1600536804010049","","","0.71073","MoKα","","0.052","0.033","","","","0.194","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203689","24.947","0.005","11.5988","0.0017","15.284","0.003","90","","118.576","0.003","90","","3883.8","1.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis[bis(2-pyridyl)methanediol-κ^3^N,N',O]copper(II) bis(adamantane-1-carboxylate)","","- C44 H50 Cu N4 O8 -","- C44 H50 Cu N4 O8 -","- C176 H200 Cu4 N16 O32 -","4","0.5","YA6199","Tong, Ming-Liang; Zhou, Ai-Ju; Hu, Sheng","Bis[bis(2-pyridyl)methanediol-κ^3^<i>N</i>,<i>N</i>',<i>O</i>]copper(II) bis(adamantane-1-carboxylate)","Acta Crystallographica Section E","2004","60","5","m657","m658","10.1107/S1600536804009237","","","0.71073","MoKα","","0.055","0.043","","","0.104","0.112","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203690","8.2766","0.0012","8.2766","0.0012","23.648","0.004","90","","90","","90","","1619.9","0.4","193","2","193","2","","","","","","","","5","P 43","P 4cw","78","","Bis(2-formylpyridine semicabazonato)nickel(II)","","- C14 H14 N8 Ni O2 -","- C14 H14 N8 Ni O2 -","- C56 H56 N32 Ni4 O8 -","4","1","YA6201","Jian Zhou; Zhen-Feng Chen; Xian-Wen Wang; Yan-Shu Tan; Hong Liang; Yong Zhang","Bis(2-formylpyridine semicabazonato)nickel(II)","Acta Crystallographica Section E","2004","60","5","m568","m570","10.1107/S1600536804008207","","","0.7107","MoKα","","0.027","0.026","","","0.055","0.056","","","","","","1.12","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203691","10.0014","0.0011","14.4188","0.0004","8.8212","0.001","90","","104.413","0.009","90","","1232.1","0.2","293","2","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(4-acetylphenyliminomethyl)-1,2-dihydroxybenzene","","- C15 H13 N O3 -","- C15 H13 N O3 -","- C60 H52 N4 O12 -","4","1","YA6202","Yüce, Süheyla; Özek, Arzu; Albayrak, Çiǧdem; Odabaşoǧlu, Mustafa; Büyükgüngör, Orhan","3-(4-Acetylphenyliminomethyl)-1,2-dihydroxybenzene","Acta Crystallographica Section E","2004","60","5","o810","o812","10.1107/S1600536804008633","","","0.71073","MoKα","","0.059","0.035","","","0.079","0.086","","","","","","0.92","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203692","15.292","0.002","7.7844","0.0011","14.306","0.002","90","","117.311","0.002","90","","1513.1","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","dichlorobis(2-chloromethylpyridine)copper(II)","","- C12 H12 Cl4 Cu N2 -","- C12 H12 Cl4 Cu N2 -","- C48 H48 Cl16 Cu4 N8 -","4","0.5","YA6203","Jian Zhang; Yao Kang; Yi-Hang Wen; Zhao-Ji Li; Ye-Yan Qin; Yuan-Gen Yao","Dichlorobis[2-(chloromethyl)pyridine]copper(II)","Acta Crystallographica Section E","2004","60","5","m599","m600","10.1107/S1600536804008645","","","0.71073","MoKα","","","0.038","","","0.101","0.11","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203693","12.377","0.003","12.377","0.003","18.296","0.001","90","","90","","90","","2802.8","1","220","2","220","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C24 H34 N2 O4 S5 -","- C24 H34 N2 O4 S5 -","- C96 H136 N8 O16 S20 -","4","0.5","YA6205","Blake, Alexander J.; Lippolis, Vito; Schröder, Martin","10,13-Bis(<i>p</i>-tolylsulfonyl)-1,4,7-trithia-10,13-diazacyclopentadecane","Acta Crystallographica Section E","2004","60","5","o901","o903","10.1107/S1600536804009201","","","0.71073","MoKα","","0.129","0.07","","","0.117","0.149","","","","","","1.11","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203694","30.989","0.004","30.989","0.004","6.5","0.001","90","","90","","120","","5405.8","1.3","150","2","150","2","","","","","","","","3","R -3 :H","-R 3","148","paracumylphenol","4-(2-phenylisopropyl)phenol","","- C15 H16 O -","- C15 H16 O -","- C270 H288 O18 -","18","1","AC6084","Abdelhak, Ettahiri; Mostafa, Abboudi; Merle, Daphne; Perrin, Monique; Thozet, Alain","4-(2-Phenylisopropyl)phenol","Acta Crystallographica Section E","2004","60","6","o954","o955","10.1107/S1600536804010621","","","0.71069","MoKα","","0.0872","0.0493","","","0.1096","0.1285","","","","","","0.942","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203695","11.2069","0.0017","12.703","0.002","20.75","0.003","90","","101.003","0.002","90","","2899.7","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C33 H24 N4 O4 -","- C33 H24 N4 O4 -","- C132 H96 N16 O16 -","4","1","AC6091","Wei Xu; Yin-Xiang Lu; Chun-Ming Liu; Peng Guo; Bi-Jian Lan; Hui Zhou","Tetrakis[(4-cyanophenoxy)methyl]methane","Acta Crystallographica Section E","2004","60","6","o1049","o1050","10.1107/S160053680401027X","","","0.71073","MoKα","","0.1004","0.0617","","","0.1275","0.1452","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203696","12.8923","0.0012","7.4816","0.0005","16.2916","0.0018","90","","116.331","0.007","90","","1408.4","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(3,5-Dimethylphenoxy)phthalonitrile","","- C16 H12 N2 O3 -","- C16 H12 N2 O3 -","- C64 H48 N8 O12 -","4","1","AC6096","Yavuz Köysal; Şamil Işık; Nesuhi Akdemir; Erbil Aǧar; Cihan Kantar","4-(3,5-Dimethoxyphenoxy)phthalonitrile","Acta Crystallographica Section E","2004","60","6","o930","o931","10.1107/S1600536804010311","","","0.71073","MoKα","","0.0638","0.0382","","","0.1036","0.1107","","","","","","0.969","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203697","9.3894","0.0008","10.8881","0.0011","11.6658","0.0012","67.191","0.007","83.696","0.008","67.04","0.007","1011.07","0.19","293","","293","","","","","","","","","4","P -1","-P 1","2","","[1-methyl-3-(2-phenylethyl)benzimidazolinio](phenylimino)methanethiolate","","- C23 H21 N3 S -","- C23 H21 N3 S -","- C46 H42 N6 S2 -","2","1","AC6097","Sema Öztürk; Mehmet Akkurt; Hasan Küçükbay; Ersin Orhan; Orhan Büyükgüngör","Mercapto-<i>N</i>-phenylformimidoyl-1-methyl-3-(2-phenylethyl)benzimidazolinium inner salt","Acta Crystallographica Section E","2004","60","6","o936","o938","10.1107/S160053680401013X","","","0.71073","MoKα","","0.0703","0.0394","","","0.0941","0.1035","","","","","","0.942","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203698","6.654","0.001","9.444","0.002","13.182","0.003","90","","90","","90","","828.4","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C7 H13 N O3 -","- C7 H13 N O3 -","- C28 H52 N4 O12 -","4","1","AC6099","Qing-An Wu; Zhen-Yuan Xu","<i>N</i>-Acetyl-<small>L</small>-valine","Acta Crystallographica Section E","2004","60","6","o949","o950","10.1107/S1600536804010505","","","0.71073","MoKα","","0.0458","0.0337","","","0.0693","0.0716","","","","","","0.911","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203699","8.204","0.0009","8.85","0.001","9.667","0.001","70.868","0.001","79.068","0.002","73.184","0.002","631.25","0.12","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis(4,4'-bipyridine N,N'-dioxide-κO)bis(dicyanamido)cadmium(II)","","- C24 H20 Cd N10 O6 -","- C24 H20 Cd N10 O6 -","- C24 H20 Cd N10 O6 -","1","0.5","AC6100","Xu, Yanqing; Yuan, Daqiang; Xu, Ying; Bi, Wenhua; Zhou, Youfu; Hong, Maochun","Diaquabis(4,4'-bipyridine <i>N,N</i>'-dioxide-κ<i>O</i>)bis(dicyanamido)cadmium(II)","Acta Crystallographica Section E","2004","60","6","m713","m714","10.1107/S1600536804010281","","","0.71073","MoKα","","","0.0335","","","0.0789","0.0817","","","","","","1.124","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203700","9.2099","0.0003","9.3828","0.0002","13.2522","0.0004","77.392","0.002","88.719","0.002","66.761","0.002","1024.3","0.05","123","2","","","","","","","","","","6","P -1","-P 1","2","","","","- C21 H24 N2 Ni O2 S2 -","- C21 H24 N2 Ni O2 S2 -","- C42 H48 N4 Ni2 O4 S4 -","2","1","AC6101","Taylor, Michelle K.; Reglinski, John; Wallace, Dawn","[<i>N,N</i>'-Bis-(<i>o</i>-sulfidobenzylidene)-1,3-diaminopropane]nickel(II) 1,4-dioxane solvate","Acta Crystallographica Section E","2004","60","6","m850","m851","10.1107/S1600536804011882","","","0.71073","MoKα","","","0.0294","","","","0.0573","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203701","7.777","0.002","8.993","0.002","11.389","0.002","71.25","0.03","86.18","0.03","86.88","0.03","752.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Aqua[2-(pyridin-2-ylmethyliminomethyl)phenolato-κ^3^N,N',O]copper(II) nitrate monohydrate","","- C13 H15 Cu N3 O6 -","- C13 H15 Cu N3 O6 -","- C26 H30 Cu2 N6 O12 -","2","1","AC6102","You, Zhong-Lu; Chen, Bo; Zhu, Hai-Liang; Liu, Wei-Sheng","Aqua[2-(pyridin-2-ylmethyliminomethyl)phenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>]copper(II) nitrate monohydrate","Acta Crystallographica Section E","2004","60","6","m884","m886","10.1107/S160053680401284X","","","0.71073","MoKα","","0.055","0.0506","","","0.1214","0.1244","","","","","","1.178","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203702","6.444","0.002","22.946","0.005","11.961","0.002","90","","102.02","0.03","90","","1729.8","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","trans-Bis{2-[3-(Cyclohexylamino)propyliminomethyl]phenolato}nickel(II) dinitrate","","- C32 H48 N6 Ni O8 -","- C32 H48 N6 Ni O8 -","- C64 H96 N12 Ni2 O16 -","2","0.5","AC6103","You, Zhong-Lu; Lin, Yong-Shan; Zhu, Hai-Liang; Liu, Wei-Sheng","<i>trans</i>-Bis{2-[3-(cyclohexylamino)propyliminomethyl]phenolato}nickel(II) dinitrate","Acta Crystallographica Section E","2004","60","6","m887","m889","10.1107/S1600536804012851","","","0.71073","MoKα","","0.1186","0.0632","","","0.1264","0.1483","","","","","","0.952","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203703","14.03","0.002","13.773","0.002","7.009","0.002","90","","114.71","0.02","90","","1230.4","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Tripotassium dibismuth (III) arsenate (V)","","- As3 Bi2 K3 O12 -","- As3 Bi2 K3 O12 -","- As12 Bi8 K12 O48 -","4","0.5","BR6141","Falah, Chiraz; Boughzala, Habib; Jouini, Tahar","Tripotassium dibismuth(III) tris[arsenate(V)], K~3~Bi~2~(AsO~4~)~3~","Acta Crystallographica, Section E","2004","60","6","i74","i76","10.1107/S1600536804011353","","","0.71073","MoKα","","0.0392","0.0261","","","0.0479","0.0512","","","","","","1.077","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2203704","10.0974","0.0003","8.8974","0.0004","20.2619","0.001","90","","99.997","0.002","90","","1792.7","0.13","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[aqua(phenanthroline)zinc(II)]-μ-cyclohexanedicarboxylato]","","- C20 H20 N2 O5 Zn -","- C20 H20 N2 O5 Zn -","- C80 H80 N8 O20 Zn4 -","4","1","BR6147","Bi, Wenhua; Sun, Daofeng; Cao, Rong; Wang, Yanqin","<i>catena</i>-Poly[[aqua(phenanthroline)zinc(II)]-μ-cyclohexanedicarboxylato]","Acta Crystallographica Section E","2004","60","6","m711","m712","10.1107/S1600536804009444","","","0.71073","MoKα","","","0.0557","","","0.1143","0.1414","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203705","25.647","0.002","10.0538","0.0009","21.0859","0.0018","90","","111.933","0.002","90","","5043.5","0.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4'-(4-Methoxybenzoyl)-1'-methyl-acenaphthene-1-spiro-2'-pyrrolidine- 3'-spiro-3''-1H-indole-2,2''(1H,3''H)-dione hemihydrate","","- C31 H25 N2 O4.5 -","- C31 H25 N2 O4.5 -","- C248 H200 N16 O36 -","8","1","BT6440","M. M. Govind; S. Selvanayagam; D. Velmurugan; K. Ravikumar; A. R. Sureshbabu; R. Raghunathan","4'-(4-Methoxybenzoyl)-1'-methyl acenaphthene-1-spiro-2'-pyrrolidine-3'-spiro-3''-1<i>H</i>-indole-2,2''(1<i>H</i>,3''<i>H</i>)-dione hemihydrate","Acta Crystallographica Section E","2004","60","6","o1003","o1005","10.1107/S1600536804010736","","","0.71073","MoKα","","0.1468","0.0835","","","0.1888","0.2189","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203706","7.531","0.003","11.787","0.004","19.786","0.006","90","","90","","90","","1756.4","1.1","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Methoxy[3-methoxysalicylaldehyde (4-methoxybenzoyl)hydrazonato(2-)-κ^3^O,O',N]oxovanadium(V)","","- C17 H17 N2 O6 V -","- C17 H17 N2 O6 V -","- C68 H68 N8 O24 V4 -","4","1","BT6444","Huo, Li-Hua; Gao, Shan; Liu, Ji-Wei; Li, Jing; Ng, Seik Weng","Methoxy[3-methoxysalicylaldehyde (4-methoxybenzoyl)hydrazonato(2‒)-κ^3^<i>O</i>,<i>O</i>',<i>N</i>]oxovanadium(V)","Acta Crystallographica Section E","2004","60","6","m758","m760","10.1107/S1600536804010323","","","0.71073","MoKα","","0.04","0.036","","","0.09","0.093","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203707","8.9005","0.0013","15.1033","0.0019","12.1253","0.0015","90","","92.632","0.011","90","","1628.2","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H14 N2 O -","- C21 H14 N2 O -","- C84 H56 N8 O4 -","4","1","BT6449","Petek, Hande; Akdemir, Nesuhi; Aǧar, Erbil; Özil, Musa; Şenel, İsmet","4-Diphenylmethoxyphthalonitrile","Acta Crystallographica Section E","2004","60","6","o1105","o1106","10.1107/S1600536804009596","","","0.71073","MoKα","","0.1142","0.0427","","","0.0772","0.0949","","","","","","0.826","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203708","14.4631","0.0008","10.1438","0.0006","24.393","0.001","90","","94.564","0.001","90","","3567.4","0.3","298","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Chloro[pyrimidine-2(1H)-thione-κS]bis(triphenylphosphine-κP)copper(I)","","- C40 H34 Cl Cu N2 P2 S -","- C40 H34 Cl Cu N2 P2 S -","- C160 H136 Cl4 Cu4 N8 P8 S4 -","4","1","BT6455","Li, Dan; Shi, Wen-Juan; Wu, Tao; Ng, Seik Weng","Chloro[pyrimidine-2(1<i>H</i>)-thione-κ<i>S</i>]bis(triphenylphosphine-κ<i>P</i>)copper(I)","Acta Crystallographica Section E","2004","60","6","m776","m777","10.1107/S1600536804011262","","","0.71073","MoKα","","0.059","0.043","","","0.101","0.113","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203709","11.781","0.003","8.994","0.002","12.988","0.003","90","","113.91","0.02","90","","1258.1","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","not relevant","4-phenylpyridinium hydrogensquarate","","- C15 H11 N O4 -","- C15 H11 N O4 -","- C60 H44 N4 O16 -","4","1","BT6456","T. Kolev; R. Wortmann; M. Spiteller; W.S. Sheldrick; M. Heller","4-Phenylpyridinium hydrogensquarate","Acta Crystallographica Section E","2004","60","6","o956","o957","10.1107/S1600536804010487","","","0.71073","MoKα","","0.0792","0.0425","","","0.0883","0.0998","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203710","21.319","0.004","11.997","0.002","38.3","0.006","90","","100.632","0.003","90","","9628","3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","1,2-bis(4-pyridyl)ethylenium trismalonatochromate(3-) octahydrate","1,2-bis(4-pyridyl)ethylenium tris(malonato-κ^2^O,O') chromate(III)-water (1/8)","","- C45 H55 Cr N6 O20 -","- C45 H55 Cr N6 O20 -","- C360 H440 Cr8 N48 O160 -","8","1","BT6457","Ghosh, Dipesh; Powell, Doug R.; Van Horn, J. David","The tris(malonato)chromate(III) anion with an organic cation","Acta Crystallographica Section E","2004","60","6","m764","m766","10.1107/S1600536804010748","","","0.71073","MoKα","","0.0753","0.0672","","","0.1728","0.1791","","","","","","1.069","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203711","6.0399","0.0001","9.7642","0.0002","14.682","0.0004","90","","90","","90","","865.87","0.03","105","2","105","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","L-Alanyl-L-threonine","","- C7 H14 N2 O4 -","- C7 H14 N2 O4 -","- C28 H56 N8 O16 -","4","1","BT6458","Netland, Kjetil Andreas; Andresen, Kim; Görbitz, Carl Henrik; Dalhus, Bjørn","<small>L</small>-Alanyl-<small>L</small>-threonine","Acta Crystallographica Section E","2004","60","6","o951","o953","10.1107/S1600536804010578","","","0.71073","MoKα","","0.0284","0.0272","","","0.074","0.0753","","","","","","1.142","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203712","15.749","0.009","15.749","0.007","3.9","0.002","90","","90","","90","","967.3","0.9","293","2","293","2","","","","","","","","4","P 42","P 4c","77","tmeonitb","2,4,5-trimethoxy-1-nitrobenzene","","- C9 H11 N O5 -","- C9 H11 N O5 -","- C36 H44 N4 O20 -","4","1","BT6459","Vande Velde, Christophe M. L.; Geise, Herman J.; Blockhuys, Frank","2,4,5-Trimethoxy-1-nitrobenzene: a structure in the rare space group <i>P</i>4~2~","Acta Crystallographica Section E","2004","60","6","o1031","o1033","10.1107/S1600536804011651","","","0.71073","MoKα","","0.1188","0.0404","","","0.0976","0.1182","","","","","","0.998","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203713","4.7413","0.0017","9.595","0.005","15.069","0.007","90","","90","","90","","685.5","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(4-Oxo-1,4-dihydropyridin-1-yl)acetic acid","","- C7 H7 N O3 -","- C7 H7 N O3 -","- C28 H28 N4 O12 -","4","1","BT6460","Shan Gao; Zhu-Yan Zhang; Li-Hua Huo; Jing-Gui Zhao; Zain, Sharifuddin M.; Ng, Seik Weng","(4-Oxo-1,4-dihydropyridin-1-yl)acetic acid","Acta Crystallographica Section E","2004","60","6","o1006","o1008","10.1107/S1600536804011110","","","0.71073","MoKα","","0.05","0.044","","","0.123","0.146","","","","","","1.11","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203714","8.94","0.001","6.768","0.001","15.028","0.002","90","","90","","90","","909.3","0.2","298","2","298","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Ethyl 3-methyl-5-nitro-1H-imidazole-2-carboxylate","","- C7 H9 N3 O4 -","- C7 H9 N3 O4 -","- C28 H36 N12 O16 -","4","0.5","BT6461","Wu, Hai-Qiang; An, Lin-Kun; Huang, Zhi-Shu; Gu, Lian-Quan; Zain, Sharifuddin M.; Ng, Seik Weng","Ethyl 3-methyl-5-nitro-1<i>H</i>-imidazole-2-carboxylate","Acta Crystallographica Section E","2004","60","6","o994","o995","10.1107/S1600536804011080","","","0.71073","MoKα","","0.042","0.038","","","0.115","0.124","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203715","10.025","0.003","7.335","0.003","9.845","0.003","90","","108.05","0.02","90","","688.3","0.4","298","2","298","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","7-iodo-8-hydroxquinoline-5-sulfonic acid‒urea‒water (1/1/1)","","","- C10 H12 I N3 O6 S -","- C10 H12 I N3 O6 S -","- C20 H24 I2 N6 O12 S2 -","2","0.5","BT6462","Graham Smith; Urs D. Wermuth; Peter C. Healy","The 1/1/1 adduct hydrate of 8-hydroxy-7-iodoquinoline-5-sulfonic acid (ferron) with urea","Acta Crystallographica Section E","2004","60","6","o1040","o1042","10.1107/S1600536804011274","","","0.71069","MoKα","","0.0286","0.0274","","","0.0849","0.0868","","","","","","0.891","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203716","10.178","0.003","13.653","0.003","7.438","0.002","90","","131.061","0.018","90","","779.3","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[mercury(II)-di-μ-bromo-μ-pyridazine-κ^2^N:N']","","- C4 H4 Br2 Hg N2 -","- C4 H4 Br2 Hg N2 -","- C16 H16 Br8 Hg4 N8 -","4","0.5","CF6341","Nockemann, Peter; Meyer, Gerd","<i>catena</i>-Poly[mercury(II)-di-μ-bromo-μ-pyridazine-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2004","60","6","m753","m754","10.1107/S1600536804010402","","","0.71073","MoKα","","0.0729","0.0662","","","0.1569","0.1647","","","","","","0.977","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203717","7.458","0.002","7.1667","0.0016","13.136","0.004","90","","90","","90","","702.1","0.3","293","2","293","2","","","","","","","","5","I m m a","-I 2b 2","74","","catena-Poly[mercury(II)-di-μ-chloro-μ-pyridazine-κ^2^N:N']","","- C4 H4 Cl2 Hg N2 -","- C4 H4 Cl2 Hg N2 -","- C16 H16 Cl8 Hg4 N8 -","4","0.25","CF6342","Nockemann, Peter; Meyer, Gerd","<i>catena</i>-Poly[mercury(II)-di-μ-chloro-μ-pyridazine-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2004","60","6","m751","m752","10.1107/S1600536804010414","","","0.71073","MoKα","","0.0479","0.0217","","","0.0268","0.03","","","","","","0.967","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203718","11.5603","0.001","8.3073","0.0019","12.9906","0.0016","90","","90","","90","","1247.6","0.3","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Poly[[dibromomercury(II)]-di-μ-pyrazine-k^4^N:N']","","- C8 H8 Br2 Hg N4 -","- C8 H8 Br2 Hg N4 -","- C32 H32 Br8 Hg4 N16 -","4","0.5","CF6343","Nockemann, Peter; Meyer, Gerd","Poly[[dibromomercury(II)]-di-μ-pyrazine-κ^4^<i>N:N</i>']","Acta Crystallographica Section E","2004","60","6","m747","m748","10.1107/S1600536804010438","","","0.71073","MoKα","","0.0486","0.0231","","","0.0342","0.0376","","","","","","0.849","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203719","11.897","0.0017","7.783","0.003","3.84","0.007","90","","90.99","0.06","90","","355.5","0.7","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Poly[di-μ-chloro-μ-pyrazine-κ^2^N:N'-mercury(II)]","","- C4 H4 Cl2 Hg N2 -","- C4 H4 Cl2 Hg N2 -","- C8 H8 Cl4 Hg2 N4 -","2","0.25","CF6344","Nockemann, Peter; Meyer, Gerd","Poly[mercury(II)-di-μ-chloro-μ-pyrazine-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2004","60","6","m744","m746","10.1107/S160053680401044X","","","0.71073","MoKα","","0.0228","0.0228","","","0.051","0.051","","","","","","1.094","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203720","7.107","0.002","7.114","0.003","8.436","0.003","95.72","0.03","109.3","0.02","113.14","0.02","357","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","μ-Pyrazine-κ^2^N:N'-bis[diiodomercury(II)]","","- C4 H4 Hg2 I4 N2 -","- C4 H4 Hg2 I4 N2 -","- C4 H4 Hg2 I4 N2 -","1","0.5","CF6345","Nockemann, Peter; Meyer, Gerd","μ-Pyrazine-κ^2^<i>N</i>:<i>N</i>'-bis[diiodomercury(II)]","Acta Crystallographica Section E","2004","60","6","m749","m750","10.1107/S1600536804010426","","","0.71073","MoKα","","0.076","0.0591","","","0.1622","0.1713","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203721","5.9465","0.0001","17.7167","0.0003","11.8918","0.0002","90","","90.037","0.001","90","","1252.83","0.04","183","2","183","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(3aS,5aR,10aS,11aR)-2,2-Dimethyl-3a,9,10,10a,11,11a-hexahydro- 5aH-1,3-dioxolo[4,5:3',4']furo[2',3'-f]indolizin-8(4H)-one","","- C13 H19 N O4 -","- C13 H19 N O4 -","- C52 H76 N4 O16 -","4","2","CF6347","Vrábel, Viktor; Kožíšek, Jozef; Langer, Vratislav; Marchalín, Štefan; Bobošíková, Maria","(3a<i>S</i>,5a<i>R</i>,10a<i>S</i>,11a<i>R</i>)-2,2-Dimethyl-3a,9,10,10a,11,11a-hexahydro-5a<i>H</i>-1,3-dioxolo[4,5:3',4']furo[2',3'-<i>f</i>]indolizin-8(4<i>H</i>)-one","Acta Crystallographica Section E","2004","60","6","o1069","o1071","10.1107/S1600536804012139","","","0.71073","MoKα","","0.0431","0.0354","","","0.0784","0.0822","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203722","7.487","0.001","16.444","0.001","15.748","0.001","90","","100.21","0.01","90","","1908.1","0.3","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H19 N O7.5 -","- C19 H11 N O7.5 -","- C76 H44 N4 O30 -","4","1","CF6352","Móczár, Ildikó; Huszthy, Péter; Báthori, Nikoletta; Czugler, Mátyás","A 2:1:1 2-(2-carboxyphenylamino)isophthalic acid‒ethyl acetate‒butan-2-one inclusion complex","Acta Crystallographica Section E","2004","60","6","o1067","o1068","10.1107/S1600536804012401","","","1.5418","CuKα","","0.0567","0.0521","","","0.163","0.1674","","","","","","1.1","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2203723","7.7376","0.0002","13.5917","0.0004","22.3338","0.0008","90","","90","","90","","2348.78","0.12","295","2","295","2","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C24 H18 Cl2 Mn N4 O3 -","- C24 H12 Cl2 Mn N4 O3 -","- C96 H48 Cl8 Mn4 N16 O12 -","4","0.5","CI6359","Zhi-Yong Wu; Duan-Jun Xu","<i>cis</i>-Dichlorobis(4,5-diazafluoren-9-one-κ^2^<i>N,N</i>')manganese(II) ethanol solvate","Acta Crystallographica Section E","2004","60","6","m839","m841","10.1107/S1600536804011870","","","0.71073","MoKα","","0.0375","0.0304","","","0.0719","0.0733","","","","","","0.986","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203724","9.705","0.0006","8.529","0.0004","16.312","0.001","90","","95.275","0.003","90","","1344.49","0.13","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H14 N2 O4 -","- C13 H14 N2 O4 -","- C52 H56 N8 O16 -","4","1","CI6360","Kauffmann, Brice; Didierjean, Claude; Brosse, Nicolas; Jamart-Grégoire, Brigitte; Aubry, Andre","<i>N</i>-(<i>tert</i>-Butyloxycarbonylamino)phthalimide","Acta Crystallographica Section E","2004","60","6","o934","o935","10.1107/S1600536804010098","","","0.71073","MoKα","","","0.0461","","","","0.1291","","","","","","1.035","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203725","12.291","0.001","8.294","0.001","12.273","0.001","90","","90","","90","","1251.1","0.2","287","2","287","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C15 H17 F O -","- C15 H17 F O -","- C60 H68 F4 O4 -","4","1","CI6365","Shen-Lin Huang; Yu-Lin Zhu; Yuan-Jiang Pan","(<i>E</i>)-2-(2-Fluorobenzylidene)cyclooctanone","Acta Crystallographica Section E","2004","60","6","o1000","o1002","10.1107/S1600536804011079","","","0.71073","MoKα","","0.042","0.0315","","","0.0706","0.0731","","","","","","0.936","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203726","5.3014","0.0019","10.502","0.004","21.102","0.007","90","","95.591","0.005","90","","1169.3","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-(2-Chlorobenzyl)-2-thioxoperhydropyrimidin-4-one","","- C11 H11 Cl N2 O S -","- C11 H11 Cl N2 O S -","- C44 H44 Cl4 N8 O4 S4 -","4","1","CI6372","Chang-Sheng Yao; Hai-Bin Song; You-Quan Zhu; Ying Gao; Fang-Zhong Hu; Xiao-Mao Zou; Hua-Zheng Yang","3-(2-Chlorobenzyl)-2-thioxoperhydropyrimidin-4-one","Acta Crystallographica Section E","2004","60","6","o943","o945","10.1107/S1600536804010347","","","0.71073","MoKα","","0.0548","0.0405","","","0.0957","0.1028","","","","","","1.073","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203727","9.727","0.003","12.77","0.004","15.947","0.006","90","","100.332","0.006","90","","1948.7","1.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","trans-5,5'-[(2-Butene-1,4-diyl)dithio]bis(1-phenyl-1,2,3,4-tetrazole)","","- C18 H16 N8 S2 -","- C18 H16 N8 S2 -","- C72 H64 N32 S8 -","4","1","CI6373","Wang, Wei; Liu, Hui-Min; Zhang, Wen-Qin","<i>trans</i>-5,5'-[(2-Butene-1,4-diyl)dithio]bis(1-phenyl-1,2,3,4-tetrazole)","Acta Crystallographica Section E","2004","60","6","o1107","o1109","10.1107/S1600536804011638","","","0.71073","MoKα","","0.0814","0.0406","","","0.0834","0.0974","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203728","10.422","0.004","13.881","0.005","17.591","0.006","90","","90","","90","","2544.9","1.6","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C30 H46 O -","- C30 H46 O -","- C120 H184 O4 -","4","1","CI6374","Shamaladevi Nagaraja Rao; Saradha Vasanth; Vasantha Pattabhi","Lup-1,20(29)-dien-3-one, a triterpenoid from <i>Agyneia bacciformis</i> A. Juss","Acta Crystallographica Section E","2004","60","6","o1092","o1093","10.1107/S160053680401236X","","","0.71073","MoKα","","0.0787","0.0606","","","0.1422","0.1523","","","","","","1.043","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2203729","9.255","0.004","10.161","0.004","16.188","0.005","90","","90","","90","","1522.3","1","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Anilinium nitrate","","- C6 H8 N2 O3 -","- C6 H8 N2 O3 -","- C48 H64 N16 O24 -","8","1","CI6376","Rademeyer, Melanie","Anilinium nitrate","Acta Crystallographica Section E","2004","60","6","o958","o960","10.1107/S1600536804010827","","","0.71073","MoKα","","0.1342","0.055","","","0.1319","0.1716","","","","","","1.055","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203730","5.7482","0.0012","7.648","0.0016","8.2817","0.0015","95.413","0.016","105.265","0.015","95.206","0.017","347.13","0.12","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H18 O2 -","- C18 H18 O2 -","- C18 H18 O2 -","1","0.5","CI6379","Ton, Quoc Cuong; Bolte, Michael","A triclinic polymorph of 1,4-dibenzoylbutane","Acta Crystallographica Section E","2004","60","6","o1019","o1020","10.1107/S1600536804011390","","","0.71073","MoKα","","0.0466","0.0359","","","0.0939","0.0958","","","","","","1.083","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203731","12.82","0.05","6.96","0.02","21.49","0.07","90","","106.51","0.06","90","","1838","11","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Aqua[N,N'-bis(2-oxidophenylmethyleneimino)-1,3- diaminopropane](thiocyanato)iron(III)","aqua{2,2'-[propane-1,3- diylbis(nitrilomethylidene)]diphenolato}(thiocyanato)iron(III))","","- C18 H18 Fe N3 O3 S -","- C18 H18 Fe N3 O3 S -","- C72 H72 Fe4 N12 O12 S4 -","4","1","CI6380","You, Zhong-Lu; Zhu, Hai-Liang; Liu, Wei-Sheng","Aqua[<i>N</i>,<i>N</i>'-bis(2-oxidophenylmethyleneimino)-1,3-diaminopropane](thiocyanato)iron(III)","Acta Crystallographica Section E","2004","60","6","m794","m796","10.1107/S1600536804011407","","","0.71073","MoKα","","0.141","0.0581","","","0.1124","0.1372","","","","","","0.847","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203732","10.508","0.003","12.998","0.004","15.266","0.005","90","","104.201","0.004","90","","2021.4","1.1","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[N,N'-Bis(salicylidene)-1,3-propanediaminato](thiocyanato)(methanol)nickel(II)","","- C19 H21 N3 Ni O3 S -","- C19 H21 N3 Ni O3 S -","- C76 H84 N12 Ni4 O12 S4 -","4","1","CI6382","You, Zhong-Lu; Zhu, Hai-Liang; Liu, Wei-Sheng","[<i>N,N</i>'-Bis(salicylidene)-1,3-propanediaminato](methanol)(thiocyanato)nickel(II)","Acta Crystallographica Section E","2004","60","6","m805","m807","10.1107/S1600536804011791","","","0.71073","MoKα","","0.0525","0.0363","","","0.0993","0.1067","","","","","","1.013","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203733","11.817","0.003","13.762","0.006","6.873","0.002","90","","101.15","0.03","90","","1096.6","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-{(Z)-Ethane-1,2-diylbis[(Z)-o-phenylenenitrilomethylidyne]}diphenol","","- C28 H24 N2 O2 -","- C28 H24 N2 O2 -","- C56 H48 N4 O4 -","2","0.5","CI6383","S. M. Malathy Sony; P. Charles; M. N. Ponnuswamy; H. S. Yathirajan","2,2'-{(<i>Z</i>)-Ethane-1,2-diylbis[(<i>Z</i>)-<i>o</i>-phenylenenitrilomethylidyne]}diphenol (EIEP)","Acta Crystallographica Section E","2004","60","6","o1078","o1080","10.1107/S1600536804012073","","","0.71073","MoKα","","0.1545","0.0572","","","0.1504","0.1991","","","","","","1.014","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203734","7.677","0.003","9.228","0.003","12.271","0.004","81.745","0.005","73.352","0.005","73.583","0.005","797.1","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 3-methyl-1-(3-methylbenzoyl)-5-(methylsulfanyl)-1H-pyrazole-4-carboxylate","","- C16 H18 N2 O3 S -","- C16 H18 N2 O3 S -","- C32 H36 N4 O6 S2 -","2","1","CI6384","Li-Rong Wen; Gui-Long Zhao; Ming Li; Xue-Mei Li; Shu-Sheng Zhang; Ping-Kai Ouyang","Ethyl 3-methyl-1-(3-methylbenzoyl)-5-(methylsulfanyl)-1<i>H</i>-pyrazole-4-carboxylate","Acta Crystallographica Section E","2004","60","6","o1026","o1028","10.1107/S1600536804011596","","","0.71073","MoKα","","0.0583","0.0428","","","0.0992","0.1089","","","","","","1.056","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203735","17.667","0.004","8.14","0.002","12.992","0.003","90","","99.21","0.03","90","","1844.3","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[N,N'-Bis(2-hydroxynaphthalmethenylimino)-1,2-ethanediaminato]cobalt(II)","","- C24 H18 Co N2 O2 -","- C24 H18 Co N2 O2 -","- C96 H72 Co4 N8 O8 -","4","1","CI6385","Ma, Ji-Long; You, Zhong-Lu; Zhu, Hai-Liang","[<i>N,N</i>'-Bis(2-hydroxynaphthylmethenylimino)-1,2-ethanediaminato]cobalt(II)","Acta Crystallographica Section E","2004","60","6","m817","m818","10.1107/S160053680401195X","","","0.71073","MoKα","","0.0813","0.0617","","","0.1243","0.1336","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203736","9.614","0.002","15.27","0.004","22.838","0.005","90","","90","","90","","3352.8","1.3","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(R)-2,2'-Dimethoxy-3,3'-bis{[(1S)-1-phenylethyl]iminomethyl}-1,1'- binaphthalene","","- C40 H36 N2 O2 -","- C40 H36 N2 O2 -","- C160 H144 N8 O8 -","4","1","CV6288","Li, Xingshu; Jia, Xian; Su, Liming; Zhou, Zhongyuan","(<i>R</i>)-2,2'-Dimethoxy-3,3'-bis{[(1<i>S</i>)-1-phenylethyl]iminomethyl}-1,1'-binaphthalene, a new chiral Schiff base","Acta Crystallographica Section E","2004","60","6","o998","o999","10.1107/S1600536804010931","","","0.71073","MoKα","","0.1567","0.0492","","","0.099","0.1182","","","","","","1.012","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203737","13.086","0.002","11.043","0.002","13.729","0.002","90","","92.11","0.02","90","","1982.6","0.6","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-Benzyl-3-(ferrocenylmethyl)imidazolium iodide","","- C21 H21 Fe I N2 -","- C21 H21 Fe I N2 -","- C84 H84 Fe4 I4 N8 -","4","1","CV6308","Hui Hua; Guo-Sheng Huang; Yong-Min Liang; Xiao-Li Wu; Yong-Xiang Ma; Bao-Hua Chen","1-Benzyl-3-(ferrocenylmethyl)imidazolium iodide","Acta Crystallographica Section E","2004","60","6","m761","m763","10.1107/S1600536804011006","","","0.71073","MoKα","","0.0409","0.0292","","","0.0654","0.0677","","","","","","0.93","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203738","8.576","0.0009","14.9072","0.0009","12.0912","0.0005","90","","92.146","0.007","90","","1544.7","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(E)-3-{[(Dimethoxythiophosphoryl)methylhydrazono]methyl}-4H-1-benzopyran-4-one","","- C13 H15 N2 O4 P S -","- C13 H15 N2 O4 P S -","- C52 H60 N8 O16 P4 S4 -","4","1","CV6309","Rybarczyk-Pirek, Agnieszka J.; Nawrot-Modranka, Jolanta","(<i>E</i>)-3-{[(Dimethoxythiophosphoryl)methylhydrazono]methyl}-4<i>H</i>-1-benzopyran-4-one, a new chromone derivative substituted with phosphorohydrazide at position 3","Acta Crystallographica Section E","2004","60","6","o988","o990","10.1107/S1600536804010943","","","1.54178","CuKα","","0.1403","0.0471","","","0.1112","0.1273","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203739","23.1233","0.0017","12.7597","0.0009","15.2076","0.0011","90","","116.032","0.001","90","","4031.7","0.5","273","2","273","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Dimethyl 1-(7-acetoxy-4-methyl-2-oxo-2H-chromen-8-ylmethyl)-1H-pyrazole- 3,4-dicarboxylate","","- C20 H18 N2 O8 -","- C20 H18 N2 O8 -","- C160 H144 N16 O64 -","8","1","CV6310","Thamotharan, S.; Parthasarathi, V.; Shinge, Prashant S.; Badami, Bharati; Ravikumar, K.","Dimethyl 1-(7-acetoxy-4-methyl-2-oxo-2<i>H</i>-chromen-8-ylmethyl)-1<i>H</i>-pyrazole-3,4-dicarboxylate","Acta Crystallographica Section E","2004","60","6","o961","o963","10.1107/S1600536804010955","","","0.71073","MoKα","","0.0734","0.0495","","","0.132","0.148","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203740","6.8548","0.0014","12.042","0.002","22.762","0.005","90","","90","","90","","1878.9","0.6","293","2","293","2","","","","","","","","5","P n a a","-P 2ac 2bc","56","","3-(4-Chlorophenyl)-5-methyl-3H-1,3,4-oxadiazole-2-one","","- C9 H7 Cl N2 O2 -","- C9 H7 Cl N2 O2 -","- C72 H56 Cl8 N16 O16 -","8","1","CV6311","Thamotharan, S.; Parthasarathi, V.; Kalaivani, P.; Mallur, Shanta G.; Badami, Bharati; Schenk, Kurt J.","3-(4-Chlorophenyl)-5-methyl-3<i>H</i>-1,3,4-oxadiazol-2-one","Acta Crystallographica Section E","2004","60","6","o964","o965","10.1107/S1600536804010967","","","0.71073","MoKα","","0.0639","0.0583","","","0.1638","0.1676","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203741","7.7954","0.0008","8.3922","0.0008","16.9225","0.0017","79.057","0.002","84.267","0.002","65.049","0.002","985.26","0.17","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","N-(4-Acetylphenyl)-N'-[(4-sydnone-3-yl)phenyl]urea dimethylformamide solvate","","- C20 H21 N5 O5 -","- C20 H21 N5 O5 -","- C40 H42 N10 O10 -","2","1","CV6313","Thamotharan, S.; Parthasarathi, V.; Sathishkumar, P.; Latthe, Prashant R.; Badami, Bharati; Ravikumar, K.","<i>N</i>-(4-Acetylphenyl)-<i>N</i>'-[(4-sydnon-3-yl)phenyl]urea dimethylformamide solvate","Acta Crystallographica Section E","2004","60","6","o1015","o1016","10.1107/S160053680401116X","","","0.71073","MoKα","","0.0561","0.0432","","","0.1069","0.1155","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203742","16.6389","0.0011","10.1097","0.0008","11.205","0.003","90","","109.247","0.01","90","","1779.5","0.5","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H16 Co N4 O8 S2 -","- C10 H14 Co N4 O8 S2 -","- C40 H56 Co4 N16 O32 S8 -","4","1","CV6314","Yi-Hong Shen; Jia-Geng Liu; Duan-Jun Xu","Aqua(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^<i>N</i>,<i>N</i>')(oxydiacetato-κ^3^<i>O</i>,<i>O</i>',<i>O</i>'')cobalt(II) dihydrate","Acta Crystallographica Section E","2004","60","6","m842","m844","10.1107/S1600536804011924","","","0.71073","MoKα","","0.067","0.05","","","0.115","0.123","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203743","9.172","0.003","12.014","0.007","12.597","0.008","75.15","0.001","73.95","0.001","86.79","0.01","1289.3","1.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Triaqua(2,2'-bipyridine)(thiophene-2,5-dicarboxylato)manganese 4,4'-bipyridine hemisolvate trihydrate","","- C42 H52 Mn2 N6 O20 S2 -","- C42 H52 Mn2 N6 O20 S2 -","- C42 H52 Mn2 N6 O20 S2 -","1","0.5","CV6316","Xian-Zhong Sun; Bao-Hui Ye","Triaqua(2,2'-bipyridine)(thiophene-2,5-dicarboxylato)manganese(II) 4,4'-bipyridine hemisolvate trihydrate","Acta Crystallographica Section E","2004","60","6","m878","m880","10.1107/S1600536804012619","","","0.71073","MoKα","","0.0551","0.0478","","","0.1318","0.1389","","","","","","1.045","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2203744","10.3531","0.0011","15.0133","0.0016","11.6892","0.0012","90","","95.138","0.002","90","","1809.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis{2'-[1-(2-hydroxyphenyl)ethylidene]benzohydrazido}bis(pyridine-κN)zinc(II)","","- C40 H36 N6 O4 Zn -","- C40 H36 N6 O4 Zn -","- C80 H72 N12 O8 Zn2 -","2","0.5","CV6317","Ali, Hapipah; Khamis, Nur Ashikin; Basirun, W. Jefri.; Yamin, Bohari M.","Bis{2'-[1-(2-hydroxyphenyl)ethylidene]benzohydrazido}bis(pyridine-κ<i>N</i>)zinc(II)","Acta Crystallographica Section E","2004","60","6","m873","m875","10.1107/S1600536804011936","","","0.71073","MoKα","","0.0783","0.0637","","","0.1379","0.1445","","","","","","1.219","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203745","9.2367","0.0015","9.7383","0.0016","11.5791","0.0019","85.764","0.003","76.748","0.003","66.394","0.003","928.8","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","N,N,N',N'-Tetrakis[(1H-benzimidazol-2-yl)methyl]ethane-1,2-diamine glycol disolvate","","- C38 H44 N10 O4 -","- C38 H44 N10 O4 -","- C38 H44 N10 O4 -","1","0.5","CV6318","Qin, Shi-Dong; Feng, Si-Si; Zhang, Hong-Mei; Yang, Pin; Zhu, Miao-Li","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetrakis[(1<i>H</i>-benzimidazol-2-yl)methyl]ethane-1,2-diamine glycol disolvate","Acta Crystallographica Section E","2004","60","6","o1121","o1122","10.1107/S1600536804012826","","","0.71073","MoKα","","0.1002","0.0689","","","0.1977","0.2498","","","","","","1.083","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203746","11.5912","0.0001","21.7257","0.0002","22.9487","0.0002","90","","90.7188","0.0004","90","","5778.65","0.09","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C42 H102 O11 Sn5 -","- C42 H102 O11 Sn5 -","- C168 H408 O44 Sn20 -","4","1","DN6124","Ballivet-TkatCchenko, Danielle; Burgat, Romain; Plasseraud, Laurent; Ricchard, Philippe","The ionic tin(IV) complex tri-μ~2~-methoxy-μ~3~-oxo-tris[di-<i>tert</i>-butyltin(IV)] tri-μ~2~-methoxy-bis[<i>tert</i>-butyldimethoxystannate(IV)]","Acta Crystallographica Section E","2004","60","6","m830","m832","10.1107/S1600536804011808","","","0.71073","MoKα","","0.0438","0.0275","","","0.0531","0.0569","","","","","","1.015","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203747","12.798","0.0006","10.8334","0.0003","10.9142","0.0003","90","","102.796","0.001","90","","1475.63","0.09","296","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-oxo-5-(5-phenyltetrazol-2-yl)piperidine-2-carboxylate","","- C14 H15 N5 O3 -","- C14 H15 N5 O3 -","- C56 H60 N20 O12 -","4","1","DN6134","Lenda, Fatimazohra; Guenoun, Farhate; Tasi, Bouchra; Ben larbi, Najib; Martinez, Jean; Lamaty, Frederic; Allouchi, Hassan","A new key intermediate in the synthesis of 6-oxopiperidine-2-carboxylate derivatives","Acta Crystallographica Section E","2004","60","6","o1038","o1039","10.1107/S1600536804011626","","","0.71069","MoKα","","","0.044","","","","0.1083","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203748","9.2651","0.0007","16.684","0.0014","16.8258","0.0014","92.13","0.002","90.032","0.002","94.958","0.002","2589.4","0.4","150","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C50 H76 N2 P4 Pt2 -","- C50 H76 N2 P4 Pt2 -","- C100 H152 N4 P8 Pt4 -","2","1","DN6135","Khan, Muhammad S.; Al-Suti, Mohammed K.; Ahrens, Birte; Raithby, Paul R.; Teat, Simon J.","<i>trans</i>-(μ-5,5'-Diethynyl-2,2'-bipyridine)bis[phenylbis(triethylphosphine)platinum(II)]","Acta Crystallographica Section E","2004","60","6","m735","m737","10.1107/S1600536804010359","","","0.6941","synchrotron","","0.0468","0.0318","","","0.0654","0.0677","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203749","15.8077","0.0007","5.4113","0.0002","15.894","0.0009","90","","95.343","0.002","90","","1353.67","0.11","293.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Phenyl-2-(toluene-4-sulfonyl)ethanone","","- C15 H14 O3 S -","- C15 H14 O3 S -","- C60 H56 O12 S4 -","4","1","DN6137","Gu, Jian-Ming; Zhang, You-Chu; Hu, Xiu-Rong","1-Phenyl-2-(toluene-4-sulfonyl)ethanone","Acta Crystallographica Section E","2004","60","6","o1115","o1116","10.1107/S160053680401267X","","","0.7107","MoKα","","","0.0448","","","","0.104","","","","","","1.011","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203750","15.3347","0.0002","13.028","0.0002","31.6125","0.0004","90","","102.678","0.001","90","","6161.58","0.15","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichloro(η^6^-p-cymene)[(2,4,6-tri-tert-butylphenyl)phosphine-κP]osmium","","- C28 H45 Cl2 Os P -","- C28 H45 Cl2 Os P -","- C224 H360 Cl16 Os8 P8 -","8","1","DN6138","Therrien, Bruno; Burrell, Anthony K.","Dichloro(η^6^-<i>p</i>-cymene)[η^1^-(2,4,6-tri-<i>tert</i>-butylphenyl)phosphine-κ<i>P</i>]osmium(II)","Acta Crystallographica Section E","2004","60","6","m863","m864","10.1107/S1600536804012474","","","0.71073","MoKα","","0.0379","0.031","","","0.0779","0.0807","","","","","","1.192","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2203751","9.337","0.003","9.601","0.004","9.947","0.005","68.18","0.03","84.25","0.03","71.52","0.02","785","0.6","300","","300","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H20 Cl2 N2 O4 -","- C14 H20 Cl2 N2 O4 -","- C28 H40 Cl4 N4 O8 -","2","1","FL6097","Hiroyuki Ishida","Pyrrolidinium chloranilate","Acta Crystallographica Section E","2004","60","6","o974","o976","10.1107/S1600536804010724","","","0.71073","MoKα","","0.078","0.043","","","0.142","0.159","","","","","","1.09","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203752","7.894","0.003","18.492","0.003","13.271","0.002","90","","101.46","0.02","90","","1898.6","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(4‒chlorophenyl)-5-methyl-7,8,9,10-tetrahydro-6H- cyclohepta[e][1,3]oxazolo[3,2-a]pyridin-11-ium perchlorate","","- C19 H19 Cl2 N O5 -","- C19 H19 Cl2 N O5 -","- C76 H76 Cl8 N4 O20 -","4","1","FL6103","Dmitry V. Albov; Victor B. Rybakov; Eugene V. Babaev; Leonid A. Aslanov","2-(4-Chlorophenyl)-5-methyl-7,8,9,10-tetrahydro-6<i>H</i>-cyclohepta[<i>e</i>][1,3]oxazolo[3,2-<i>a</i>]pyridin-11-ium perchlorate","Acta Crystallographica Section E","2004","60","6","o1096","o1097","10.1107/S1600536804012462","","","1.5418","CuKα","","0.0458","0.0419","","","0.1036","0.1068","","","","","","0.978","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203753","10.7198","0.0008","7.7518","0.0005","26.447","0.002","90","","93.635","0.001","90","","2193.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2,5-dicarboethoxy-3,4-bis(4-bromophenyl)cyclopentadienone","Diethyl 4,5-bis(4-bromophenyl)-2-oxocyclopentadiene-1,3-dicarboxylate","","- C23 H18 Br2 O5 -","- C23 H18 Br2 O5 -","- C92 H72 Br8 O20 -","4","1","FL6104","Grossie, David A.; Feld, William A.","Diethyl 4,5-bis(4-bromophenyl)-2-oxocyclopentadiene-1,3-dicarboxylate","Acta Crystallographica Section E","2004","60","6","o1017","o1018","10.1107/S1600536804011225","","","0.71069","MoKα","","0.065","0.0457","","","0.1196","0.1314","","","","","","1.015","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203754","6.937","0.002","8.674","0.002","17.491","0.004","90","","94.94","0.01","90","","1048.6","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[2-oxopyridine N-oxide(1-)-κ^2^O,O']palladium(II)","","- C10 H8 N2 O4 Pd -","- C10 H8 N2 O4 Pd -","- C40 H32 N8 O16 Pd4 -","4","1","HB6027","Xu, Li; Li, Yi-Zhi; Chen, Xue-Tai; Ji, Xing-Xiang","Bis[2-oxopyridine <i>N</i>-oxide(1‒)-κ^2^<i>O,O</i>']palladium(II)","Acta Crystallographica Section E","2004","60","6","m769","m770","10.1107/S1600536804006385","","","0.71073","MoKα","","0.07","0.0385","","","0.0746","0.08","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203755","6.94","0.001","9.319","0.002","10.765","0.002","99.36","0.01","94.86","0.02","106.27","0.02","653.2","0.2","293","2","","","","","","","","","","5","P -1","-P 1","2","","trans-bis[4-amino-3,5-bis(2-pyridyl)-4H-1,2,4-triazole- κ^2^N^1^,N^5^]bis(nitrato-κO)copper(II)","","- C24 H20 Cu N14 O6 -","- C24 H20 Cu N14 O6 -","- C24 H20 Cu N14 O6 -","1","0.5","HB6038","García-Couceiro, Urko; Castillo, Oscar; Luque, Antonio; Beobide, Garikoitz; Román, Pascual","<i>trans</i>-Bis[4-amino-3,5-bis(2-pyridyl)-4<i>H</i>-1,2,4-triazole-κ^2^<i>N</i>^1^,<i>N</i>^5^]bis(nitrato-κ<i>O</i>)copper(II)","Acta Crystallographica Section E","2004","60","6","m720","m722","10.1107/S1600536804010220","","","0.71073","MoKα","","0.1526","0.0462","","","0.0642","0.0781","","","","","","0.812","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203756","11.882","0.002","16.367","0.003","12.744","0.003","90","","90.353","0.003","90","","2478.3","0.8","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Aquachloro[tris(methylpyridyl)amine]cobalt(III) diperchlorate monohydrate","","","- C18 H22 Cl3 Co N4 O10 -","- C18 H22 Cl3 Co N4 O10 -","- C72 H88 Cl12 Co4 N16 O40 -","4","1","HB6039","Failes, Timothy W.","Aquachloro[tris(methylpyridyl)amine]cobalt(III) diperchlorate monohydrate","Acta Crystallographica Section E","2004","60","6","m781","m782","10.1107/S1600536804011341","","","0.71073","MoKα","","0.0507","0.0366","","","0.1016","0.1075","","","","","","1.072","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203757","14.213","0.004","4.9447","0.0012","11.401","0.002","90","","97.284","0.019","90","","794.8","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","sodium 2-aminobenzenesulfonate","","","- C6 H6 N Na O3 S -","- C6 H6 N Na O3 S -","- C24 H24 N4 Na4 O12 S4 -","4","1","HB6040","Graham Smith; Urs D. Wermuth; David J. Young; Peter C. Healy","Polymeric anhydrous sodium 2-aminobenzensulfonate","Acta Crystallographica Section E","2004","60","6","m836","m838","10.1107/S1600536804011456","","","0.71069","MoKα","","0.0626","0.0395","","","0.1129","0.1527","","","","","","0.891","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203758","18.0843","0.0005","8.198","0.0014","21.469","0.0012","90","","90","","90","","3182.9","0.6","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","1-n-Butyl-2-(4'-fluorophenyl)-1H-benzimidazole-6-carbonitrile","","- C18 H16 F N3 -","- C18 H16 F N3 -","- C144 H128 F8 N24 -","8","2","HB6041","Kazak, Canan; Yilmaz, Veysel T.; Goker, Hakan; Kus, Canan","1-<i>n</i>-Butyl-2-(4'-fluorophenyl)-1<i>H</i>-benzimidazole-6-carbonitrile","Acta Crystallographica Section E","2004","60","6","m819","m821","10.1107/S1600536804011468","","","0.71073","MoKα","","0.0678","0.036","","","0.0761","0.083","","","","","","0.8","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203759","10.577","0.002","12.779","0.002","17.924","0.003","75.562","0.004","88.993","0.003","71.629","0.003","2221.7","0.7","120","2","120","2","","","","","","","","6","P -1","-P 1","2","(Ir(fppy)2Cl)2","Di-μ-chloro-bis{bis[4-(2-pyridyl)benzaldehyde-κ^2^C^2^,N']iridium} dichloromethane sesquisolvate","","- C49.5 H35 Cl5 Ir2 N4 O4 -","- C49.5 H35 Cl5 Ir2 N4 O4 -","- C99 H70 Cl10 Ir4 N8 O8 -","2","1","HB6042","Bettington, Sylvia; Thompson, Amber L.; Beeby, Andrew; Goeta, Andrés E.","Di-μ-chloro-bis{bis[4-(2-pyridyl)benzaldehyde-κ^2^<i>C</i>^2^,<i>N</i>']iridium} dichloromethane sesquisolvate","Acta Crystallographica Section E","2004","60","6","m827","m829","10.1107/S1600536804011663","","","0.71073","MoKα","","0.0699","0.0423","","","0.0805","0.0883","","","","","","1.029","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2203760","7.8694","0.0013","8.866","0.0013","10.2643","0.0011","65.788","0.011","69.511","0.012","81.816","0.014","611.83","0.17","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H30 Co N8 O10 -","- C18 H30 Co N8 O10 -","- C18 H30 Co N8 O10 -","1","0.5","HB6043","Zhen-Feng Chen; Jian Zhou; Hong Liang; Yu-Hui Tan; Yong Zhang","Bis{3-[(<i>E</i>)-2-(aminocarbonyl)hydrazonomethyl]pyridine-κ<i>N</i>}tetraaquacobalt(II) diacetate","Acta Crystallographica Section E","2004","60","6","m802","m804","10.1107/S1600536804011420","","","0.7107","MoKα","","0.0297","0.0279","","","0.0677","0.0685","","","","","","1.082","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203761","15.0895","0.0018","10.8217","0.0013","15.2048","0.0018","90","","104.705","0.002","90","","2401.5","0.5","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H30 Cu2 N2 O15 -","- C17 H30 Cu2 N2 O15 -","- C68 H120 Cu8 N8 O60 -","4","1","HB6044","Meng, Bianhong; Huang, Shuping; Gao, Fei","Redetermination of [HCu~2~{(CH~3~HXTA)(H)}(H~2~O)~2~]·4H~2~O [CH~3~HXTA = <i>N,N</i>'-(2-hydroxy-5-methyl-1,3-xylylene)bis(<i>N</i>-carboxymethylglycine)]","Acta Crystallographica Section E","2004","60","6","m797","m799","10.1107/S1600536804011432","","","0.71073","MoKα","","0.0362","0.0312","","","0.0804","0.0819","","","","","","1.005","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203762","7.2401","0.0002","8.0946","0.0002","10.2386","0.0003","75.814","0.001","70.486","0.001","73.894","0.001","535.62","0.03","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","(1,4,7,10,13,16-hexaoxacyclooctadecane)potassium dithiocyanatogold(I)","","- C14 H24 Au K N2 O6 S2 -","- C14 H24 Au K N2 O6 S2 -","- C14 H24 Au K N2 O6 S2 -","1","0.5","HB6045","Coker, Nathan L.; Krause Bauer, Jeanette A.; Elder, R. C.","(1,4,7,10,13,16-Hexaoxacyclooctadecane)potassium dithiocyanatoaurate(I)","Acta Crystallographica Section E","2004","60","6","m814","m816","10.1107/S1600536804011614","","","0.71073","MoKα","","0.0177","0.0177","","","0.0385","0.0385","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203763","8.748","0.001","19.503","0.002","17.247","0.002","90","","94.842","0.005","90","","2932","0.6","150.2","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C26 H23 Ag F8 N2 O4 S2 -","- C26 H23 Ag F8 N2 O4 S2 -","- C104 H92 Ag4 F32 N8 O16 S8 -","4","0.5","HB6047","Liu, Shu Qin; Konaka, Hisashi; Kuroda-Sowa, Takayoshi; Maekawa, Masahiko; Suenaga, Yusaku; Ning, Gui Ling; Munakata, Megumu","<i>catena</i>-Poly[[[diacetonitrilesilver(I)]-μ-2,11-dithia[3.3]paracyclophane-κ^2^<i>S</i>:<i>S</i>'] hydrogenoctafluoroadipate]","Acta Crystallographica Section E","2004","60","6","m865","m867","10.1107/S1600536804012486","","","0.7107","MoKα","","","0.035","","","","0.0669","","","","","","1.097","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203764","13.3664","0.0003","11.4709","0.0003","17.1147","0.0004","90","","112.16","0.001","90","","2430.27","0.1","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","dimethylammonium 1,1'-spiro-bis(3,5,-dihydroxy-2,4,6-trioxa-1,3,5-triboracyclohexane)borate","","- C2 H12 B5 N O10 -","- C2 H12 B5 N O10 -","- C16 H96 B40 N8 O80 -","8","1","HB6049","R. Angharad Baber; Jonathan P. H. Charmant; Nicholas C. Norman; A. Guy Orpen; Jean Rossi","Dimethylammonium tetrahydropentaborate","Acta Crystallographica Section E","2004","60","6","o1086","o1088","10.1107/S1600536804012371","","","1.54178","CuKα","","0.0392","0.0339","","","0.0861","0.0884","","","","","","0.989","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203765","16.0338","0.001","13.64","0.0008","16.6764","0.001","90","","96.779","0.001","90","","3621.6","0.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(tetramethylammonium) hexaaquacobalt(II) β-octamolybdate(vi)","","- C8 H36 Co Mo8 N2 O32 -","- C8 H36 Co Mo8 N2 O32 -","- C32 H144 Co4 Mo32 N8 O128 -","4","0.5","HG6029","Shu-Mei Chen; Can-Zhong Lu; Ya-Qin Yu; Quan-Zheng Zhang; Xiang He","Bis(tetramethylammonium) hexaaquacobalt(II) β-octamolybdate(VI)","Acta Crystallographica Section E","2004","60","6","m723","m725","10.1107/S1600536804007524","","","0.71073","MoKα","","","0.0386","","","0.0966","0.1051","","","","","","1.099","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203766","13.178","0.007","11.587","0.006","14.516","0.007","90","","112.949","0.008","90","","2041.1","1.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[3,6,9,12,23-Pentaazatetracyclo[22.4.0.0^2,6^.0^14,19^]octacosa- 1(28),12,14,16,18,24,26-heptaene-21,22-dione(2-)- κ^5^N^6^,N^9^,N^12^,N^20^,N^23^]copper(II)","","- C22 H24 Cu N6 O2 -","- C22 H24 Cu N6 O2 -","- C88 H96 Cu4 N24 O8 -","4","1","HG6037","Ya-Qiu Sun; Wen Dong; Guang-Ming Yang; Dai-Zheng Liao","[3,6,9,12,23-Pentaazatetracyclo[22.4.0.0^2,6^.0^14,19^]octacosa-1(28),12,14,16,18,24,26-heptaene-21,22-dione(2‒)-κ^5^<i>N</i>^6^,<i>N</i>^9^,<i>N</i>^12^,<i>N</i>^20^,<i>N</i>^23^]copper(II)","Acta Crystallographica Section E","2004","60","6","m848","m849","10.1107/S1600536804011973","","","0.71073","MoKα","","0.1059","0.0516","","","0.1106","0.1376","","","","","","1.058","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203767","21.104","0.002","9.1302","0.001","18.3734","0.0019","90","","103.935","0.002","90","","3436.1","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Li[N(SiMe~3~)C(ph)N]C~2~H~4~NMe~2~","Bis{μ-N-[(2-(dimethylamino)ethyl]-N'- (trimethylsilyl)benzamidinato}dilithium(I)","","- C28 H48 Li2 N6 Si2 -","- C28 H48 Li2 N6 Si2 -","- C112 H192 Li8 N24 Si8 -","4","0.5","HG6039","Tong, Hong-Bo; Wei, Xue-Hong; Liu, Dian-Sheng; Huang, Su-Ping","Bis{μ-<i>N</i>-[(2-(dimethylamino)ethyl]-<i>N</i>'-(trimethylsilyl)benzamidinato}dilithium(I)","Acta Crystallographica Section E","2004","60","6","m825","m826","10.1107/S1600536804011560","","","0.71073","MoKα","","0.08","0.0684","","","0.1679","0.1765","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203768","6.94","0.002","15.994","0.004","15.573","0.004","90","","93.93","0.01","90","","1724.5","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[1-(4-chlorobenzyl)-3-methylpyrazinium] bis(maleonitriledithiolato)nickelate(II)","","- C32 H24 Cl2 N8 Ni S4 -","- C32 H24 Cl2 N8 Ni S4 -","- C64 H48 Cl4 N16 Ni2 S8 -","2","0.5","HG6041","Minghua Yang; Chunlin Ni; Yunfa Zheng; Weijin Gu","Bis[1-(4-chlorobenzyl)-3-methylpyrazinium] bis(maleonitriledithiolato)nickelate(II)","Acta Crystallographica Section E","2004","60","6","m833","m835","10.1107/S1600536804011705","","","0.71073","MoKα","","0.0394","0.032","","","0.08","0.082","","","","","","1.081","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203769","6.9084","0.0002","8.7738","0.0004","8.8162","0.0004","99.552","0.002","110.209","0.002","104.461","0.002","466.51","0.03","150","2","296","2","","","","","","","","4","P -1","-P 1","2","","Poly[[diaquacerium(III)]-μ~5~-propane-1,2,3-tricarboxylato]","","- C6 H9 Ce O8 -","- C6 H9 Ce O8 -","- C12 H18 Ce2 O16 -","2","1","HG6042","Armstrong, Jennifer A.; Barnes, John C.","Poly[[diaquacerium(III)]-μ~5~-propane-1,2,3-tricarboxylato]","Acta Crystallographica Section E","2004","60","6","m791","m793","10.1107/S1600536804011389","","","0.71073","MoKα","","0.027","0.0261","","","0.0634","0.064","","","","","","1.128","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203770","15.712","0.007","6.141","0.003","10.464","0.005","90","","104.96","0.04","90","","975.4","0.8","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","rac-ammonium trans-2-carboxycyclohexanecarboxylate","","- C8 H15 N O4 -","- C8 H15 N O4 -","- C32 H60 N4 O16 -","4","1","HG6043","Robert T. Stibrany; Harvey J. Schugar; Joseph A. Potenza","The hydrogen-bonding network in <i>rac</i>-ammonium <i>trans</i>-2-carboxycyclohexanecarboxylate","Acta Crystallographica Section E","2004","60","6","o1012","o1014","10.1107/S1600536804011146","","","0.71073","MoKα","","0.0906","0.0541","","","0.1312","0.154","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203771","24.373","0.002","7.5744","0.0006","10.0284","0.0009","90","","106.134","0.002","90","","1778.4","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","DL-Valine‒succinic acid (2/1)","","- C14 H28 N2 O8 -","- C14 H28 N2 O8 -","- C56 H112 N8 O32 -","4","0.5","HG6046","M. Alagar; M. Subha Nandhini; R. V. Krishnakumar; K. Ravikumar; S. Natarajan","<small>DL</small>-Valine‒succinic acid (2/1)","Acta Crystallographica Section E","2004","60","6","o1009","o1011","10.1107/S1600536804011134","","","0.71073","MoKα","","0.0546","0.0482","","","0.1277","0.1326","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203772","13.001","0.003","23.211","0.003","27.01","0.008","90","","90","","90","","8151","3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(Dibenzylacetone-κO)(1,3-diphenylpropane-1,3-dionato- κ^2^O,O')dioxouranium(VI)","","- C47 H36 O7 U -","- C47 H36 O7 U -","- C376 H288 O56 U8 -","8","1","HG6047","M. Alagar; S. Kannan; K. Rajagopal; V. Venugopal; R. V. Krishnakumar; M. Subha Nandhini; S. Natarajan","(Dibenzylacetone-κ<i>O</i>)(1,3-diphenylpropane-1,3-dionato-κ^2^<i>O,O</i>')dioxouranium(VI)","Acta Crystallographica Section E","2004","60","6","m773","m775","10.1107/S1600536804011122","","","0.71073","MoKα","","0.203","0.0701","","","0.144","0.267","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203773","11.883","0.004","13.833","0.004","15.737","0.005","90","","90","","90","","2586.8","1.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","9α-fluoro-11β,17α,21-trihydroxy-16β-methyl-3,20-dioxopregna-1,4-diene- 17,21-diyl dipropionate","","- C28 H37 F O7 -","- C28 H37 F O7 -","- C112 H148 F4 O28 -","4","1","HG6048","Shu-Li Wang; Yan Zheng; Wen-Qin Zhang","Betamethasone dipropionate","Acta Crystallographica Section E","2004","60","6","o1063","o1064","10.1107/S160053680401205X","","","0.71073","MoKα","","0.0794","0.0587","","","","0.1743","","","","","","1.09","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203774","10.419","0.006","12.996","0.002","13.841","0.002","90","","90","","90","","1874.1","1.1","293","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","21,24-dimethyl-3,12,21,24-tetraazahexacyclo[9.7.3.3^2,10^. O^1,10^.O^4,9^.O^13,18^]tetracosa-4,6,8,13(18),14,16-hexaene","","- C22 H28 N4 O -","- C22 H28 N4 O -","- C88 H112 N16 O4 -","4","1","HG6049","Vencato, Ivo; Lariucci, Carlito; Oliveira, Cecilia M. A. de; Kato, Lucilia; Nascimento, Claudia A. do","Calycanthine monohydrate","Acta Crystallographica Section E","2004","60","6","o1023","o1025","10.1107/S160053680401178X","","","1.5418","CuKα","","0.0657","0.0653","","","0.149","0.15","","","","","","1.16","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203775","9.2424","0.0002","16.521","0.0005","11.9154","0.0004","90","","98.631","0.002","90","","1798.8","0.09","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C22 H22 O4 -","- C22 H22 O4 -","- C88 H88 O16 -","4","1","HG6050","Simpson, Michael; Storey, John M. D.; Harrison, William T. A.","Diethyl 9,10-<i>endo</i>-ethano-9,10-dihydroanthracene-11,11-dicarboxylate","Acta Crystallographica Section E","2004","60","6","o1081","o1083","10.1107/S1600536804012279","","","0.71073","MoKα","","0.0735","0.0554","","","0.1328","0.143","","","","","","1.056","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203776","7.6677","0.0003","26.7366","0.0012","6.6477","0.0003","90","","109.065","0.002","90","","1288.08","0.1","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-[Bis(cyclopropanecarbonyl)amino]-4,6-dichloropyrimidine","","- C12 H11 Cl2 N3 O2 -","- C12 H11 Cl2 N3 O2 -","- C48 H44 Cl8 N12 O8 -","4","1","HG6054","Walji, Dhiran; Storey, John M. D.; Harrison, William T. A.","5-[Bis(cyclopropanecarbonyl)amino]-4,6-dichloropyrimidine containing a short cyclopropyl C—H···O interaction","Acta Crystallographica Section E","2004","60","6","o1110","o1112","10.1107/S1600536804012577","","","0.71073","MoKα","","0.0814","0.0426","","","0.0901","0.1037","","","","","","0.984","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203777","9.1419","0.0013","10.0656","0.0014","12.1721","0.0017","90.438","0.003","105.11","0.003","94.126","0.003","1078.1","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4'-[(2-Butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]-1,1'-biphenyl- 2-carbonitrile‒water (4/1)","","- C25 H27.5 N3 O1.25 -","- C25 H27.5 N3 O1.25 -","- C50 H55 N6 O2.5 -","2","1","LH6182","Qing Bao Song; You Hua Hu; Tian Hua Shen; Zhi Min Jin","4'-[(2-Butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]-1,1'-biphenyl-2-carbonitrile 0.25-hydrate","Acta Crystallographica Section E","2004","60","6","m741","m743","10.1107/S1600536804008463","","","0.71073","MoKα","","0.0893","0.0557","","","0.101","0.1179","","","","","","1.038","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2203778","10.099","0.005","16.315","0.007","18.593","0.008","90","","90","","90","","3063","2","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C8 H7 N3 O -","- C8 H7 N3 O -","- C128 H112 N48 O16 -","16","2","LH6207","Ling Xu; Guo-Cong Guo; Bing Liu; Ming-Lai Fu; Jin-Shun Huang","3-(1<i>H</i>-1,2,4-Triazol-4-yl)phenol","Acta Crystallographica Section E","2004","60","6","o1060","o1062","10.1107/S1600536804012152","","","0.71073","MoKα","","0.0594","0.0546","","","0.1167","0.119","","","","","","1.271","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203779","7.8664","0.0012","10.714","0.0016","22.582","0.003","90","","99.569","0.003","90","","1876.7","0.5","293","2","293","2","","","","","","","","8","P 1 2/n 1","-P 2yac","13","","Bis[μ-(S)-1-(1-ferrocenylethylidene)-4-methylthiosemicarbazide- κ^2^C^2^,N,S:S]bis[dicarbonylruthenium] dichlormethane solvate","","- C33 H34 Cl2 Fe2 N6 O4 Ru2 S2 -","- C33 H34 Cl2 Fe2 N6 O4 Ru2 S2 -","- C66 H68 Cl4 Fe4 N12 O8 Ru4 S4 -","2","0.5","LH6209","Jing-Mu Yang; Wen-Bin Ma; Bao-Hua Chen; Guo-Sheng Huang; Yong-Xiang Ma","Bis[μ-(<i>S</i>)-1-(1-ferrocenylethylidene)-4-methylthiosemicarbazide-κ^2^<i>C</i>^2^,<i>N,S</i>:<i>S</i>]bis(dicarbonylruthenium) dichloromethane solvate","Acta Crystallographica Section E","2004","60","6","m852","m853","10.1107/S1600536804012164","","","0.71073","MoKα","","0.1262","0.0657","","","0.1371","0.1576","","","","","","0.855","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203780","9.177","0.005","15.124","0.01","13.334","0.007","90","","101.73","0.02","90","","1812","1.8","102","","102","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Chloro[N,N'-ethylenebis(5-carboxysalicylideneiminato)]iron(III)","","- C18 H14 Cl Fe N2 O6 -","- C18 H14 Cl Fe N2 O6 -","- C72 H56 Cl4 Fe4 N8 O24 -","4","1","LH6213","Chen, Banglin; Contreras, Damacio S.; Clancy, Yvette L.; Fronczek, Frank R.","Chloro[<i>N,N</i>'-ethylenebis(5-carboxysalicylideneiminato)]iron(III)","Acta Crystallographica Section E","2004","60","6","m732","m734","10.1107/S160053680401030X","","","0.71073","MoKα","","0.193","0.074","","","0.128","0.167","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203781","9.754","0.0002","33.4646","0.0007","8.901","0.0001","90","","103.602","0.0009","90","","2823.92","0.09","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis-(5-amino-3-methyl-1-phenyl-1H-pyrazol-4-yl)-3,4,5-trimethoxyphenylmethane","","- C30 H32 N6 O3 -","- C30 H32 N6 O3 -","- C120 H128 N24 O12 -","4","1","LH6214","Low, John N.; Cobo, Justo; Portilla, Jaime; Quiroga, Jairo; Glidewell, Christopher","Bis(5-amino-3-methyl-1-phenyl-1<i>H</i>-pyrazol-4-yl)-3,4,5-trimethoxyphenylmethane: sheets built from N—H···N and N—H···O hydrogen bonds","Acta Crystallographica Section E","2004","60","6","o1034","o1037","10.1107/S1600536804011511","","","0.71073","MoKα","","0.0778","0.0554","","","0.1314","0.1443","","","","","","1.043","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203782","7.991","0.002","8.611","0.002","11.007","0.002","100.5","0.03","98.46","0.03","102.37","0.03","713.6","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Bis(4,4'-dimethyl-2,2'-bipyridinium) hexachlororhenium(IV) dihydrate","","- C24 H30 Cl6 N4 O2 Re -","- C24 H30 Cl6 N4 O2 Re -","- C24 H30 Cl6 N4 O2 Re -","1","0.5","LH6215","Andrzej Kochel","Bis(4,4'-dimethyl-2,2'-bipyridinium) hexachlororhenium(IV) dihydrate","Acta Crystallographica Section E","2004","60","6","m859","m860","10.1107/S1600536804012255","","","0.71073","MoKα","","0.0751","0.0549","","","0.0706","0.0755","","","","","","0.95","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203783","13.1346","0.0012","9.2316","0.0009","14.2385","0.0014","90","","95.171","0.002","90","","1719.4","0.3","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","tetramethylammonium oxodisulfatevanadate","Tetrakis(tetramethylammonium) di-am-sulfato-bis[oxosulfatovanadium(V)]","","- C16 H48 N4 O18 S4 V2 -","- C16 H48 N4 O18 S4 V2 -","- C32 H96 N8 O36 S8 V4 -","2","0.5","LH6220","Ngala, Katana; Zavalij, Peter Y.; Whittingham, M. Stanley","Tetrakis(tetramethylammonium) di-μ-sulfato-bis[oxosulfatovanadate(V)]","Acta Crystallographica Section E","2004","60","6","m881","m883","10.1107/S1600536804012589","","","0.71073","MoKα","","0.0336","0.0309","","","0.0758","0.0777","","","","","","1","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203784","6.5253","0.0002","21.4286","0.0005","10.8198","0.0009","90","","90","","90","","1512.91","0.14","120","2","120","2","","","","","","","","4","P n a 21","P 2c -2n","33","","rac-5-Acetyl-6-(4-nitrophenyl)-6,7-dihydro-5H-1,3-dioxolo[4,5-g]quinoline-8-one","","- C18 H14 N2 O6 -","- C18 H14 N2 O6 -","- C72 H56 N8 O24 -","4","1","LH6221","Low, John N.; Cobo, Justo; Ortíz, Angy; Cuervo, Paola; Abonia, Rodrigo; Glidewell, Christopher","<i>rac</i>-5-Acetyl-6-(4-nitrophenyl)-6,7-dihydro-5<i>H</i>-1,3-dioxolo[4,5-<i>g</i>]quinoline-8-one: chains of rings built from C—H···O and C—H···π(arene) hydrogen bonds","Acta Crystallographica Section E","2004","60","6","o1057","o1059","10.1107/S1600536804012140","","","0.71073","MoKα","","0.0697","0.0415","","","0.0783","0.0865","","","","","","1.058","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203785","9.728","0.003","17.232","0.005","14.953","0.005","90","","108.076","0.006","90","","2382.9","1.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","{2,2'-Bis[(3-aminopropyl)iminomethyl]oxalanilide}cobalt(III) perchlorate","","- C22 H26 Cl Co N6 O6 -","- C22 H26 Cl Co N6 O6 -","- C88 H104 Cl4 Co4 N24 O24 -","4","1","NA6309","Ya-Qiu Sun; Wen Dong; Guang-Ming Yang; Dai-Zheng Liao","{2,2'-Bis[(3-aminopropyl)iminomethyl]oxalanilide}cobalt(III) perchlorate","Acta Crystallographica Section E","2004","60","6","m730","m731","10.1107/S1600536804009894","","","0.71073","MoKα","","0.1142","0.0538","","","0.1005","0.1181","","","","","","0.992","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203786","13.071","0.003","8.36","0.001","17.418","0.004","90","","109.01","0.02","90","","1799.5","0.7","293","","293","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","(E)-1-[1-ethoxycarbonyl-2(N-benzylamino)-1-propenyl]benzotriazole.","","- C19 H20 N4 O2 -","- C19 H20 N4 O2 -","- C76 H80 N16 O8 -","4","1","NA6321","Guo-Bin Zhou; Peng-Fei Zhang; Zhen-Chu Chen; Yuan-Jiang Pan","Ethyl (<i>E</i>)-2-(1<i>H</i>-benzotriazol-1-yl)-3-(<i>N</i>-benzylamino)but-2-enoate","Acta Crystallographica Section E","2004","60","6","o1021","o1022","10.1107/S1600536804011250","","","0.7107","MoKα","","","0.042","","","0.051","","","","","1.18","1.18","","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203787","11.6567","0.0001","13.6627","0.0001","24.1997","0.0002","90","","90","","90","","3854.09","0.05","220","2","220","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C39 H42 Cl4 N4 Pd -","- C39 H42 Cl4 N4 Pd -","- C156 H168 Cl16 N16 Pd4 -","4","1","NA6322","Lebel, Hélène; Sanchez Salvatori, Maria del Rayo; Bélanger-Gariépy, Francine","(<i>R</i>)-Bis[1,3-bis(1-phenylethyl)imidazolin-2-ylidene]dichloropalladium(II) dichloromethane solvate","Acta Crystallographica Section E","2004","60","6","m755","m757","10.1107/S1600536804010451","","","1.54178","CuKα","","0.0374","0.0338","","0.0844","","0.0829","","","1.013","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203788","7.0546","0.0003","23.3933","0.0011","16.2515","0.0009","90","","102.405","0.003","90","","2619.4","0.2","110","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H24 N2 O4 S2 -","- C31 H24 N2 O4 S2 -","- C124 H96 N8 O16 S8 -","4","1","NA6324","Pinkus, A. G.; Klausmeyer, Kevin K.; Feazell, Rodney P.; Jiro Tsuji","<i>N</i>,<i>N</i>-[(<i>Z</i>,<i>Z</i>)-7,7-Diphenylbicyclo[4.1.0]hept-3-ene-2,5-diylidene]dibenzenesulfonamide","Acta Crystallographica Section E","2004","60","6","o982","o984","10.1107/S1600536804010815","","","0.71073","MoKα","","0.0383","0.0323","","","0.0824","0.0871","","","","","","1.032","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203789","9.2265","0.0005","11.6587","0.0006","11.9719","0.0007","80.92","0.001","87.804","0.001","89.488","0.001","1270.73","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H64 Co N10 O10 -","- C52 H64 Co N10 O10 -","- C52 H64 Co N10 O10 -","1","0.5","NA6326","Nordell, Karen J.; Schultz, Kristin N.; Smith, Mark D.","<i>trans</i>-Diaquatetrakis(4,4'-methylenediphenylamine-κ<i>N</i>)cobalt(II) dinitrate dihydrate","Acta Crystallographica Section E","2004","60","6","m857","m858","10.1107/S1600536804011894","","","0.71073","MoKα","","0.0521","0.0405","","","0.0787","0.0813","","","","","","0.989","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203790","7.876","0.002","20.352","0.004","8.664","0.002","90","","101.87","0.01","90","","1359.1","0.5","298","1","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C5 H6 N2 O5 -","- C5 H6 N2 O5 -","- C40 H48 N16 O40 -","8","2","NA6327","Law, Ga-Lai; Szeto, Lap; Wong, Wing-Tak","2,4-Dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid monohydrate","Acta Crystallographica Section E","2004","60","6","o1072","o1074","10.1107/S1600536804012267","","","0.7107","MoKα","","","0.045","","","","0.047","","","","","","1.089","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203791","14.891","0.003","13.416","0.003","15.936","0.003","90","","91.781","0.016","90","","3182.1","1.1","298","2","298","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C10 H9 Cl9 -","- C10 H9 Cl9 -","- C80 H72 Cl72 -","8","2","NA6328","Hansen, Lars Kr.; Kallenborn, Roland; Kiprianova, Anastasia; Nikiforov, Vladimir; Trukhin, Alexey","An enantiomerically pure potential toxaphene congener: (1<i>R</i>,2<i>S</i>,3<i>S</i>,4<i>R</i>,7<i>S</i>)-2-<i>endo</i>,3-<i>exo</i>,5,5-tetrachloro-7-(chloromethyl)-1,7-bis(dichloromethyl)bicyclo[2.2.1]heptane","Acta Crystallographica Section E","2004","60","6","o1089","o1091","10.1107/S1600536804012437","","","0.71069","MoKα","","0.0319","0.0252","","","0.0632","0.0654","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203792","13.221","0.001","15.1466","0.0011","7.5827","0.0006","90","","105.324","0.002","90","","1464.47","0.19","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Chloroacetophenone 2,4-dinitrophenylhydrazone","","- C14 H11 Cl N4 O4 -","- C14 H11 Cl N4 O4 -","- C56 H44 Cl4 N16 O16 -","4","1","NA6329","Zheng Fan; Shang Shan; Wei-Xiao Hu; Duan-Jun Xu","3-Chloroacetophenone 2,4-dinitrophenylhydrazone","Acta Crystallographica Section E","2004","60","6","o1102","o1104","10.1107/S1600536804012590","","","0.71069","MoKα","","0.083","0.05","","","0.114","0.127","","","","","","1.024","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203793","7.851","0.002","7.657","0.002","16.296","0.004","90","","111.09","0.01","90","","914","0.4","173","2","173","2","","","","","","","","5","P 1 c 1","P -2yc","7","","4,7-Dibromobenzo[c]furazan 1-oxide‒pyrene (1/1)","","- C22 H12 Br2 N2 O2 -","- C22 H12 Br2 N2 O2 -","- C44 H24 Br4 N4 O4 -","2","1","NA6330","Britton, Doyle","4,7-Dibromobenzo[<i>c</i>]furazan 1-oxide‒pyrene (1/1)","Acta Crystallographica Section E","2004","60","6","o1117","o1118","10.1107/S1600536804012449","","","0.71073","MoKα","","0.082","0.051","","","0.111","0.127","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","201973","2020-10-21","18:00:00",""
"2203794","6.2691","0.0016","9.2424","0.001","14.926","0.003","94.39","0.01","98.02","0.02","94.56","0.02","850.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-(4-chlorophenacyl)oxy-4-methyl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine","","- C19 H20 Cl N O2 -","- C19 H20 Cl N O2 -","- C38 H40 Cl2 N2 O4 -","2","1","NA6333","Dmitry V. Albov; Victor B. Rybakov; Eugene V. Babaev; Leonid A. Aslanov","2-(4-Chlorophenacyloxy)-4-methyl-6,7,8,9-tetrahydro-5<i>H</i>-cyclohepta[<i>b</i>]pyridine","Acta Crystallographica Section E","2004","60","6","o1098","o1099","10.1107/S1600536804012450","","","1.5418","CuKα","","0.0676","0.0496","","","0.1291","0.1436","","","","","","0.952","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203795","13.8888","0.0007","18.8359","0.0009","13.9301","0.0007","90","","116.545","0.001","90","","3260.1","0.3","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H84 O18 Si6 Sn6 -","- C36 H84 O18 Si6 Sn6 -","- C72 H168 O36 Si12 Sn12 -","2","0.5","NG6029","Beckmann, Jens; Dakternieks, Dainis; Duthie, Andrew; Thompson, Laura; Tiekink, Edward R. T.","Hexameric trimethylsilylmethyloxotin acetate, [(Me~3~SiCH~2~)Sn(O)(OAc)]~6~","Acta Crystallographica Section E","2004","60","6","m767","m768","10.1107/S1600536804011055","","","0.71069","MoKα","","0.064","0.044","","","0.086","0.093","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203796","7.8498","0.0019","8.836","0.002","10.2711","0.0017","65.822","0.015","69.678","0.016","82.14","0.02","609.5","0.2","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H30 N8 Ni O10 -","- C18 H30 N8 Ni O10 -","- C18 H30 N8 Ni O10 -","1","0.5","NG6031","Zhen-Feng Chen; Jian Zhou; Dong-Qing Li; Ming-Xiong Tan; Hong Liang; Yong Zhang","Bis{3-[(<i>E</i>)-2-(aminocarbonyl)hydrazonomethyl]pyridine-κ<i>N</i>}tetraaquanickel(II) diacetate","Acta Crystallographica Section E","2004","60","6","m861","m862","10.1107/S1600536804012425","","","0.7107","MoKα","","0.0424","0.0376","","","0.0753","0.077","","","","","","1.124","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203797","8.7205","0.0006","20.2972","0.0013","8.8322","0.0006","90","","102.295","0.001","90","","1527.46","0.18","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dimethyl (Z, Z)-3,3'-(propane-1,2-diyldiimino)dibut-2-enoate","","- C13 H22 N2 O4 -","- C13 H22 N2 O4 -","- C52 H88 N8 O16 -","4","1","OB6365","Zhenfeng Zhang; Shuo Jin; Bo Liu; Jianping Guo","Dimethyl (<i>Z,Z</i>)-3,3'-(propane-1,2-diyldiimino)dibut-2-enoate","Acta Crystallographica Section E","2004","60","6","o991","o993","10.1107/S1600536804010372","","","0.71073","MoKα","","0.0677","0.058","","","0.1851","0.1966","","","","","","1.108","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203798","13.0562","0.0003","13.0562","0.0003","10.4754","0.0005","90","","90","","120","","1546.45","0.09","173","2","173","2","","","","","","","","7","P -3","-P 3","147","","fac-Triaqua[tris(2-pyridyl)amine]chromium(III) trifluoromethanesulfonate","","- C18 H18 Cr F9 N4 O12 S3 -","- C18 H18 Cr F9 N4 O12 S3 -","- C36 H36 Cr2 F18 N8 O24 S6 -","2","0.333333","OB6366","Terasaki, Yukiko; Fujihara, Takashi; Nagasawa, Akira; Kaizaki, Sumio","<i>fac</i>-Triaqua[tris(2-pyridyl)amine-κ^3^<i>N</i>]chromium(III) tris(trifluoromethanesulfonate)","Acta Crystallographica Section E","2004","60","6","m854","m856","10.1107/S1600536804011912","","","0.71073","MoKα","","0.0338","0.0324","","","0.0878","0.0888","","","","","","1.066","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203799","8.877","0.001","18.508","0.003","22.098","0.003","90","","90","","90","","3630.6","0.9","295","2","295","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Tetraaquaphenanthrolinemanganese(II) sulfate dihydrate","","- C12 H20 Mn N2 O10 S -","- C12 H20 Mn N2 O10 S -","- C96 H160 Mn8 N16 O80 S8 -","8","1","OB6367","Hui Wu; Jun Zhou; Huizhen Yu; Leilei Lu; Zhou Xu; Yu Wan; Daqing Shi","Tetraaquaphenanthrolinemanganese(II) sulfate dihydrate","Acta Crystallographica Section E","2004","60","6","m822","m824","10.1107/S1600536804011602","","","0.71073","MoKα","","0.051","0.0311","","","0.0653","0.0692","","","","","","0.892","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203800","9.091","0.004","14.789","0.006","8.396","0.003","103.52","0.03","93.65","0.03","80.41","0.04","1081.8","0.8","296","","","","","","","","","","","6","P -1","-P 1","2","","","","- C6 H18 As O6 P3 S6 -","- C6 H18 As O6 P3 S6 -","- C12 H36 As2 O12 P6 S12 -","2","1","OB6370","Tetsuzo Ito","Tris(<i>O</i>,<i>O</i>'-dimethyl dithiophosphato-κ^2^<i>S</i>,<i>S</i>')arsenic(III)","Acta Crystallographica Section E","2004","60","6","m783","m784","10.1107/S1600536804011237","","","0.7107","MoKα","","","0.029","","","","0.031","","","","","","1.541","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203801","17.08","0.05","8.95","0.02","7.23","0.02","90","","112.52","0.03","90","","1021","5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(2,2'-Bipyridine-κ^2^N,N')dichlorocopper(II)","","- C10 H8 Cl2 Cu N2 -","- C10 H8 Cl2 Cu N2 -","- C40 H32 Cl8 Cu4 N8 -","4","0.5","OB6373","Wang, Yan-Qin; Bi, Wen-Hua; Li, Xing; Cao, Rong","(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')dichlorocopper(II)","Acta Crystallographica Section E","2004","60","6","m876","m877","10.1107/S1600536804012565","","","0.71073","MoKα","","0.076","0.0549","","","0.1419","0.1578","","","","","","1.052","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203802","9.968","0.001","18.381","0.002","10.215","0.001","90","","108.883","0.006","90","","1770.9","0.3","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","2,5-Bis[(cyclopentyldiphenylstannyl)sulfanyl]-1,3,4-thiadiazole","","- C36 H38 N2 S3 Sn2 -","- C36 H38 N2 S3 Sn2 -","- C72 H76 N4 S6 Sn4 -","2","1","SU6096","Lo, Kong Mun; Ng, Seik Weng","2,5-Bis[(cyclopentyldiphenylstannyl)sulfanyl]-1,3,4-thiadiazole","Acta Crystallographica Section E","2004","60","6","m715","m716","10.1107/S1600536804010190","","","0.71073","MoKα","","0.042","0.031","","","0.066","0.071","","","","","","0.97","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203803","12.324","0.003","12.842","0.003","19.975","0.004","90","","107.54","0.03","90","","3014.4","1.3","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[Bis(p-chlorophenyl)(p-tolyl)chlorotin]-μ-1,2-bis(diphenylphosphoryl)ethane- κ^2^O:O'-[bis(p-chlorophenyl)(p-tolyl)bromotin]","","- C64 H58 Br Cl5 O2 P2 Sn2 -","- C64 H54 Br Cl5 O2 P2 Sn2 -","- C128 H108 Br2 Cl10 O4 P4 Sn4 -","2","0.5","SU6097","Lo, Kong Mun; Ng, Seik Weng","[Chlorobis(<i>p</i>-chlorophenyl)(<i>p</i>-tolyl)tin]-μ-1,2-bis(diphenylphosphoryl)ethane-κ^2^<i>O</i>:<i>O</i>'-[bromobis(<i>p</i>-chlorophenyl)(<i>p</i>-tolyl)tin]","Acta Crystallographica Section E","2004","60","6","m717","m719","10.1107/S1600536804010219","","","0.71073","MoKα","","0.109","0.054","","","0.093","0.114","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203804","26.2518","0.0009","9.3899","0.0004","18.496","0.0006","90","","90","","90","","4559.3","0.3","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","(2-Methylbenzimidaxolyl-κN)(triphenylphosphine-κP)gold(I) hemihydrate","","- C26 H23 Au N2 O0.5 P -","- C26 H23 Au N2 O0.5 P -","- C208 H184 Au8 N16 O4 P8 -","8","1","SU6098","Li, Dan; Wu, Tao; Ng, Seik Weng","(2-Methylbenzimidazolyl-κ<i>N</i>)(triphenylphosphine-κ<i>P</i>)gold(I) hemihydrate","Acta Crystallographica Section E","2004","60","6","m728","m729","10.1107/S1600536804010268","","","0.71073","MoKα","","0.068","0.038","","","0.08","0.092","","","","","","0.99","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203805","4.8528","0.0004","7.0073","0.0006","23.256","0.003","90","","90","","90","","790.82","0.14","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3,5-Dimethyl-pyrazol-1-yl)acetic acid","","- C7 H10 N2 O2 -","- C7 H10 N2 O2 -","- C28 H40 N8 O8 -","4","1","SU6099","Andrew N Boa; Jonathan D Crane","(3,5-Dimethylpyrazol-1-yl)acetic acid","Acta Crystallographica Section E","2004","60","6","o966","o967","10.1107/S1600536804010761","","","0.71073","MoKα","","0.0759","0.0487","","","0.13","0.1472","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203806","11.012","0.015","8.31","0.015","12.941","0.015","90","","108.406","0.015","90","","1124","3","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-(2-biphenyl)sydnone","","- C14 H10 N2 O2 -","- C14 H10 N2 O2 -","- C56 H40 N8 O8 -","4","1","SU6100","Riddle, Gordon B.; Grossie, David A.; Turnbull, Kenneth","3-(2-Biphenyl)sydnone","Acta Crystallographica Section E","2004","60","6","o977","o978","10.1107/S1600536804010773","","","0.70998","synchrotron","","0.0538","0.0495","","","0.137","0.1458","","","","","","1.128","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203807","11.285","0.003","11.862","0.003","16.449","0.004","80.97","0.004","71.818","0.004","62.518","0.004","1855.7","0.8","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-acetato-μ-hydroxo-bis{acetato[bis(2-pyridyl)amine]cobalt(II)} acetate tetrahydrate","","- C28 H40 Co2 N6 O14 -","- C28 H40 Co2 N6 O14 -","- C56 H80 Co4 N12 O28 -","2","1","SU6101","Miao Du; Xiao-Jun Zhao","μ-Acetato-di-μ-hydroxo-bis{acetato[bis(2-pyridyl)amine]cobalt(III)} acetate tetrahydrate: a novel mixed-bridged dinuclear Co^III^ complex with bis(2-pyridyl)amine as terminal ligands","Acta Crystallographica Section E","2004","60","6","m785","m787","10.1107/S160053680401133X","","","0.71073","MoKα","","0.0809","0.0482","","","0.1239","0.1418","","","","","","1.004","","","","has coordinates,has Fobs","189124","2020-10-21","18:00:00",""
"2203808","11.425","0.004","9.78","0.004","7.726","0.003","90","","90.967","0.006","90","","863.2","0.6","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C12 H20 Co N2 O12 -","- C12 H20 Co N2 O12 -","- C24 H40 Co2 N4 O24 -","2","0.25","SU6102","Miao Du; Xiao-Jun Zhao; Jian-Hua Guo","Hexaquacobalt(II) bis(isonicotinate <i>N</i>-oxide): a redetermination and analysis of the hydrogen-bonding interactions","Acta Crystallographica Section E","2004","60","6","m788","m790","10.1107/S1600536804011249","","","0.71073","MoKα","","0.0369","0.0359","","","0.0811","0.0817","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203809","8.646","0.005","10.5079","0.0006","10.7934","0.0006","91.477","0.001","111.107","0.001","109.929","0.001","847.6","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(μ-4-nitrophenolato-κ^2^O:O')bis[(2,2'-bipyridine-κ^2^N,N')nitrolead(II)]","","- C32 H24 N8 O12 Pb2 -","- C32 H24 N8 O12 Pb2 -","- C32 H24 N8 O12 Pb2 -","1","0.5","SU6103","Hong-Ping Xiao; Nan-Wen Zhu; Mao-Lin Hu","Bis(μ-4-nitrophenolato-κ^2^<i>O</i>:<i>O</i>')bis[(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')nitratolead(II)]","Acta Crystallographica Section E","2004","60","6","m800","m801","10.1107/S1600536804011419","","","0.71073","MoKα","","0.0255","0.0237","","","0.0516","0.0523","","","","","","1.111","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203810","11.05","0.003","11.2116","0.0004","16.3949","0.0006","90","","90","","90","","2031.1","0.6","291","1","291","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C21 H39 N -","- C21 H39 N -","- C84 H156 N4 -","4","1","SU6104","Müller, Kai-Sven; Schürmann, Markus; Preut, Hans; Eilbracht, Peter","Tris(cyclohexylmethyl)amine","Acta Crystallographica Section E","2004","60","6","o1100","o1101","10.1107/S1600536804011535","","","0.71073","MoKα","","0.1229","0.0342","","","0.0575","0.0653","","","","","","0.881","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203811","9.442","0.001","5.063","0.001","27.926","0.004","90","","90","","90","","1335","0.4","293","2","293","2","","","","","","","","6","P c a 21","P 2c -2ac","29","trans-[Cu(gly)~2~].4-BrPhOHl","trans-bis(glycinato-N,O)copper(II) 4-bromophenol solvate","","- C10 H13 Br Cu N2 O5 -","- C10 H13 Br Cu N2 O5 -","- C40 H52 Br4 Cu4 N8 O20 -","4","1","SU6106","Bakir, Mohammed; Clarke, Suzanne A.; Hassan, Ishmael; Lancashire, Robert J.; Singh-Wilmot, Marvadeen","<i>trans</i>-Bis(glycinato-κ^2^<i>N,O</i>)copper(II) 4-bromophenol solvate","Acta Crystallographica Section E","2004","60","6","m868","m870","10.1107/S1600536804012541","","","0.71073","MoKα","","0.0611","0.0425","","","0.0946","0.1039","","","","","","1.034","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203812","9.1403","0.0008","12.5346","0.001","14.851","0.0013","109.503","0.003","104.308","0.004","93.099","0.004","1536.6","0.2","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H26 Cl2 O4 Si -","- C38 H26 Cl2 O4 Si -","- C76 H52 Cl4 O8 Si2 -","2","1","SU6108","Pinkus, A. G.; Klausmeyer, Kevin K.; Feazell, Rodney P.; Alice T. Y. Ku","2,2'-[(Diphenylsilylene)dioxy]bis(5-chlorobenzophenone)","Acta Crystallographica Section E","2004","60","6","o1094","o1095","10.1107/S1600536804012516","","","0.71073","MoKα","","0.0586","0.0395","","","0.1013","0.1076","","","","","","1.092","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203813","25.073","0.013","5.147","0.004","13.296","0.012","90","","115.64","0.05","90","","1547","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dianilinediiodozinc(II)","","- C12 H14 I2 N2 Zn -","- C12 H14 I2 N2 Zn -","- C48 H56 I8 N8 Zn4 -","4","0.5","TK6156","Rademeyer, Melanie","Dianilinediiodozinc(II)","Acta Crystallographica Section E","2004","60","6","m871","m872","10.1107/S160053680401181X","","","0.71073","MoKα","","0.056","0.041","","","0.101","0.11","","","","","","0.96","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203814","15.976","0.003","9.168","0.004","17.635","0.003","90","","107.213","0.013","90","","2467.3","1.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H24 As2 S2 -","- C26 H24 As2 S2 -","- C104 H96 As8 S8 -","4","0.5","TK6162","Davies, Sian C.; Smith, Matt C.; Evans, David J.","1,2-Bis(diphenylthioarsinoyl)ethane","Acta Crystallographica Section E","2004","60","6","m771","m772","10.1107/S1600536804011158","","","0.71069","Mo-Kα","","0.105","0.043","","","0.073","0.097","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203815","4.8686","0.0005","22.688","0.003","10.0658","0.0011","90","","98.223","0.008","90","","1100.4","0.2","293","","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(3-pyridyloxy)phthalonitrile","","- C13 H7 N3 O -","- C13 H7 N3 O -","- C52 H28 N12 O4 -","4","1","TK6164","Yazıcı, Serap; Akdemir, Nesuhi; Aǧar, Erbil; Özil, Musa; Şenel, İsmet; Büyükgüngör, Orhan","4-(3-Pyridyloxy)phthalonitrile","Acta Crystallographica Section E","2004","60","6","o1119","o1120","10.1107/S1600536804010797","","","0.71073","MoKα","","0.12","0.04","","","0.041","0.045","","","","","","0.99","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203816","13.342","0.001","15.552","0.001","12.013","0.0008","90","","94.076","0.002","90","","2486.3","0.3","295","1","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H24 N6 O4 S4 -","- C20 H24 N6 O4 S4 -","- C80 H96 N24 O16 S16 -","4","1","TK6165","Cheng-Xia Tan; Jian-Ming Gu; De-Long Shen; Jian-Quan Weng; De-Fang Fan","Bis[3-ethyl-1-methyl-5-(2-oxothiazolidin-3-ylcarbonyl)pyrazol-4-yl] disulfide","Acta Crystallographica Section E","2004","60","6","o1029","o1030","10.1107/S1600536804011833","","","0.7107","MoKα","","","0.037","","","","0.097","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203817","4.866","0.002","22.435","0.009","6.04","0.002","90","","90.664","0.007","90","","659.3","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","isopropylglucoheptonamide","N-isopropyl-D-glycero-D-gulo-heptonamide","","- C10 H21 N O7 -","- C10 H21 N O7 -","- C20 H42 N2 O14 -","2","1","TK6166","Metta-Magaña, Alejandro J.; Tlahuext, Hugo; Reyes-Martínez, Reyna","<i>N</i>-Isopropyl-α-glucoheptonamide","Acta Crystallographica Section E","2004","60","6","o1046","o1048","10.1107/S1600536804011821","","","0.71073","MoKα","","0.048","0.044","","","0.11","0.113","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203818","7.1937","0.0006","13.8894","0.0012","14.3709","0.0012","90","","93.271","0.002","90","","1433.5","0.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C30 H34 O10 -","- C30 H34 O10 -","- C60 H68 O20 -","2","0.5","TK6167","Baell, Jonathan B.; Gable, Robert W.; Harvey, Andrew J.","1,6-Bis(5-acetyl-4,7-dimethoxybenzofuran-6-yloxy)hexane","Acta Crystallographica Section E","2004","60","6","o996","o997","10.1107/S1600536804011067","","","0.71073","MoKα","","0.065","0.047","","","0.119","0.131","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203819","15.2175","0.0003","5.297","0.0001","15.8185","0.0003","90","","104.893","0.004","90","","1232.25","0.05","293","1","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H12 N4 O5 -","- C10 H12 N4 O5 -","- C40 H48 N16 O20 -","4","1","TK6169","Cheng-Xia Tan; Jian-Ming Gu; De-Long Shen; Jian-Quan Weng; De-Fang Fan","3-(5-Ethyl-2-methyl-4-nitro-2<i>H</i>-pyrazole-3-carbonyl)oxazolidin-2-one","Acta Crystallographica Section E","2004","60","6","o1084","o1085","10.1107/S1600536804012280","","","0.7107","MoKα","","","0.064","","","","0.193","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203820","6.6561","0.0002","11.1986","0.0003","11.8739","0.0003","90","","90","","90","","885.07","0.04","183","2","183","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,4,4a,5,6,7,9,9a-Octahydrofuro[2,3-f]indolizin-7-one","","- C10 H13 N O2 -","- C10 H13 N O2 -","- C40 H52 N4 O8 -","4","1","WK6013","Vrábel, Viktor; Kožíšek, Jozef; Langer, Vratislav; Marchalín, Štefan","2,4,4a,5,6,7,9,9a-Octahydrofuro[2,3-<i>f</i>]indolizin-7-one","Acta Crystallographica Section E","2004","60","6","o932","o933","10.1107/S1600536804005483","","","0.71073","MoKα","","0.051","0.041","","","0.107","0.115","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203821","8.3723","0.0018","4.7404","0.0011","9.799","0.002","90","","90","","90","","388.89","0.15","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","Europium(II) bromide iodide","","- Br Eu I -","- Br Eu I -","- Br4 Eu4 I4 -","4","0.5","WM6017","Liao, Wuping; Liu, Xiaohui; Dronskowski, Richard","Europium(II) bromide iodide","Acta Crystallographica, Section E","2004","60","6","i69","i71","10.1107/S160053680401075X","","","0.71073","MoKα","","0.0595","0.0378","","","0.073","0.0802","","","","","","1.075","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2203822","6.8558","0.0009","7.255","0.001","10.1444","0.0013","90","","90.869","0.003","90","","504.51","0.12","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","trisodium yttrium(III) hexachloride","","- Cl6 Na3 Y -","- Cl6 Na3 Y -","- Cl12 Na6 Y2 -","2","0.5","WM6018","Liao, Wuping; Dronskowski, Richard","Trisodium yttrium(III) hexachloride","Acta Crystallographica, Section E","2004","60","6","i72","i73","10.1107/S1600536804011043","","","0.71073","MoKα","","0.0367","0.0272","","","0.0564","0.0591","","","","","","1.024","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2203823","7.494","0.0012","13.915","0.0011","18.377","0.0013","90","","90","","90","","1916.3","0.4","293","2","293","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","","2-[2-(cyanomethoxy)phenoxy]acetonitrile","","- C10 H8 N2 O2 -","- C10 H8 N2 O2 -","- C80 H64 N16 O16 -","8","1","WN6235","Ustabaş, Reşat; Çoruh, Ufuk; Sancak, Kemal; Er, Mustafa; Ünver, Yasemin; Yavuz, Metin","2-[2-(Cyanomethoxy)phenoxy]acetonitrile","Acta Crystallographica Section E","2004","60","6","o968","o970","10.1107/S1600536804010785","","","0.71073","MoKα","","0.1197","0.0479","","","0.0909","0.1068","","","","","","0.729","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203824","8.133","0.005","15.762","0.005","11.752","0.005","90","0.005","95.231","0.005","90","0.005","1500.2","1.2","293","2","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C19 H18 O2 -","- C19 H18 O2 -","- C76 H72 O8 -","4","1","WN6240","Arıcı, Cengiz; Ülkü, Dinçer; Kırılmış, Cumhur; Koca, Murat; Ahmedzade, Misir","1-(1-Benzofuran-2-yl)-2-mesitylethanone","Acta Crystallographica Section E","2004","60","6","o941","o942","10.1107/S1600536804010116","","","0.71073","MoKα","","","0.058","","","","0.154","","","","","","1.02","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203825","8.6587","0.001","20.5881","0.0019","11.0082","0.0013","90","","100.187","0.009","90","","1931.5","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Benzoyl-N-methyl-1,5-diphenyl-1H-pyrazole-3-carboxamide","","- C24 H19 N3 O2 -","- C24 H19 N3 O2 -","- C96 H76 N12 O8 -","4","1","WN6243","Dinçer, Muharrem; Özdemir, Namık; Yıldırım, İsmail; Demir, Elif; Işık, Şamil","4-Benzoyl-<i>N</i>-methyl-1,5-diphenyl-1<i>H</i>-pyrazole-3-carboxamide","Acta Crystallographica Section E","2004","60","6","o946","o948","10.1107/S1600536804010517","","","0.71073","MoKα","","0.1452","0.0581","","","0.1184","0.1326","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203826","6.0743","0.0013","7.2436","0.0016","15.916","0.003","90","","95.334","0.004","90","","697.3","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(2S,3S)-3-hydroxy-1-(4-methoxybenzyl)piperidine-2-carboxamide","","- C14 H20 N2 O3 -","- C14 H20 N2 O3 -","- C28 H40 N4 O6 -","2","1","WN6244","Feng, Chen-Guo; Fang, Hua; Huang, Pei-Qiang","(2<i>S</i>,3<i>S</i>)-3-Hydroxy-1-(4-methoxybenzyl)piperidine-2-carboxamide","Acta Crystallographica Section E","2004","60","6","o1075","o1077","10.1107/S1600536804012085","","","0.71073","MoKα","","0.0445","0.0443","","","0.1238","0.124","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203827","8.7869","0.0008","8.8329","0.0008","22.095","0.002","90","","95.21","0.01","90","","1707.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(diisopropylammonium) sulfate","","- C12 H32 N2 O4 S -","- C12 H32 N2 O4 S -","- C48 H128 N8 O16 S4 -","4","1","WN6246","Guido J. Reiß; Judith S. Engel","Bis(diisopropylammonium) sulfate","Acta Crystallographica Section E","2004","60","6","o985","o987","10.1107/S1600536804010645","","","0.71073","MoKα","","0.0821","0.0555","","","0.0902","0.099","","","","","","1.012","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203828","26.46","0.01","5.467","0.002","21.477","0.006","90","","123.93","0.03","90","","2577.8","1.8","150","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C13 H18 O5 -","- C13 H18 O5 -","- C104 H144 O40 -","8","1","WN6247","Andreas Fischer; Veronica M. Profir","A 2-propanol solvate of (<i>RS</i>)-phenylsuccinic acid","Acta Crystallographica Section E","2004","60","6","o979","o981","10.1107/S160053680401061X","","","0.71073","MoKα","","0.1067","0.0577","","","0.1091","0.1314","","","","","","1.081","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203829","9.6154","0.0007","11.5957","0.001","13.1996","0.0015","66.198","0.008","74.053","0.008","67.858","0.006","1234.1","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H15 Cl4 N4 O2 P3 -","- C22 H15 Cl4 N4 O2 P3 -","- C44 H30 Cl8 N8 O4 P6 -","2","1","WN6249","Tercan, Barış; Hökelek, Tuncer; Işıklan, Muhammed; İlter, Elif Ece; Kılıç, Zeynel","4,4,6,6-Tetrachloro-4a',8'-dihydrodinaphtho[2,1-<i>c</i>';2,1-<i>g</i>']-2λ^5^,4λ^5^,6λ^5^-cyclotriphosphazene-1-spiro-1'-[2,5,8a,1]dioxazaphosphanaphthalene","Acta Crystallographica Section E","2004","60","6","o971","o973","10.1107/S1600536804010803","","","0.71073","MoKα","","0.1032","0.0504","","","0.1244","0.1482","","","","","","0.987","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203830","8.856","0.0008","17.4364","0.0019","14.463","0.002","90","","105.457","0.009","90","","2152.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H23 I3 N2 -","- C18 H23 I3 N2 -","- C72 H92 I12 N8 -","4","1","WN6253","Xuejie Tan; Sixiu Sun; Wentao Yu; Dianxiang Xing; Yonggang Wang; Chenggang Qi","<i>trans</i>-4-[<i>p</i>-(<i>N,N</i>-Diethylamino)styryl]-<i>N</i>-methylpyridinium triiodide","Acta Crystallographica Section E","2004","60","6","o1054","o1056","10.1107/S1600536804011869","","","0.71073","MoKα","","0.077","0.0431","","","0.0874","0.0996","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203831","11.82","0.003","10.175","0.003","24.169","0.007","90","","96.512","0.004","90","","2888","1.4","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3,5-Di-tert-butyl-2-hydroxybenzaldehyde","","- C15 H22 O2 -","- C15 H22 O2 -","- C120 H176 O16 -","8","2","WN6254","Chu, Zhao-Lian; Huang, Wei; Cui, Kai; Gou Shao-Hua","3,5-Di-<i>tert</i>-butyl-2-hydroxybenzaldehyde","Acta Crystallographica Section E","2004","60","6","o1043","o1045","10.1107/S1600536804012036","","","0.71073","MoKα","","0.0793","0.0529","","","0.152","0.165","","","","","","1.011","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203832","8.826","0.002","10.951","0.002","11.043","0.002","90","","101.57","0.02","90","","1045.7","0.4","173.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","tert-Butyloxycarbonyl-L-Alanyl-L-Leucyl-L-Lactic Acid","","- C17 H30 N2 O7 -","- C17 H30 N2 O7 -","- C34 H60 N4 O14 -","2","1","WW6184","Oku, Hiroyuki; Yamada, Keiichi; Katakai, Ryoichi","An N-protected depsipeptide free acid prepared by direct synthesis without using a terminal-C protecting group: <i>tert</i>-butoxycarbonyl-<small>L</small>-alanyl-<small>L</small>-leucyl-<small>L</small>-lactic acid (Boc-<small>L</small>-Ala-<small>L</small>-Leu-<small>L</small>-Lac-OH)","Acta Crystallographica Section E","2004","60","6","o927","o929","10.1107/S1600536804010189","","","1.5418","CuKα","","","0.068","","","","0.156","","","","","","1.255","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203833","15.348","0.009","5.98","0.003","20.909","0.012","90","","102.488","0.009","90","","1873.7","1.8","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4-(4-tert-Butylphenyl)-3,5-di-2-pyridyl-4H-1,2,4-triazole","","- C22 H21 N5 -","- C22 H21 N5 -","- C88 H84 N20 -","4","1","WW6192","Zhang, Shu-ping; Liu, Hui-jun; Shao, Si-chang; Zhang, Ying; Shun, De-guang; Yang, Song; Zhu, Hai-liang","4-(4-tert-Butylphenyl)-3,5-di-2-pyridyl-4H-1,2,4-triazole","Acta Crystallographica, Section E","2004","60","6","o1113","o1114","10.1107/S1600536804008712","","","0.71073","MoKα","","0.0993","0.051","","","0.1216","0.1466","","","","","","0.957","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203834","22.203","0.001","17.877","0.001","18.487","0.001","90","","90","","90","","7337.9","0.7","296","2","293","2","","","","","","","","7","P c c n","-P 2ab 2ac","56","","Iodo(1-methyl-2-mercaptoimidazole-κS)bis(triphenylphosphine-κP)copper(I)","","- C40 H36 Cu I N2 P2 S -","- C40 H36 Cu I N2 P2 S -","- C320 H288 Cu8 I8 N16 P16 S8 -","8","1","WW6196","Li, Dan; Luo, Ya-Fang; Wu, Tao; Ng, Seik Weng","Iodo(1-methyl-2-mercaptoimidazole-κ<i>S</i>)bis(triphenylphosphine-κ<i>P</i>)copper(I)","Acta Crystallographica Section E","2004","60","6","m726","m727","10.1107/S1600536804010256","","","0.71073","MoKα","","0.086","0.052","","","0.106","0.124","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203835","7.3913","0.0006","9.3377","0.0008","18.643","0.002","90","","94.209","0.002","90","","1283.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(4-Pyridyl)-1H-benzimidazole trihydrate","","- C12 H15 N3 O3 -","- C12 H15 N3 O3 -","- C48 H60 N12 O12 -","4","1","WW6198","Huang, Xiao-Chun; Zhen, Ming-Hua; Ng, Seik Weng","2-(4-Pyridyl)-1<i>H</i>-benzimidazole trihydrate","Acta Crystallographica Section E","2004","60","6","o939","o940","10.1107/S1600536804010244","","","0.71073","MoKα","","0.08","0.05","","","0.124","0.142","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203836","13.2528","0.0009","13.6796","0.0009","29.358","0.002","90","","92.43","0.001","90","","5317.6","0.6","181","2","181","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Aquabis(tetrahydrofuran)hexakis(trichloroacetato)copper(II)diiron(III) hexane solvate","","- C26 H32 Cl18 Cu Fe2 O16 -","- C26 H32 Cl18 Cu Fe2 O16 -","- C104 H128 Cl72 Cu4 Fe8 O64 -","4","1","WW6199","Ng, Seik Weng","Aquabis(tetrahydrofuran)hexakis(trichloroacetato)copper(II)diiron(III) hexane solvate","Acta Crystallographica Section E","2004","60","6","m738","m740","10.1107/S1600536804010232","","","0.71073","MoKα","","0.129","0.067","","","0.126","0.151","","","","","","1.1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203837","8.998","0.002","11.741","0.002","15.836","0.003","102.28","0.03","106.11","0.03","90.14","0.03","1567.2","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Hexa(imidazole)nickel(II) benzene-1,3-dioxyacetate","hexakis(1H-imidazole-κN^3^)nickel(II) (m-phenylenedioxy)diacetate","","- C28 H32 N12 Ni O6 -","- C28 H32 N12 Ni O6 -","- C56 H64 N24 Ni2 O12 -","2","1","WW6205","Gao, Shan; Liu, Ji-Wei; Dong, Yu; Huo, Li-Hua; Zhao, Hui","Hexakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)nickel(II) benzene-1,3-dioxyacetate","Acta Crystallographica Section E","2004","60","6","m778","m780","10.1107/S1600536804011328","","","0.71073","MoKα","","0.072","0.044","","","0.105","0.118","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203838","16.564","0.006","6.3","0.002","14.597","0.006","90","","109.73","0.02","90","","1433.8","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaquadiformatodipyridinecobalt(II)","","- C12 H16 Co N2 O6 -","- C12 H16 Co N2 O6 -","- C48 H64 Co4 N8 O24 -","4","0.5","WW6206","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui","Diaquadiformatodipyridinecobalt(II)","Acta Crystallographica Section E","2004","60","6","m808","m810","10.1107/S1600536804011572","","","0.71073","MoKα","","0.048","0.045","","","0.124","0.128","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203839","14.842","0.003","14.166","0.003","7.721","0.002","90","","96.23","0.03","90","","1613.8","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaqua(nitrato-κ^2^O,O')bis(4-pyridone-κO)cobalt(II) nitrate","","- C10 H14 Co N4 O10 -","- C10 H14 Co N4 O10 -","- C40 H56 Co4 N16 O40 -","4","0.5","WW6207","Gao, Shan; Lu, Zhen-Zhong; Huo, Li-Hua; Zhao, Hui; Zhao, Jing-Gui","Diaqua(nitrato-κ^2^<i>O,O</i>')bis(4-pyridone-κ<i>O</i>)cobalt(II) nitrate","Acta Crystallographica Section E","2004","60","6","m811","m813","10.1107/S1600536804011584","","","0.71073","MoKα","","0.034","0.031","","","0.082","0.083","","","","","","1.08","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203840","6.134","0.001","26.02","0.005","12.028","0.002","90","","102.64","0.03","90","","1873.2","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Hexaaquamagnesium(II) benzene-1,3-dioxyacetate trihydrate","","- C10 H26 Mg O15 -","- C10 H26 Mg O15 -","- C40 H104 Mg4 O60 -","4","1","WW6210","Gao, Shan; Huo, Li-Hua; Dong, Yu; Liu, Ji-Wei; Zhao, Hui","Hexaaquamagnesium(II) benzene-1,3-dioxyacetate trihydrate","Acta Crystallographica Section E","2004","60","6","m845","m847","10.1107/S1600536804012176","","","0.71073","MoKα","","0.05","0.039","","","0.092","0.097","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203841","8.425","0.004","11.357","0.002","11.489","0.002","104.56","0.02","80.66","0.02","95.19","0.03","1048.5","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3,6-Diethyl-N,N'-bis(3-methylphenyl)-1,6-dihydro-1,2,4,5-tetrazine- 1,4-dicarboxyamide","","- C22 H26 N6 O2 -","- C22 H26 N6 O2 -","- C44 H52 N12 O4 -","2","1","WW6211","Shi, Hai-Bo; Hu, Wei-Xiao; Rao, Guo-Wu","3,6-Diethyl-<i>N,N</i>'-bis(3-methylphenyl)-1,6-dihydro-1,2,4,5-tetrazine-1,4-dicarboxamide","Acta Crystallographica Section E","2004","60","6","o1065","o1066","10.1107/S1600536804012103","","","0.71073","MoKα","","0.06","0.035","","","0.0962","0.1101","","","","","","1.029","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203842","6.9831","0.0017","10.235","0.003","11.931","0.003","82.783","0.011","79.961","0.011","85.934","0.012","832","0.4","193","2","193","2","","","","","","","","6","P -1","-P 1","2","Enoxacin hydroiodide","","","- C15 H18 F I N4 O3 -","- C15 H18 F I N4 O3 -","- C30 H36 F2 I2 N8 O6 -","2","1","YA6206","Liang-Cai Yu; Hong Liang; Chun-Shan Zhou; Zhen-Feng Chen; Yong Zhang","Enoxacin hydroiodide","Acta Crystallographica Section E","2004","60","6","o1051","o1053","10.1107/S1600536804011948","","","0.7107","MoKα","","0.053","0.042","","","0.075","0.078","","","","","","1.18","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203843","10.3779","0.0012","10.3151","0.0011","15.2789","0.0013","90","","105.116","0.004","90","","1579","0.3","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H19 N O2 -","- C19 H19 N O2 -","- C76 H76 N4 O8 -","4","1","AC6098","Arıcı, Cengiz; Ülkü, Dinçer; Kırılmış, Cumhur; Koca, Murat; Ahmedzade, Misir","1-(3-Amino-1-benzofuran-2-yl)-2-mesitylethanone","Acta Crystallographica Section E","2004","60","7","o1211","o1212","10.1107/S160053680401428X","","","0.71073","MoKα","","","0.054","","","","0.132","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203844","8.9714","0.0002","8.615","0.0002","26.4673","0.0007","90","","99.155","0.002","90","","2019.56","0.08","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-[1-(Decahydronaphthalen-1-yl)piperidin-4-yl]indolin-2-one","","- C23 H32 N2 O -","- C23 H32 N2 O -","- C92 H128 N8 O4 -","4","1","AC6104","Parrish, Damon A.; Deschamps, Jeffrey R.; Jiang, Faming; Zaveri, Nurulain T.","1-[1-(Decahydronaphthalen-1-yl)piperidin-4-yl]indolin-2-one: one of a novel series of nociceptin receptor ligands:","Acta Crystallographica Section E","2004","60","7","o1253","o1254","10.1107/S1600536804013297","","","1.54178","CuKα","","0.0775","0.0544","","","0.1449","0.1623","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203845","10.5773","0.0013","17.629","0.003","8.0759","0.0009","90.228","0.011","102.521","0.01","81.179","0.011","1452","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H38 B Li N10 -","- C25 H38 B Li N10 -","- C50 H76 B2 Li2 N20 -","2","1","AC6105","Lisette Hernández; Soraya Taboada; Lindora D'Ornelas; Teresa González; Reinaldo Atencio","(3,5-Dimethylpyrazole)[hydridotris(3,5-dimethylpyrazol-1-yl)borate]lithium 3,5-dimethylpyrazole solvate","Acta Crystallographica Section E","2004","60","7","m979","m981","10.1107/S1600536804014126","","","0.71073","MoKα","","0.0994","0.064","","","0.1763","0.2133","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203846","6.817","0.001","6.817","0.001","19.242","0.003","90","","90","","90","","894.2","0.2","293","2","293","2","","","","","","","","4","I -4 2 d","I -4 2bw","122","Na Mg4 (As O4)3","Sodium tetramagnesium tris(arsenate)","","- As3 Mg4 Na O12 -","- As3 Mg4 Na O12 -","- As12 Mg16 Na4 O48 -","4","0.25","BR6150","Anissa, Haj Abdallah; Brahim, Ayed; Amor, Haddad","NaMg~4~(AsO~4~)~3~","Acta Crystallographica, Section E","2004","60","7","i77","i79","10.1107/S1600536804012772","","","0.71073","MoKα","","0.0206","0.0181","","","0.0444","0.045","","","","","","1.097","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2203847","16.6884","0.0007","10.9585","0.0005","22.0082","0.0009","90","","90","","90","","4024.9","0.3","273","2","273","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","catena-Poly[[[(2,2'-bipyridine)copper(II)]-μ-terephthalato] N,N-dimethylformamide solvate]","","- C21 H19 Cu N3 O5 -","- C21 H19 Cu N3 O5 -","- C168 H152 Cu8 N24 O40 -","8","1","BR6151","Xin-Hua, Li; Hong-Ping, Xiao","<i>catena</i>-Poly[[[(2,2'-bipyridine)copper(II)]-μ-terephthalato] <i>N</i>,<i>N</i>-dimethylformamide solvate]","Acta Crystallographica Section E","2004","60","7","m898","m900","10.1107/S1600536804012784","","","0.71073","MoKα","","0.06","0.0516","","","0.1276","0.1332","","","","","","1.096","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203848","14.251","0.005","9.984","0.003","8.994","0.003","90","","105.305","0.005","90","","1234.3","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3-Hydroxy-3-(3-hydroxyphenyl)-1-phenylpropan-1-one","","- C15 H14 O3 -","- C15 H14 O3 -","- C60 H56 O12 -","4","1","BT6430","Zhifang Yu; Jianwei Sun; Bing Zhao; Xiuyan Gu; Zhongzhen Tian","3-Hydroxy-3-(3-hydroxyphenyl)-1-phenylpropan-1-one","Acta Crystallographica Section E","2004","60","7","o1135","o1136","10.1107/S1600536804013261","","","0.71073","MoKα","","0.0923","0.0481","","","0.1161","0.1451","","","","","","0.994","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203849","9.328","0.003","13.393","0.003","15.694","0.004","76.951","0.004","75.162","0.004","72.894","0.004","1787.2","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2,7,12-Tris-(4-bromo-butoxy)-3,8,13-trimethoxy- 10,15-dihydro-5H-tribenzo[a,d,g]cyclononene","","- C36 H45 Br3 O6 -","- C36 H45 Br3 O6 -","- C72 H90 Br6 O12 -","2","1","BT6446","Hu, Qing-Ping; Ma, Ming-Liang; Zheng, Xiu-Fang; John, Reiner; Su, Lei","2,7,12-Tris(4-bromobutoxy)-3,8,13-trimethoxy-10,15-dihydro-5<i>H</i>-tribenzo[<i>a</i>,<i>d</i>,<i>g</i>]cyclononene","Acta Crystallographica Section E","2004","60","7","o1178","o1179","10.1107/S1600536804013273","","","0.71073","MoKα","","0.1194","0.058","","","0.1372","0.1633","","","","","","1.021","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203850","8.1693","0.0004","10.343","0.0005","10.6876","0.0005","67.371","0.001","73.176","0.001","86.825","0.001","796.25","0.07","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[aquanickel(II)]-di-μ-(4-pyridylsulfanyl)acetato]","","- C14 H14 N2 Ni O5 S2 -","- C14 H14 N2 Ni O5 S2 -","- C28 H28 N4 Ni2 O10 S4 -","2","1","BT6463","Huang, Yong-Qing; Zhang, Hui; Chen, Jian-Gu; Zou, Wei; Ng, Seik Weng","<i>catena</i>-Poly[[aquanickel(II)]-di-μ-(4-pyridylsulfanyl)acetato-κ^6^<i>N</i>:<i>O,O</i>;<i>O,O</i>':<i>N</i>]","Acta Crystallographica Section E","2004","60","7","m933","m934","10.1107/S1600536804013340","","","0.71073","MoKα","","0.0378","0.0351","","","0.0931","0.0954","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203851","15.775","0.001","5.7314","0.0004","16.95","0.001","90","","97.726","0.001","90","","1518.59","0.17","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","Poly[[diaquanickel(II)]-μ-(4-pyridysulfanyl)acetato-nickel(II)-tri- μ-(4-pyridysulfanyl)acetato]","","- C28 H28 N4 Ni2 O10 S4 -","- C28 H28 N4 Ni2 O10 S4 -","- C56 H56 N8 Ni4 O20 S8 -","2","0.5","BT6464","Huang, Yong-Qing; Zhang, Hui; Chen, Jian-Gu; Zou, Wei; Ng, Seik Weng","Poly[[diaquanickel(II)]-μ-(4-pyridysulfanyl)acetato-nickel(II)-tri-μ-(4-pyridysulfanyl)acetato]","Acta Crystallographica Section E","2004","60","7","m935","m936","10.1107/S1600536804013352","","","0.71073","MoKα","","0.056","0.048","","","0.118","0.123","","","","","","1.13","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203852","10.32","0.001","10.441","0.001","11.793","0.001","98.878","0.001","90.545","0.002","107.244","0.001","1196.99","0.19","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","3-(1,10-Phenanthrolin-2-yl)-5,6-diphenyl-as-triazinedichlorocopper(II)","","- C27 H17 Cl2 Cu N5 -","- C27 H17 Cl2 Cu N5 -","- C54 H34 Cl4 Cu2 N10 -","2","1","BT6465","Ng, Seik Weng","Rerefinement of dichloro[3-(1,10-phenanthrolin-2-yl)-5,6-diphenyl-1,2,4-triazine]copper(II) as an anhydrous structure","Acta Crystallographica Section E","2004","60","7","m937","m938","10.1107/S1600536804013509","","","0.71073","MoKα","","0.092","0.05","","","0.117","0.136","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203853","8.912","0.001","20.769","0.003","10.608","0.001","90","","79.605","0.002","90","","1931.2","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-Methyl-2-phenyl-4-[(Z)-(benzylaminophenylmethylene]-2H-pyrazol-3-one","","- C24 H21 N3 O -","- C24 H21 N3 O -","- C96 H84 N12 O4 -","4","1","BT6466","Jiang, Ji-Jun; Lü, Xing-Qiang; Bao, Feng; Kang, Bei-Sheng; Ng, Seik Weng","4-[(<i>Z</i>)-(Benzylamino)phenylmethylene]-5-methyl-2-phenyl-2<i>H</i>-pyrazol-3-one","Acta Crystallographica Section E","2004","60","7","o1149","o1150","10.1107/S1600536804013479","","","0.71073","MoKα","","0.0936","0.0435","","","0.1069","0.1345","","","","","","0.988","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203854","12.479","0.002","12.611","0.002","12.597","0.002","90","","95.963","0.002","90","","1971.7","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(2-Methylpyrazine)trifluoroacetatosilver(I)","","- C7 H6 Ag F3 N2 O2 -","- C7 H6 Ag F3 N2 O2 -","- C56 H48 Ag8 F24 N16 O16 -","8","2","BT6467","Zhu, Hai-Liang; Ng, Seik Weng","μ-2-Methylpyrazine-μ-trifluoroacetato-silver(I)","Acta Crystallographica Section E","2004","60","7","m939","m940","10.1107/S1600536804013510","","","0.71073","MoKα","","0.075","0.055","","","0.157","0.18","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203855","24.991","0.001","7.3516","0.0004","20.958","0.001","90","","94.679","0.001","90","","3837.7","0.3","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Diaqua(1,10-Phenanthroline)[3-phosphonopropionato(2-)]zinc(II) dihydrate","","- C15 H21 N2 O9 P Zn -","- C15 H21 N2 O9 P Zn -","- C120 H168 N16 O72 P8 Zn8 -","8","1","BT6468","Zhang, Xian-Ming; Fang, Rui-Qin; Wu, Hai-Shun; Ng, Seik Weng","Zwitterionic diaqua(1,10-phenanthroline)[3-phosphonopropionato(2‒)]zinc(II) dihydrate","Acta Crystallographica Section E","2004","60","7","m941","m942","10.1107/S1600536804013522","","","0.71073","MoKα","","0.0458","0.04","","","0.1158","0.1203","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203856","6.4402","0.0009","18.455","0.003","10.279","0.0014","90","","96.901","0.003","90","","1212.8","0.3","160","2","160","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(E)-2-[2-(4-methylphenyl)ethenyl]-1,3,2-benzodioxaborole","","- C15 H13 B O2 -","- C15 H13 B O2 -","- C60 H52 B4 O8 -","4","1","BT6469","Clegg, William; Scott, Andrew J.; Wiesauer, Christian; Weissensteiner, Walter; Marder, Todd B.","(<i>E</i>)-2-[2-(4-Methylphenyl)ethenyl]-1,3,2-benzodioxaborole","Acta Crystallographica Section E","2004","60","7","o1172","o1174","10.1107/S1600536804014011","","","0.71073","MoKα","","0.0474","0.0423","","","0.1035","0.1077","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203857","6.757","0.004","7.768","0.004","12.578","0.007","93.581","0.012","98.6","0.016","91.084","0.015","651.2","0.6","160","2","160","2","","","","","","","","5","P -1","-P 1","2","","(E)-2-[2-(4-trifluoromethylphenyl)ethenyl]-1,3,2-benzodioxaborole","","- C15 H10 B F3 O2 -","- C15 H10 B F3 O2 -","- C30 H20 B2 F6 O4 -","2","1","BT6470","Clegg, William; Scott, Andrew J.; Wiesauer, Christian; Weissensteiner, Walter; Marder, Todd B.","(<i>E</i>)-2-{2-[4-(Trifluoromethyl)phenyl]ethenyl}-1,3,2-benzodioxaborole","Acta Crystallographica Section E","2004","60","7","o1175","o1177","10.1107/S1600536804014023","","","0.71073","MoKα","","0.1177","0.0905","","","0.2562","0.2792","","","","","","1.018","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203858","25.939","0.004","13.938","0.003","22.685","0.004","90","","114.05","0.004","90","","7490","2","160","2","160","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C56 H100 Au Cl13 P4 -","- C56 H100 Au Cl13 P4 -","- C224 H400 Au4 Cl52 P16 -","4","0.5","BT6471","Clegg, William; Scott, Andrew J.; Wiesauer, Christian; Weissensteiner, Walter; Marder, Todd B.","Bis[bis(dicyclohexylphosphino)ethane-κ^2^<i>P,P</i>']gold(I) chloride chloroform tetrasolvate","Acta Crystallographica Section E","2004","60","7","m968","m970","10.1107/S1600536804014187","","","0.71073","MoKα","","0.1044","0.0821","","","0.2017","0.2227","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203859","5.459","0.003","8.011","0.003","17.205","0.005","90","","96","0.03","90","","748.3","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H15 N O5 -","- C16 H15 N O5 -","- C32 H30 N2 O10 -","2","1","BT6472","Anand, Naveen; Koul, Surrinder; Taneja, Subhash C.; Qazi, Ghulam N.; Spiteller, Michael; Sheldrick, William S.; van Almsick, Tobias","(3<i>R</i>,4<i>S</i>)-<i>cis</i>-3-Acetoxy-1-(4-methoxyphenyl)-4-(2-furanyl)azetidin-2-one","Acta Crystallographica Section E","2004","60","7","o1215","o1216","10.1107/S1600536804014540","","","0.71073","MoKα","","0.0446","0.0369","","","0.1001","0.1046","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203860","20.355","0.002","6.5407","0.0004","9.7669","0.0011","90","","98.314","0.013","90","","1286.7","0.2","170","2","170","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Copper(I)chloride-bis(piperidine)","","","- C10 H22 Cl Cu N2 -","- C10 H22 Cl Cu N2 -","- C40 H88 Cl4 Cu4 N8 -","4","1","BT6473","Näther, Christian; Beck, Andreas","Chlorobis(piperidine-κ<i>N</i>)copper(I)","Acta Crystallographica Section E","2004","60","7","m1008","m1009","10.1107/S1600536804015223","","","0.71073","MoKα","","0.0487","0.0343","","","0.0834","0.0894","","","","","","0.974","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203861","6.0986","0.0014","9.893","0.0017","13.424","0.002","78.11","0.15","79.217","0.016","78.599","0.014","767.8","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","8-aminoquinolinium 4-toluenesulfonate","","","- C16 H16 N2 O3 S -","- C16 H16 N2 O3 S -","- C32 H32 N4 O6 S2 -","2","1","BT6474","Graham Smith; Urs D. Wermuth; Peter C. Healy","Quinolin-8-aminium toluene-4-sulfonate","Acta Crystallographica Section E","2004","60","7","o1257","o1259","10.1107/S1600536804014898","","","0.71069","MoKα","","0.0552","0.0415","","","0.1052","0.1241","","","","","","0.832","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203862","10.825","0.001","17.316","0.001","14.428","0.001","90","","109.907","0.001","90","","2542.9","0.3","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[[[μ-sulfato-dicopper(I)]-di-μ-4,4'-bipyridine- 1:1'κ^2^N,N';2:2'κ^2^N,N'] tetrahydrate]","","- C20 H24 Cu2 N4 O8 S -","- C20 H16 Cu2 N4 O8 S -","- C80 H64 Cu8 N16 O32 S4 -","4","0.5","BT6475","Zhang, Xian-Ming; Fang, Rui-Qin; Wu, Hai-Shun; Ng, Seik Weng","<i>catena</i>-Poly[[[μ-sulfato-dicopper(I)]-di-μ-4,4'-bipyridine-1:1'κ^2^<i>N,N</i>';2:2'κ^2^<i>N,N</i>'] tetrahydrate]","Acta Crystallographica Section E","2004","60","7","m990","m992","10.1107/S1600536804014801","","","0.71073","MoKα","","0.098","0.066","","","0.193","0.221","","","","","","1.11","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203863","9.7","0.001","22.441","0.003","10.638","0.001","90","","94.583","0.003","90","","2308.3","0.4","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-[(Z)-(2-Fluorenylamino)phenylmethylene]-5-methyl-2-phenyl-2H-pyrazol-3(4H)-one","","- C30 H23 N3 O -","- C30 H23 N3 O -","- C120 H92 N12 O4 -","4","1","BT6476","Bao, Feng; Lü, Xing-Qiang; Wu, Qing; Ng, Seik Weng","4-[(<i>Z</i>)-(2-Fluorenylamino)phenylmethylene]-5-methyl-2-phenyl-2<i>H</i>-pyrazol-3(4<i>H</i>)-one","Acta Crystallographica Section E","2004","60","7","o1244","o1245","10.1107/S1600536804014795","","","0.71073","MoKα","","0.0941","0.0422","","","0.0946","0.116","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203864","8.0753","0.0008","13.698","0.001","14.054","0.001","90","","92.639","0.002","90","","1552.9","0.2","167.2","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C20 H12 Br2 -","- C20 H12 Br2 -","- C80 H48 Br8 -","4","1","CF6346","Rebecca J. Abergel; Mircea Dinca","9,10-Dibromotriptycene","Acta Crystallographica Section E","2004","60","7","o1248","o1249","10.1107/S1600536804013753","","","0.7107","MoKα","","","0.0416","","","","0.0537","","","","","","2.081","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203865","10.9448","0.0002","15.1406","0.0002","15.6896","0.0003","90","","99.1231","0.0009","90","","2567.05","0.08","150","","150","","","","","","","","","4","P 1 21 1","P 2yb","4","","N-[3-(dimethylamino)propyl]-N-(ethylcarbamoyl)-6-allyl ergoline-8β-carboxamide","","- C26 H37 N5 O2 -","- C26 H37 N5 O2 -","- C104 H148 N20 O8 -","4","2","CF6348","Bednář, Roman; Cvak, Ladislav; Čejka, Jan; Kratochvíl, Bohumil; Císařová, Ivana; Jegorov, Alexandr","Cabergoline, form VII","Acta Crystallographica Section E","2004","60","7","o1167","o1169","10.1107/S1600536804013777","","","0.71073","MoKα","","0.0461","0.0374","","0.0503","0.044","0.044","","","","","","1.1277","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2203866","17.644","0.004","8.165","0.002","12.922","0.003","90","","99.99","0.03","90","","1833.4","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[N,N'-Bis(2-oxidonaphthylmethylidene)ethane-1,2-diamine- κ^4^O,N,N',O']copper(II)","","- C24 H18 Cu N2 O2 -","- C24 H18 Cu N2 O2 -","- C96 H72 Cu4 N8 O8 -","4","1","CF6354","Li, Zong-Xiao; Zhang, Xin-Li","[<i>N,N</i>'-Bis(2-oxidonaphthylmethylidene)ethane-1,2-diamine-κ^4^<i>O,N,N</i>',<i>O</i>']copper(II)","Acta Crystallographica Section E","2004","60","7","m958","m959","10.1107/S1600536804013972","","","0.71073","MoKα","","0.086","0.0673","","","0.145","0.1546","","","","","","1.149","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203867","7.8757","0.001","9.108","0.0011","15.8434","0.0012","90","","100.853","0.009","90","","1116.1","0.2","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H14 N2 O2 S -","- C9 H14 N2 O2 S -","- C36 H56 N8 O8 S4 -","4","1","CF6356","Kennedy, Alan R.; Khalaf, Abedawn I.; Suckling, Colin J.; Waigh, Roger D.","Ethyl 2-amino-4-isopropyl-1,3-thiazole-5-carboxylate","Acta Crystallographica Section E","2004","60","7","o1188","o1190","10.1107/S1600536804013984","","","0.71069","MoKα","","0.0556","0.0377","","","0.0999","0.1094","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203868","12.5615","0.0004","10.9659","0.0004","17.2638","0.0005","90","","104.805","0.001","90","","2299.11","0.13","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H20 Cl3 O P -","- C26 H20 Cl3 O P -","- C104 H80 Cl12 O4 P4 -","4","1","CF6357","Zhang, Xingguo; Zhong, Ping; Hu, Mao-lin; Lin, Deqing; Lin, Jing","(2,4-Dichlorobenzoylmethyl)triphenylphosphonium chloride","Acta Crystallographica Section E","2004","60","7","o1200","o1201","10.1107/S1600536804013996","","","0.71073","MoKα","","0.0439","0.0386","","","0.0939","0.0973","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203869","9.6867","0.0019","9.7435","0.0019","10.723","0.002","116.9","0.03","100.35","0.03","99.36","0.03","852.9","0.4","293","2","","","","","","","","","","3","P -1","-P 1","2","","","","- C24 H18 O2 -","- C24 H18 O2 -","- C48 H36 O4 -","2","1","CF6359","Kang, Sung Kwon; Park, Kwanghee Koh; Kim, Wan Cheol; Kim, Sun-Hyuk","2,6-Dimethyl-3,7-diphenylbenzo[1,2-<i>b</i>:4,5-<i>b</i>']difuran","Acta Crystallographica Section E","2004","60","7","o1195","o1197","10.1107/S160053680401400X","","","0.71073","MoKα","","","0.0845","","","","0.2487","","","","","","0.98","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203870","11.6505","0.0005","10.4942","0.0005","19.4752","0.0009","90","","104.799","0.001","90","","2302.1","0.18","183","2","183","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,4-Diazabicyclo[2.2.2]octanium 3,5-dinitrobenzoate hydrate (1/2/1)","","- C20 H22 N6 O13 -","- C20 H22 N6 O13 -","- C80 H88 N24 O52 -","4","1","CI6387","Suchada Chantrapromma; Hoong-Kun Fun","1,4-Diazabicyclo[2.2.2]octanium bis(3,5-dinitrobenzoate) monohydrate","Acta Crystallographica Section E","2004","60","7","o1250","o1252","10.1107/S1600536804015077","","","0.71073","MoKα","","0.0905","0.0533","","","0.115","0.1276","","","","","","0.935","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203871","7.7746","0.0007","8.9911","0.0008","11.3884","0.001","71.226","0.001","86.229","0.001","86.914","0.001","751.64","0.12","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Aqua[2-(pyridin-2-ylmethyliminomethyl)phenolato]zinc(II) nitrate monohydrate","","- C13 H15 N3 O6 Zn -","- C13 H15 N3 O6 Zn -","- C26 H30 N6 O12 Zn2 -","2","1","CI6388","Li, Zong-Xiao; Zhang, Xin-Li","Aqua[2-(pyridin-2-ylmethyliminomethyl)phenolato]zinc(II) nitrate monohydrate","Acta Crystallographica Section E","2004","60","7","m1017","m1019","10.1107/S1600536804015405","","","0.71073","MoKα","","0.0538","0.0454","","","0.1253","0.1314","","","","","","1.068","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203872","7.6427","0.0005","12.738","0.0012","15.5045","0.0009","90","","90","","90","","1509.41","0.19","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-Ethyl-3-(2-phenylethyl)benzimidazole-2-selone","","- C17 H18 N2 Se -","- C17 H18 N2 Se -","- C68 H72 N8 Se4 -","4","1","CI6391","Mehmet Akkurt; Sema Öztürk; Hasan Küçükbay; Ersin Orhan; Orhan Büyükgüngör","1-Ethyl-3-(2-phenylethyl)benzimidazole-2-selone","Acta Crystallographica Section E","2004","60","7","o1263","o1265","10.1107/S1600536804014977","","","0.71073","MoKα","","0.0672","0.0423","","","0.086","0.097","","","","","","1.027","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203873","13.369","0.005","15.31","0.005","14.69","0.005","90","","90","","90","","3006.7","1.8","293","","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1-Ethyl-4-phenylethyl-1,4-dihydroquinoxaline-2,3-dione","","- C18 H18 N2 O2 -","- C18 H18 N2 O2 -","- C144 H144 N16 O16 -","8","1","CI6392","Mehmet Akkurt; Sema Öztürk; Hasan Küçükbay; Ersin Orhan; Orhan Büyükgüngör","1-Ethyl-4-phenylethyl-1,4-dihydroquinoxaline-2,3-dione","Acta Crystallographica Section E","2004","60","7","o1266","o1268","10.1107/S1600536804014989","","","0.71073","MoKα","","0.1576","0.0481","","","0.0685","0.089","","","","","","0.857","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203874","11.3829","0.0009","11.5359","0.0012","13.0358","0.001","90","","90","","90","","1711.8","0.3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C12 H28 Cu N4 O6 -","- C12 H28 Cu N4 O6 -","- C48 H112 Cu4 N16 O24 -","4","0.5","CI6393","Uçar, İbrahim; Yeşilel, Okan Zafer; Bulut, Ahmet; Ölmez, Halis; Büyükgüngör, Orhan","Diaquabis(<i>N,N</i>-dimethylethylenediamine-κ^2^<i>N,N</i>')copper(II) squarate","Acta Crystallographica Section E","2004","60","7","m1025","m1027","10.1107/S1600536804015338","","","0.71073","MoKα","","0.0578","0.031","","","0.0782","0.0834","","","","","","0.867","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203875","14.807","0.003","9.7061","0.0018","20.218","0.004","90","","98.589","0.003","90","","2873.1","1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Diacetato(5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradeca-1,8- diene)cobalt(III) triiodide","","- C20 H38 Co I3 N4 O4 -","- C20 H38 Co I3 N4 O4 -","- C80 H152 Co4 I12 N16 O16 -","4","1","CV6312","Shu-Sheng Zhang; Shu-Yan Niu; Gui-Fen Jie; Xue-Mei Li; Kui Jiao","Diacetato(5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradeca-1,8-diene)cobalt(III) triiodide","Acta Crystallographica Section E","2004","60","7","m966","m967","10.1107/S1600536804012899","","","0.71073","MoKα","","0.0366","0.0283","","","0.0676","0.0714","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203876","22.489","0.004","6.629","0.001","22.027","0.004","90","","96.3","0.03","90","","3263.9","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H28 Cu2 F4 O10 -","- C32 H28 Cu2 F4 O10 -","- C128 H112 Cu8 F16 O40 -","4","0.5","CV6319","Hu, Ren-Zhi; Liu, Zhao-Di; Tan, Min-Yu; Zhu, Hai-Liang","Tetrakis(μ~2~-4-fluorobenzoato-κ^2^<i>O</i>:<i>O</i>')bis[(ethanol-κ<i>O</i>)copper(II)](<i>Cu{—</i>Cu})","Acta Crystallographica Section E","2004","60","7","m946","m947","10.1107/S1600536804013054","","","0.71073","MoKα","","0.0647","0.0463","","","0.096","0.1005","","","","","","1.032","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203877","8.8151","0.0009","10.6692","0.0011","10.905","0.0011","96.281","0.002","108.032","0.002","108.383","0.002","900.79","0.16","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","Methyl [8-(3,5-dimethylpyrazol-1-ylmethyl)-4-methyl-2-oxo-2H-chromen-7- yloxy]acetate 0.19-hydrate","","- C19 H20.38 N2 O5.19 -","- C19 H20.38 N2 O5.19 -","- C38 H40.76 N4 O10.38 -","2","1","CV6320","Thamotharan, S.; Parthasarathi, V.; Shinge, Prashant S.; Badami, Bharati; Ravikumar, K.","Methyl [8-(3,5-dimethylpyrazol-1-ylmethyl)-4-methyl-2-oxo-2<i>H</i>-chromen-7-yloxy]acetate 0.19-hydrate","Acta Crystallographica Section E","2004","60","7","o1213","o1214","10.1107/S1600536804014151","","","0.71073","MoKα","","0.0859","0.0591","","","0.1445","0.1614","","","","","","1.026","","","","has coordinates,has disorder,has Fobs","194389","2020-10-21","18:00:00",""
"2203878","13.3716","0.0007","13.0984","0.0008","14.6909","0.0012","90","","110.343","0.004","90","","2412.6","0.3","296","1","296","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","diphenylimidazole","4,5-diphenyl-1H-imidazole","","- C15 H12 N2 -","- C15 H12 N2 -","- C120 H96 N16 -","8","2","CV6323","Robert T. Stibrany; Harvey J. Schugar; Joseph A. Potenza","A second polymorph of 4,5-diphenyl-1<i>H</i>-imidazole","Acta Crystallographica Section E","2004","60","7","o1182","o1184","10.1107/S160053680401311X","","","0.71073","MoKα","","0.08","0.0626","","","0.172","0.1847","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203879","8.8281","0.001","8.8281","0.001","11.4206","0.001","90","","90","","90","","890.07","0.16","292","2","292","2","","","","","","","","5","P 42/m n m","-P 4n 2n","136","","bis(tetramethylammonium) tetrachloropalladate(II)","","- C8 H24 Cl4 N2 Pd -","- C8 H24 Cl4 N2 Pd -","- C16 H48 Cl8 N4 Pd2 -","2","0.125","CV6324","Fábry, Jan; Krupková, Radmila; Vaněk, Přemysl; Dušek, Michal; Němec, Ivan","Bis(tetramethylammonium) tetrachloropalladate(II)","Acta Crystallographica Section E","2004","60","7","m924","m926","10.1107/S1600536804013388","","","0.71069","MoKα","","0.0499","0.0221","","","0.0633","0.0747","","","","","","1.115","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203880","13.196","0.004","8.865","0.006","11.33","0.011","90","","90.77","0.06","90","","1325.3","1.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-ethoxy-1,2,3,4-tetrahydro-2,2,4-trimethylquinoline","","- C14 H21 N O -","- C14 H21 N O -","- C56 H84 N4 O4 -","4","1","CV6325","Rybakov, Victor B.; Alekseev, Nikolai V.; Sheludyakov, Vladimir D.; Ivanov, Yury A.; Frolov, Alexei Yu.; Aslanov, Leonid A.","6-Ethoxy-1,2,3,4-tetrahydro-2,2,4-trimethylquinoline","Acta Crystallographica Section E","2004","60","7","o1145","o1146","10.1107/S1600536804013121","","","1.5418","CuKα","","0.0809","0.053","","","0.1254","0.1425","","","","","","0.994","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203881","6.8881","0.0014","10.081","0.002","15.312","0.003","90","","91.68","0.03","90","","1062.8","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-[1,4-phenylenebis(oxy)]-bis[N-p-methylphenyl(acetamide)]","","- C24 H24 N2 O4 -","- C24 H24 N2 O4 -","- C48 H48 N4 O8 -","2","0.5","CV6327","Wen, Yong-Hong; Zhang, Shu-Sheng; Liang, Juan; Li, Xue-Mei","<i>N</i>,<i>N</i>'-Bis(<i>p</i>-methylphenyl)-2,2'-(<i>p</i>-phenylenedioxy)diacetamide","Acta Crystallographica Section E","2004","60","7","o1198","o1199","10.1107/S1600536804013923","","","0.71073","MoKα","","0.0723","0.0624","","","0.178","0.1947","","","","","","1.049","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203882","13.445","0.003","8.6747","0.0017","18.821","0.004","90","","98.04","0.03","90","","2173.5","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetrakis(μ-acetato-κ^2^O:O')bis[(4-pyridone-κO)copper(II)]","","- C18 H22 Cu2 N2 O10 -","- C18 H22 Cu2 N2 O10 -","- C72 H88 Cu8 N8 O40 -","4","0.5","CV6329","Lu, Zhen-Zhong; Gao, Shan; Huo, Li-Hua; Zhao, Hui; Zhao, Jing-Gui","Tetrakis(μ-acetato-κ^2^<i>O</i>:<i>O</i>')bis[(4-pyridone-κ<i>O</i>)copper(II)]","Acta Crystallographica Section E","2004","60","7","m976","m978","10.1107/S1600536804014278","","","0.71073","MoKα","","0.032","0.028","","","0.076","0.079","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203883","16.019","0.0011","7.057","0.0005","8.7203","0.0006","90","","91.536","0.001","90","","985.44","0.12","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","ethylene diammonium dineptunium decafluoride","","","- C2 H10 F10 N2 Np2 -","- C2 H10 F10 N2 Np2 -","- C8 H40 F40 N8 Np8 -","4","0.5","CV6331","Sullens, Tyler A.; Almond, Philip M.; Albrecht-Schmitt, T. E.","Ethylenediammonium decafluorodineptunate(IV)","Acta Crystallographica Section E","2004","60","7","m973","m975","10.1107/S1600536804014217","","","0.71073","MoKα","","0.0157","0.0144","","","0.0327","0.0331","","","","","","1.151","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2203884","12.367","0.004","13.192","0.004","22.682","0.007","90","","100.905","0.003","90","","3634","2","130.15","","130.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetrakis(μ-α-naphthylacetato-κ^2^O:O')bis[(dimethyl sulfoxide-κO)copper(II)]‒α-naphthylacetic acid‒dimethyl sulfoxide (1/2/2)","","- C80 H80 Cu2 O16 S4 -","- C80 H80 Cu2 O16 S4 -","- C160 H160 Cu4 O32 S8 -","2","0.5","CV6332","Lan-Fen Chen; Jie Zhang; Li-Jun Song; Wen-Guo Wang; Zhan-Feng Ju","Tetrakis(μ-α-naphthylacetato-κ^2^<i>O</i>:<i>O</i>')bis[(dimethyl sulfoxide-κ<i>O</i>)copper(II)]‒α-naphthylacetic acid‒dimethyl sulfoxide (1/2/2)","Acta Crystallographica Section E","2004","60","7","m1032","m1034","10.1107/S1600536804015284","","","0.71073","MoKα","","0.0863","0.0703","","","0.129","0.1357","","","","","","1.184","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203885","14.693","0.004","9.221","0.003","16.515","0.005","90","","90","","90","","2237.5","1.2","293","2","293","2","","","","","","","","6","P c a 21","P 2c -2ac","29","(cis-Cyclohexano-18-crown-6)potassium chlorochromate","(cis-hexadecahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecin)potassium chlorochromate","","- C16 H30 Cl Cr K O9 -","- C16 H30 Cl Cr K O9 -","- C64 H120 Cl4 Cr4 K4 O36 -","4","1","CV6334","Kotlyar, Sergey A.; Zubatyuk, Roman I.; Shishkin, Oleg V.; Chuprin, Gennady N.; Kiriyak, Andrey V.; Kamalov, Gerbert L.","(<i>cis</i>-Cyclohexano-18-crown-6)potassium chlorochromate(VI)","Acta Crystallographica Section E","2004","60","7","m1015","m1016","10.1107/S1600536804015132","","","0.71073","MoKα","","0.0789","0.035","","","0.0771","0.0839","","","","","","0.935","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203886","7.065","0.001","8.4842","0.001","8.6617","0.0009","98.471","0.007","112.685","0.004","103.098","0.004","450.37","0.1","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H18 N4 Ni O6 -","- C18 H18 N4 Ni O6 -","- C18 H18 N4 Ni O6 -","1","0.5","CV6335","Yu Liu; Duan-Jun Xu","<i>catena</i>-Poly[[diaquabis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)nickel(II)]-μ-fumarato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2004","60","7","m1002","m1004","10.1107/S1600536804015144","","","0.71069","MoKα","","0.038","0.034","","","0.082","0.084","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203887","18.8282","0.0006","8.6541","0.0003","19.0766","0.0006","90","","95.583","0.001","90","","3093.62","0.18","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","N-{3-Cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl}acetamide","","- C13 H7 Cl2 F3 N4 O -","- C13 H7 Cl2 F3 N4 O -","- C104 H56 Cl16 F24 N32 O8 -","8","1","CV6336","Yang, Zhiping; Zhong, Ping; Guo, Shengrong","<i>N</i>-{3-Cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1<i>H</i>-pyrazol-5-yl}acetamide","Acta Crystallographica Section E","2004","60","7","o1277","o1278","10.1107/S1600536804015570","","","0.71073","MoKα","","0.0727","0.0639","","","0.1633","0.1703","","","","","","1.143","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203888","13.0087","0.0002","18.5644","0.0003","13.7312","0.0002","90","","102.117","0.001","90","","3242.19","0.09","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis[μ^2^-bis(diphenylphosphinoyl)methanido-κ^2^O:O']hexamethyldi-μ^3^-oxo- dialuminium(III) tetrahydrofuran disolvate","","- C64 H76 Al4 O8 P4 -","- C56 H60 Al4 O6 P4 -","- C112 H120 Al8 O12 P8 -","2","0.5","DN6136","Nassar, Roger; Noll, Bruce C.; Henderson, Kenneth W.","Bis[μ^2^-bis(diphenylphosphinoyl)methanido-κ^2^<i>O</i>:<i>O</i>']hexamethyldi-μ^3^-oxo-tetraaluminium(III) tetrahydrofuran disolvate","Acta Crystallographica Section E","2004","60","7","m1023","m1024","10.1107/S1600536804011523","","","0.71073","MoKα","","0.0757","0.0615","","","0.1657","0.1734","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203889","6.6778","0.0013","8.904","0.0017","11.876","0.002","90","","90","","90","","706.1","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","ethylenediammonium chromate","","- C2 H10 Cr N2 O4 -","- C2 H10 Cr N2 O4 -","- C8 H40 Cr4 N8 O16 -","4","1","DN6139","Chebbi, Hammouda; Driss, Ahmed","Chromate d'éthylènediammonium","Acta Crystallographica Section E","2004","60","7","m904","m906","10.1107/S1600536804012747","","","0.71073","MoKα","","0.0257","0.0225","","","0.0656","0.0673","","","","","","1.132","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203890","8.078","0.002","9.604","0.002","10.48","0.003","81.145","0.003","88.341","0.004","75.731","0.003","778.5","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-hydroxo-bis[aqua(1,10-phenanthroline-κ^2^N,N')copper(II)] dinitrate hexahydrate","","- C24 H34 Cu2 N6 O16 -","- C24 H34 Cu2 N6 O16 -","- C24 H34 Cu2 N6 O16 -","1","0.5","DN6140","Li-Ping, Lu; Qin, Shi-Dong; Yang, Pin; Zhu, Miao-Li","Di-μ-hydroxo-bis[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)] dinitrate hexahydrate","Acta Crystallographica Section E","2004","60","7","m950","m952","10.1107/S1600536804013145","","","0.71073","MoKα","","0.051","0.0448","","","0.1119","0.1153","","","","","","1.021","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203891","28.961","0.006","4.2874","0.0009","20.788","0.004","90","","96.53","0.03","90","","2564.4","0.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H14 F N6 Ni S4 -","- C22 H14 F N6 Ni S4 -","- C88 H56 F4 N24 Ni4 S16 -","4","0.5","DN6141","Hui Zhang; XiaoMing Ren; Jingli Xie; Yizhi Li; Qingjin Meng","1-(3-Fluorobenzyl)pyridinium bis(maleonitriledithiolato-κ^2^<i>S</i>,<i>S</i>')nickelate(III) acetonitrile solvate","Acta Crystallographica Section E","2004","60","7","m960","m962","10.1107/S1600536804014060","","","0.71073","MoKα","","0.0509","0.0444","","","0.1474","0.1494","","","","","","1.042","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2203892","5.8032","0.0003","21.161","0.001","10.6863","0.0005","90","","90.748","0.001","90","","1312.18","0.11","293","1","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H9 Br O2 S -","- C14 H9 Br O2 S -","- C56 H36 Br4 O8 S4 -","4","1","DN6143","Xiu-rong Hu; Jian-Ming Gu; Mao-Sheng Xu","2-(Benzenesulfonyl)-1-(4-bromophenyl)ethyne","Acta Crystallographica Section E","2004","60","7","o1224","o1225","10.1107/S160053680401462X","","","0.7107","MoKα","","","0.03","","","","0.069","","","","","","1.034","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203893","5.8501","0.0004","14.721","0.0009","15.2578","0.001","90","","90","","90","","1313.99","0.15","180","2","180","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","bis(2-{pyridyl-2-yl}ethyl)hydroxylamine","","- C14 H17 N3 O -","- C14 H17 N3 O -","- C56 H68 N12 O4 -","4","1","DN6145","Bjernemose, Jens K.; Bond, Andrew D.","<i>N</i>,<i>N</i>-Bis[2-(2-pyridyl)ethyl]hydroxylamine","Acta Crystallographica Section E","2004","60","7","o1143","o1144","10.1107/S1600536804013534","","","0.7107","MoKα","","0.0423","0.034","","","0.0853","0.0893","","","","","","1.064","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203894","8.764","0.012","12.087","0.014","21.07","0.04","97.48","0.09","93.12","0.1","91.89","0.1","2208","6","393","2","393","2","","","","","","","","4","P -1","-P 1","2","","2-[4-(Dimethylamino)phenyl]-4,5-diphenyl-1H-imidazole isopropyl alcohol solvate","","- C26 H29 N3 O -","- C26 H29 N3 O -","- C104 H116 N12 O4 -","4","2","DN6147","Martinez, Hassan; Puschmann, Horst; Howard, Judith A.K.; Acevedo, Jorge; Au-Alvarez, Oscar","2-[4-(Dimethylamino)phenyl]-4,5-diphenyl-1<i>H</i>-imidazole isopropanol solvate","Acta Crystallographica Section E","2004","60","7","o1229","o1230","10.1107/S1600536804014503","","","0.71073","MoKα","","0.0888","0.0468","","","0.1046","0.119","","","","","","0.853","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203895","4.9695","0.0005","13.4392","0.0012","19.2749","0.0018","90","","90.253","0.002","90","","1287.3","0.2","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","DL-histidine DL-tartrate","","","- C10 H15 N3 O8 -","- C10 H15 N3 O8 -","- C40 H60 N12 O32 -","4","1","DN6150","Johnson, M. N.; Feeder, N.","<small>DL</small>-Histidine <small>DL</small>-tartrate","Acta Crystallographica Section E","2004","60","7","o1273","o1274","10.1107/S1600536804015296","","","0.71073","MoKα","","0.0584","0.0435","","","0.1133","0.1184","","","","","","1.023","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203896","8.1065","0.0003","9.8767","0.0002","12.4936","0.0005","98.638","0.002","99.295","0.002","113.606","0.001","878.66","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Tetrapotassium bis(glycine)hexacosaoxooctamolybdenum(VI) hexahydrate","","- C4 H22 K4 Mo8 N2 O36 -","- C4 H10 K4 Mo8 N2 O36 -","- C4 H10 K4 Mo8 N2 O36 -","1","0.5","HB6046","Xiao-Yuan Wu; Jiu-Hui Liu; Quan-Zheng Zhang; Xiang He; Shu-Mei Chen; Can-Zhong Lu","A polyoxomolybdate coordinated by glycine ligands: K~4~[Mo~8~O~26~(NH~3~CH~2~COO)~2~]·6H~2~O","Acta Crystallographica Section E","2004","60","7","m921","m923","10.1107/S160053680401308X","","","0.71073","MoKα","","0.0476","0.0413","","","0.1053","0.1118","","","","","","1.052","","","","has coordinates,has Fobs","201211","2020-10-21","18:00:00",""
"2203897","11.84","0.0002","10.319","0.0002","16.5919","0.0004","90","","107.772","0.0009","90","","1930.41","0.07","150","","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H19 N2 O19 S3 U2 -","- C4 H19 N2 O19 S3 U2 -","- C16 H76 N8 O76 S12 U8 -","4","1","HB6048","Doran, Michael B.; Norquist, Alexander J.; Stuart, Clair L.; O'Hare, Dermot","(C~8~H~26~N~4~)~0.5~[(UO~2~)~2~(SO~4~)~3~(H~2~O)]·2H~2~O, an organically templated uranyl sulfate with a novel layer type","Acta Crystallographica Section E","2004","60","7","m996","m998","10.1107/S1600536804014941","","","0.71073","MoKα","","0.0356","0.0251","","0.0591","0.0552","0.0552","","","","","","0.9792","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203898","10.0007","0.0014","12.9573","0.0017","16.396","0.003","90","","96.872","0.011","90","","2109.4","0.6","100","3","100","3","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H22 B N O6 -","- C24 H22 B N O6 -","- C96 H88 B4 N4 O24 -","4","1","HB6050","R. Angharad Baber; Jonathan P. H. Charmant; Jonathan D. Moore; Nicholas C. Norman; A. Guy Orpen","4-Methylpyridinium bis(pyrocatecholato-κ^2^<i>O,O</i>')borate catechol solvate","Acta Crystallographica Section E","2004","60","7","o1140","o1142","10.1107/S1600536804013108","","","0.71073","MoKα","","0.0575","0.045","","","0.1034","0.1096","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203899","12.2498","0.0002","16.0805","0.0005","21.5391","0.0006","90","","96.944","0.002","90","","4211.71","0.19","100","1","100","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H38 B Mn N10 O2 -","- C48 H38 B Mn N10 O2 -","- C192 H152 B4 Mn4 N40 O8 -","4","1","HB6051","Huh, Seong; Youm, Kyong-Tae; Lough, Alan. J.","Aqua[η^1^-dihydrobis(1,2,4-triazolyl)borato](5,10,15,20-<i>meso</i>-tetraphenylporphyrinato-κ^4^<i>N</i>)manganese(III) monohydrate","Acta Crystallographica Section E","2004","60","7","m895","m897","10.1107/S1600536804012905","","","0.71073","MoKα","","0.0805","0.0441","","","0.0956","0.1049","","","","","","1.068","","","","has coordinates,has Fobs","209451","2020-10-21","18:00:00",""
"2203900","29.2584","0.0004","12.4252","0.0002","21.724","0.0003","90","","118.355","0.0005","90","","6950.05","0.18","150","","150","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","{(carbonyl)(acetonitrilo)(μ~2~-O)(P)(dibenzo-[d,f]-2,2,4,4-tetra-tert-butyl- [1,3,2]dioxa-phosphito)}-rhodium(I)-dimer ∼1.5 dichloromethane solvate","","- C62 H86 N2 O8 P2 Rh2 -","- C62 H86 N2 O8 P2 Rh2 -","- C248 H344 N8 O32 P8 Rh8 -","4","0.5","HB6056","Tooke, Duncan M.; Mills, Allison M.; Spek, Anthony L.; van der Vlugt, Jarl Ivar; Vogt, Dieter","Bis[μ-3,3',5,5'-tetra-<i>tert</i>-butylbiphenyl-2,2'-diyl phosphonato(1‒)]bis[(acetonitrile)carbonylrhodium(I)] dichloromethane sesquisolvate","Acta Crystallographica Section E","2004","60","7","m943","m945","10.1107/S1600536804013406","","","0.71073","MoKα","","0.0673","0.0434","","","0.0911","0.0981","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203901","13.4711","0.0005","10.2873","0.0004","19.2982","0.0006","90","","103.719","0.001","90","","2598.07","0.16","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H27 N7 Ni O6 -","- C25 H27 N7 Ni O6 -","- C100 H108 N28 Ni4 O24 -","4","1","HB6057","Jian-Rong Su; Kai-Liang Yin; Duan-Jun Xu","Tris(benzimidazole)(iminodiacetato)nickel(II) dihydrate","Acta Crystallographica Section E","2004","60","7","m1020","m1022","10.1107/S1600536804014035","","","0.71073","MoKα","","0.063","0.043","","","0.087","0.093","","","","","","1.077","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203902","10.8736","0.0002","10.0773","0.0002","11.7098","0.0003","90","","116.942","0.0009","90","","1143.86","0.04","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C25 H21 Cl Cu N2 O P -","- C25 H21 Cl Cu N2 O P -","- C50 H42 Cl2 Cu2 N4 O2 P2 -","2","1","HB6058","Qian-Yong Cao; Wen-Fu Fu","Chloro[(hydroxymethyl)diphenylphosphine-κ<i>P</i>](1,10-phenanthroline-κ^2^<i>N,N</i>')copper(I)","Acta Crystallographica Section E","2004","60","7","m987","m989","10.1107/S1600536804014771","","","0.71073","MoKα","","0.0472","0.0313","","","0.0675","0.0723","","","","","","0.966","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203903","10.9714","0.0009","7.7711","0.0008","14.3786","0.0011","90","","101.464","0.004","90","","1201.46","0.18","298","1","298","1","","","","","","","","3","P 1 21 1","P 2yb","4","","(25R)-1α,2α-epoxy-3α-hydroxy-5α-spirostan-6-one","","- C27 H40 O5 -","- C27 H40 O5 -","- C54 H80 O10 -","2","1","HG6053","Castro-Méndez, Albina; Bernès, Sylvain; Sandoval-Ramírez, Jesús","(25<i>R</i>)-1α,2α-Epoxy-3α-hydroxy-5α-spirostan-6-one","Acta Crystallographica Section E","2004","60","7","o1133","o1134","10.1107/S1600536804013467","","","0.71073","MoKα","","0.0678","0.0422","","","0.0947","0.1142","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203904","6.8847","0.0012","9.4841","0.0017","26.48","0.005","90","","90","","90","","1729","0.5","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(3aS,4S,5R,7aS,1'R,2a'S,6'S,6a'S)-5-(2',5'-dioxo-2a'-methyl-6', 6a'-epoxylperhydroinden-1'-yl)-3a,4-epoxy-5-hydroxy-7a-methyl- perhydro-1H-inden-1-one","","- C20 H24 O6 -","- C20 H24 O6 -","- C80 H96 O24 -","4","1","HG6055","Shi, Hai-Jian; Li, Yi-Zhi; Hu, Yue-Fei; Hu, Hong-Wen","(3a<i>S</i>,4<i>S</i>,5<i>R</i>,7a<i>S</i>,1'<i>R</i>,2a'<i>S</i>,6'<i>S</i>,6a'<i>S</i>)-5-(2',5'-Dioxo-2a'-methyl-6',6a'-epoxyperhydroinden-1'-yl)-3a,4-epoxy-5-hydroxy-7a-methylperhydro-1<i>H</i>-inden-1-one","Acta Crystallographica Section E","2004","60","7","o1275","o1276","10.1107/S1600536804014849","","","0.71073","MoKα","","0.0828","0.0596","","","0.1321","0.1411","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203905","5.3608","0.0011","25.62","0.005","11.554","0.002","90","","98.133","0.005","90","","1570.9","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-(4-n-Butyloxyphenyl)-2-(2-mercaptoethyl)-1,2,4-triazole-3-thione","","- C15 H18 N4 O S -","- C15 H18 N4 O S -","- C60 H72 N16 O4 S4 -","4","1","HG6056","Shi, Hai-Jian; Li, Yi-Zhi; Hu, Hong-Wen","5-(4-<i>n</i>-Butyloxyphenyl)-2-(2-mercaptoethyl)-1,2,4-triazole-3-thione","Acta Crystallographica Section E","2004","60","7","o1246","o1247","10.1107/S1600536804014722","","","0.71073","MoKα","","0.0689","0.0549","","","0.1366","0.1443","","","","","","0.931","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203906","9.6398","0.0003","11.5164","0.0004","17.1539","0.0005","90","","90","","90","","1904.35","0.1","293","2","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C22 H28 O5 -","- C22 H28 O5 -","- C88 H112 O20 -","4","1","HG6058","Rodrigues, Luciano Pereira; Rubinger, Mayura M. M.; Piló-Veloso, Dorila; Malta, Valéria Rodrigues dos Santos; Guilardi, Silvana","6α-Acetoxyvouacapan-7β,17β-lactone","Acta Crystallographica Section E","2004","60","7","o1208","o1210","10.1107/S1600536804014394","","","0.71073","MoKα","","","0.0466","","","","0.1167","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203907","8.4348","0.0015","13.635","0.002","13.842","0.002","90","","101.606","0.003","90","","1559.4","0.4","294","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H20 N O2 P -","- C16 H20 N O2 P -","- C64 H80 N4 O8 P4 -","4","1","HG6060","Bod, Henriëtte de; Williams, D. Bradley G.; Roodt, Andreas; Muller, Alfred","(<i>N,N</i>-Diethylamino)(2-hydroxyphenyl)phenylphosphine oxide","Acta Crystallographica Section E","2004","60","7","o1241","o1243","10.1107/S1600536804014850","","","0.71073","MoKα","","","0.0568","","","","0.1448","","","","","","1.037","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203908","7.0734","0.0016","9.2564","0.0016","15.704","0.004","90","","102.755","0.018","90","","1002.8","0.4","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Nitroso-2-phenylimidazo[1,2-a]pyrimidine","","- C12 H8 N4 O -","- C12 H8 N4 O -","- C48 H32 N16 O4 -","4","1","LH6216","Anaflous, Abderahmane; Benchat, Nour-Eddine; Ben-Hadda, Taibi; El Bali, Brahim; Bolte, Michael","3-Nitroso-2-phenylimidazo[1,2-<i>a</i>]pyrimidine","Acta Crystallographica Section E","2004","60","7","o1131","o1132","10.1107/S1600536804011699","","","0.71073","MoKα","","0.0981","0.0541","","","0.1265","0.1401","","","","","","0.875","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203909","7.087","0.001","21.023","0.002","10.019","0.001","90","","99.042","0.009","90","","1474.2","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H19 Cl N2 O2 -","- C13 H19 Cl N2 O2 -","- C52 H76 Cl4 N8 O8 -","4","1","LH6217","Ton, Quoc Cuong; Bolte, Michael","<i>N</i>-Benzoyl-<i>N</i>'-(1,1-dimethyl-3-oxobutyl)hydrazine hydrochloride","Acta Crystallographica Section E","2004","60","7","o1129","o1130","10.1107/S1600536804011778","","","0.71073","MoKα","","0.0434","0.0299","","","0.0716","0.0747","","","","","","0.954","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203910","6.549","0.005","8.091","0.006","11.354","0.008","78.79","0.06","79.7","0.06","73.76","0.06","561.6","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(benzylammonium) tetraaquabis(sulfato)cuprate(II)","","- C14 H28 Cu N2 O12 S2 -","- C14 H28 Cu N2 O12 S2 -","- C14 H28 Cu N2 O12 S2 -","1","0.5","LH6222","Rademeyer, Melanie","Bis(benzylammonium) tetraaquabis(sulfato)cuprate(II)","Acta Crystallographica Section E","2004","60","7","m993","m995","10.1107/S1600536804013303","","","0.71073","MoKα","","0.0373","0.0326","","","0.0878","0.0915","","","","","","1.068","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203911","18.1209","0.0013","19.8137","0.0014","25.2396","0.0017","90","","90","","90","","9062.1","1.1","198","2","198","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","5,11-bis(formyl)-25,26,27,28-tetra-benzoxycalix[4]arene","5,11-bis(formyl)-25,26,27,28-tetra-benzoxycalix[4]arene","","- C58 H48 O6 -","- C58 H48 O6 -","- C464 H384 O48 -","8","1","LH6225","Andreas Decken; Pierre D. Harvey; Jasmin Douville","5,17-Diformyl-25,26,27,28-tetrabenzyloxycalix[4]arene: functionalization of the upper rim of a calix[4]arene","Acta Crystallographica Section E","2004","60","7","o1170","o1171","10.1107/S1600536804013595","","","0.71073","MoKα","","0.1479","0.0527","","","0.1401","0.1603","","","","","","1.089","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203912","5.6991","0.0004","15.2962","0.001","8.7352","0.0008","90","","93.743","0.0016","90","","759.86","0.1","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H8 N2 S -","- C7 H8 N2 S -","- C28 H32 N8 S4 -","4","1","LH6227","Yi-Hong Shen; Duan-Jun Xu","Phenylthiourea","Acta Crystallographica Section E","2004","60","7","o1193","o1194","10.1107/S1600536804013947","","","0.71073","MoKα","","0.049","0.037","","","0.086","0.091","","","","","","1.062","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203913","5.2765","0.0006","6.2163","0.0008","38.109","0.004","90","","90","","90","","1250","0.3","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","tert-butyl N-[(1R,3S,4R)-3-hydroxy-4-(hydroxymethyl)cyclopentyl]carbamate","","- C11 H21 N O4 -","- C11 H21 N O4 -","- C44 H84 N4 O16 -","4","1","LH6229","Ober, Matthias; Marsch, Michael; Harms, Klaus; Carell, Thomas","A carbocyclic analogue of a protected β-<small>D</small>-2-deoxyribosylamine","Acta Crystallographica Section E","2004","60","7","o1191","o1192","10.1107/S1600536804013959","","","0.71073","MoKα","","0.0345","0.0308","","","0.0814","0.0826","","","","","","1.037","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203914","12.167","0.002","17.195","0.002","19.128","0.002","90","","107.64","0.002","90","","3813.6","0.9","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","trans-Bis{1-[3-(cyclohexylamino)propyliminomethyl]-2-naphtholato- κ^3^O,N,N'}cobalt(III) perchlorate","","- C40 H50 Cl Co N4 O6 -","- C40 H50 Cl Co N4 O6 -","- C160 H200 Cl4 Co4 N16 O24 -","4","1","LH6230","Li, Su-Yue; You, Zhong-Lu; Chen, Bo; Lin, Yong-Shan; Xiong, Zhong-Duo; Zhu, Hai-Liang","<i>trans</i>-Bis{1-[3-(cyclohexylamino)propyliminomethyl]-2-naphtholato-κ^3^<i>O,N,N</i>'}cobalt(III) perchlorate","Acta Crystallographica Section E","2004","60","7","m999","m1001","10.1107/S1600536804014990","","","0.71073","MoKα","","0.1493","0.1049","","","0.2074","0.231","","","","","","1.162","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203915","8.476","0.003","8.87","0.003","10.376","0.004","78.886","0.006","79.375","0.006","89.483","0.006","752.1","0.5","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","N-9H-Fluoren-9-ylidene-3,4-dimethyaniline","","- C21 H17 N -","- C21 H17 N -","- C42 H34 N2 -","2","1","LH6231","Glagovich, Neil M.; Reed, Elizabeth M.; Crundwell, Guy; Updegraff III, James B.; Zeller, Matthias; Hunter, Allen D.","<i>N</i>-9<i>H</i>-Fluoren-9-ylidene-3,4-dimethylaniline","Acta Crystallographica Section E","2004","60","7","o1269","o1270","10.1107/S1600536804015089","","","0.71073","MoKα","","0.0567","0.0543","","","0.1439","0.1467","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203916","18.436","0.008","6.551","0.003","24.274","0.01","90","","90","","90","","2932","2","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","Piperazinediium 3-nitrophthalate dihydrate","","- C12 H19 N3 O8 -","- C12 H19 N3 O8 -","- C96 H152 N24 O64 -","8","2","LH6232","Guo, Ming-Lin","Piperazinediium 3-nitrophthalate dihydrate","Acta Crystallographica Section E","2004","60","7","o1236","o1238","10.1107/S1600536804014692","","","0.71073","MoKα","","0.0808","0.0559","","","0.1431","0.1607","","","","","","1.043","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203917","7.0137","0.0002","10.3135","0.0004","11.5107","0.0005","107.02","0.005","91.224","0.004","100.854","0.008","779.33","0.06","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","10-(2-methylbenzylidene)anthrone","","- C22 H16 O -","- C22 H16 O -","- C44 H32 O2 -","2","1","LH6233","Guo-Wu Rao; Wei-Xiao Hu; Wei Zhou","10-(2-Methylbenzylidene)anthrone","Acta Crystallographica Section E","2004","60","7","o1234","o1235","10.1107/S1600536804014709","","","0.71073","MoKα","","0.081","0.0558","","","0.1478","0.171","","","","","","1.088","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203918","8.474","0.0011","10.277","0.0012","19.472","0.004","95.817","0.006","99.748","0.007","114.116","0.008","1497.7","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","Bis[2,3-bis(4-chlorophenyl)propenoato-κ^2^O,O']dimethyltin(IV)","Bis[2,3-bis(4-chlorophenyl)propenoato-κ^2^O,O']dimethyltin(IV)","","- C32 H24 Cl4 O4 Sn -","- C32 H24 Cl4 O4 Sn -","- C64 H48 Cl8 O8 Sn2 -","2","1","LH6234","Sadiq-ur-Rehman; Leung, Bonnie On-On; Ali, Saqib; Badshah, Amin; Parvez, Masood","Bis[2,3-bis(4-chlorophenyl)propenoato-κ^2^<i>O,O</i>']dimethyltin(IV)","Acta Crystallographica Section E","2004","60","7","m984","m986","10.1107/S1600536804014710","","","0.71073","MoKα","","0.045","0.032","","","0.07","0.075","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203919","10.873","0.001","11.785","0.001","18.116","0.001","90","","93.56","0.01","90","","2316.9","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","octasodium hexatungstoplatinate(IV) hexaicosahydrate","octasodium hexatungstoplatinate(IV) hexaicosahydrate","","- H52 Na8 O50 Pt W6 -","- Na8 O50 Pt W6 -","- Na16 O100 Pt2 W12 -","2","0.5","MG6028","Lee, Uk; Joo, Hea-Chung","Octasodium hexatungstoplatinate(IV) hexaicosahydrate, Na~8~[PtW~6~O~24~]·26H~2~O","Acta Crystallographica Section E","2004","60","7","i86","i88","10.1107/S1600536804014618","","","0.71069","MoKα","","0.0801","0.0512","","","0.0763","0.0816","","","","","","1.668","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203920","13.708","0.003","5.545","0.009","15.018","0.006","90","","109.94","0.02","90","","1073.1","1.8","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3-(4-Pyridyl)-5-(2-pyridyl)pyrazole","","- C13 H10 N4 -","- C13 H10 N4 -","- C52 H40 N16 -","4","1","NA6325","Churakov, Andrei V.; Kuz'mina, Lyudmila G.; Nuriev, Vyatcheslav N.; Vatsadze, Sergey Z.; Zyk, Nikolay V.","3-(4-Pyridyl)-5-(2-pyridyl)-1<i>H</i>-pyrazole","Acta Crystallographica Section E","2004","60","7","o1231","o1233","10.1107/S1600536804013625","","","0.71073","MoKα","","0.1388","0.054","","","0.1268","0.1525","","","","","","0.944","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203921","8.7388","0.0008","13.7957","0.0013","14.4499","0.0014","90","","105.62","0.002","90","","1677.7","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Azido[bis(2-oxidophenylmethyleneimino)propane-1,2-diamine(2-)]iron(III)","","- C17 H16 Fe N5 O2 -","- C17 H16 Fe N5 O2 -","- C68 H64 Fe4 N20 O8 -","4","1","NA6332","Liu, Zhao-Di; Tan, Min-Yu; Zhu, Hai-Liang","Azido[bis(2-oxidophenylmethyleneimino)propane-1,2-diamine(2‒)]iron(III)","Acta Crystallographica Section E","2004","60","7","m910","m911","10.1107/S1600536804013005","","","0.71073","MoKα","","0.1136","0.0718","","","0.1996","0.2253","","","","","","1.061","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203922","8.141","0.002","11.822","0.003","14.934","0.004","90","","90.217","0.005","90","","1437.3","0.6","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C12 H36 Cl2 N6 O6 Ru2 S6 -","- C12 H36 Cl2 N6 O6 Ru2 S6 -","- C24 H72 Cl4 N12 O12 Ru4 S12 -","2","0.5","NA6335","Li-Xia Bai; Wei Han; Wen-Zhen Wang; Xin Liu; Shi-Ping Yan; Dai-Zheng Liao","A new dinuclear ruthenium complex bridged by azide: [Ru~2~Cl~2~(μ-1,3-N~3~)~2~(Me~2~SO)~6~]","Acta Crystallographica Section E","2004","60","7","m953","m954","10.1107/S1600536804013686","","","0.71073","MoKα","","0.0485","0.0303","","","0.0602","0.0654","","","","","","1.005","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2203923","7.2956","0.0004","14.8719","0.0008","14.7849","0.0007","90","","95.171","0.001","90","","1597.62","0.14","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H17 Br O2 -","- C18 H17 Br O2 -","- C72 H68 Br4 O8 -","4","1","NA6336","Kirsop, Peter; Storey, John M. D.; Harrison, William T. A.","1-Allyloxy-2-bromo-3-(3-phenylallyloxy)benzene","Acta Crystallographica Section E","2004","60","7","o1147","o1148","10.1107/S1600536804013133","","","0.71073","MoKα","","0.0641","0.0407","","","0.1055","0.1113","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203924","9.3421","0.0014","6.6804","0.0011","17.297","0.006","90","","106.82","0.02","90","","1033.3","0.4","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-phenylimidocarbonimidic diamide hydrochloride","","- C8 H12 Cl N5 -","- C8 H12 Cl N5 -","- C32 H48 Cl4 N20 -","4","1","NA6338","Gustavo Portalone; Marcello Colapietro","Redetermination of phenylbiguanide hydrochloride","Acta Crystallographica Section E","2004","60","7","o1165","o1166","10.1107/S1600536804013807","","","0.71069","MoKα","","0.063","0.0626","","","0.1909","0.192","","","","","","1.137","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203925","8.0523","0.0016","10.17","0.002","17.116","0.005","90","","112.63","0.03","90","","1293.7","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[2-(1,3-dithiolane-2-ylidene)-1-phenyl-2-(1,2,4-triazol-1-yl)]ethanone","","- C13 H11 N3 O S2 -","- C13 H11 N3 O S2 -","- C52 H44 N12 O4 S8 -","4","1","NA6339","Jian, Fang-Fang; Xu, Liang-Zhong; Shi, Jian-Gang; Xiao, Hai-Lian","2-(1,3-Dithiolan-2-ylidene)-1-phenyl-2-(1,2,4-triazol-1-yl)ethanone","Acta Crystallographica Section E","2004","60","7","o1204","o1205","10.1107/S1600536804013601","","","0.71073","MoKα","","0.0945","0.0469","","","0.0824","0.1032","","","","","","1.086","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203926","7.6672","0.0006","8.3085","0.0007","14.696","0.0012","97.96","0.002","93.595","0.002","95.405","0.001","920.31","0.13","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","{4-Chloro-2'-[(3-methoxy-2- oxidophenyl)methylidene]benzohydrazido}(pyridine)copper(II)","","- C20 H16 Cl Cu N3 O3 -","- C20 H16 Cl Cu N3 O3 -","- C40 H32 Cl2 Cu2 N6 O6 -","2","1","NA6340","Ali, Hapipah; Khamis, Nur Ashikin; Basirun, W. Jefri; Yamin, Bohari M.","{4-Chloro-2'-[(3-methoxy-2-oxidophenyl)methylidene]benzohydrazido}(pyridine)copper(II)","Acta Crystallographica Section E","2004","60","7","m982","m983","10.1107/S1600536804014357","","","0.71073","MoKα","","0.027","0.026","","","0.075","0.076","","","","","","1.06","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2203927","14.376","0.006","20.576","0.008","11.383","0.004","90","","90.301","0.007","90","","3367","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C35 H31 Cd N3 O9 -","- C35 H31 Cd N3 O9 -","- C140 H124 Cd4 N12 O36 -","4","1","NA6341","Ren, Hua-Wei; Liu, Zhao-Di; Qu, Yang; Tan, Min-Yu; Zhu, Hai-Liang","Diaqua(2,2'-bipyridyl)(2,2'-dihydroxy-[1,1']-binaphthalene-3,3'-dicarboxylato)cadmium(II) <i>N,N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2004","60","7","m948","m949","10.1107/S1600536804013662","","","0.71073","MoKα","","0.1291","0.0485","","","0.073","0.0842","","","","","","0.957","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203928","9.3895","0.0019","9.6613","0.0019","10.929","0.002","111.53","0.03","100.46","0.03","102.08","0.03","864.7","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H15 F N4 O S -","- C19 H15 F N4 O S -","- C38 H30 F2 N8 O2 S2 -","2","1","NA6343","Liangzhong Xu; Chongyi Zhu; Guanping Yu; Fangfang Jian","1-(4-Fluorophenyl)-2-(3-phenylthiazolidin-2-ylidene)-2-(1<i>H</i>-1,2,4-triazol-1-yl)ethanone","Acta Crystallographica Section E","2004","60","7","o1180","o1181","10.1107/S1600536804013881","","","0.71073","MoKα","","0.1025","0.0733","","","0.1391","0.1521","","","","","","1.106","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203929","8.239","0.003","9.115","0.003","12.42","0.01","111.2","0.04","93.8","0.04","96.76","0.03","857.6","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-(4-Chlorophenacyl)-4-methyl-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin- 2(1H)-one","","- C20 H22 Cl N O2 -","- C20 H22 Cl N O2 -","- C40 H44 Cl2 N2 O4 -","2","1","NA6344","Dmitry V. Albov; Victor B. Rybakov; Eugene V. Babaev; Leonid A. Aslanov","1-(4-Chlorophenacyl)-4-methyl-5,6,7,8,9,10-hexahydrocycloocta[<i>b</i>]pyridin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2004","60","7","o1219","o1221","10.1107/S1600536804014163","","","0.71073","MoKα","","0.0835","0.0497","","","0.1221","0.1371","","","","","","1.054","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2203930","9.5667","0.0016","7.3784","0.0012","20.85","0.004","90","","95.34","0.01","90","","1465.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","N-(4-bromophenacyl) piridone","N-(4-Bromophenacyl)-4,6-dimethyl-2-oxo-1,2-dihydropyridine-2-carbonitrile","","- C16 H13 Br N2 O2 -","- C16 H13 Br N2 O2 -","- C64 H52 Br4 N8 O8 -","4","1","NA6345","Dmitry V. Albov; Eugenia I. Turubanova; Victor B. Rybakov; Eugene V. Babaev; Leonid A. Aslanov","<i>N</i>-(4-Bromophenacyl)-4,6-dimethyl-2-oxo-1,2-dihydropyridine-2-carbonitrile","Acta Crystallographica Section E","2004","60","7","o1222","o1223","10.1107/S1600536804014175","","","1.5418","CuKα","","0.0491","0.039","","","0.1013","0.1069","","","","","","1.029","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203931","9.5874","0.0005","9.4468","0.0005","19.408","0.0011","90","","94.293","0.001","90","","1752.86","0.16","223","2","223","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H48 N2 O4 P2 S4 Zn -","- C28 H48 N2 O4 P2 S4 Zn -","- C56 H96 N4 O8 P4 S8 Zn2 -","2","0.5","NG6035","Chian-Sing Lai; Sikai Liu; Tiekink, Edward R. T.","<i>catena</i>-Poly[[bis(<i>O,O</i>'-diisobutyldithiophosphato-κ^2^<i>S,S</i>')zinc(II)]-μ-1,2-bis(4-pyridyl)ethane-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2004","60","7","m1005","m1007","10.1107/S160053680401520X","","","0.71069","MoKα","","0.046","0.036","","","0.089","0.093","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203932","9.058","0.003","12.922","0.005","17.826","0.006","84.966","0.005","80.597","0.005","84.398","0.005","2043.1","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Diaquatris(nicotinato-κO)bis(1,10-phenanthroline-κ^2^N,N')praseodymium(III) trihydrate","","- C42 H38 N7 O11 Pr -","- C42 H38 N7 O11 Pr -","- C84 H76 N14 O22 Pr2 -","2","1","OB6368","Yue, Zheng-Yu; Jin, Hui-Jie; Yan, Peng-Fei; Gao, Po","Diaquatris(nicotinato-κ<i>O</i>)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')praseodymium(III) trihydrate","Acta Crystallographica Section E","2004","60","7","m890","m892","10.1107/S1600536804012711","","","0.71073","MoKα","","0.0435","0.0315","","","0.0612","0.0646","","","","","","1.026","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203933","12.472","0.007","17.6737","0.0013","17.0718","0.0012","90","","90","","90","","3763","2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","1-Ethyl-5-(4-methoxybenzoyl-4-(4-methoxyphenyl)pyrimidine-2(1H)-thione","","- C21 H20 N2 O3 S -","- C21 H20 N2 O3 S -","- C168 H160 N16 O24 S8 -","8","1","OB6369","Özçelik, Suzan; Dinçer, Muharrem; Yıldırım, İsmail; Akçamur Yunus","1-Ethyl-5-(4-methoxybenzoyl)-4-(4-methoxyphenyl)pyrimidine-2(1<i>H</i>)-thione","Acta Crystallographica Section E","2004","60","7","o1123","o1125","10.1107/S1600536804012413","","","0.71073","MoKα","","0.0971","0.0479","","","0.0881","0.0972","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203934","11.6648","0.0006","12.3882","0.0006","12.5333","0.0006","92.168","0.001","91.05","0.001","92.252","0.001","1808.09","0.15","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","N,N,N',N'-Tetrakis(2-pyridiniomethyl)-1,3-diaminopropane tetraperchlorate hydrate","","- C27 H36 Cl4 N6 O17 -","- C27 H36 Cl4 N6 O17 -","- C54 H72 Cl8 N12 O34 -","2","1","OB6371","Fujihara, Takashi; Saito, Miki; Nagasawa, Akira","<i>N,N,N</i>',<i>N</i>'-Tetrakis(2-pyridiniomethyl)-1,3-diaminopropane tetraperchlorate monohydrate","Acta Crystallographica Section E","2004","60","7","o1126","o1128","10.1107/S1600536804011961","","","0.71073","MoKα","","0.072","0.066","","","0.1775","0.1829","","","","","","1.062","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203935","8.331","0.002","8.997","0.002","9.341","0.002","105.851","0.004","108.501","0.004","94.671","0.004","627.8","0.2","297","2","297","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-chloro-bis[dichlorobis(acetonitrile)niobium] acetonitorile disolvate","","- C12 H18 Cl6 N6 Nb2 -","- C12 H18 Cl6 N6 Nb2 -","- C12 H18 Cl6 N6 Nb2 -","1","0.5","OB6374","Kakeya, Masaki; Fujihara, Takashi; Nagasawa, Akira","Di-μ-chloro-bis[diacetonitriledichloroniobium(III)] acetonitrile disolvate","Acta Crystallographica Section E","2004","60","7","m893","m894","10.1107/S1600536804012760","","","0.71073","MoKα","","0.07","0.0532","","","0.1272","0.1357","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203936","13.272","0.003","9.905","0.002","15.533","0.003","90","","90","","90","","2042","0.7","298","2","298","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C15 H21.6 K Ni O6.3 -","- C15 H21 K Ni O6.3 -","- C60 H84 K4 Ni4 O25.2 -","4","1","OB6375","Reinaldo Atencio; Julián Reyes; Karina Ramírez; Teresa González; Ysaias Alvarado","Potassium tris(acetylacetonato)nickelate(II) 0.3-hydrate","Acta Crystallographica Section E","2004","60","7","m915","m917","10.1107/S1600536804013017","","","0.71073","MoKα","","0.0322","0.0275","","","0.0759","0.0793","","","","","","1.058","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203937","7.6789","0.0009","10.2222","0.0011","11.3519","0.0013","102.368","0.009","103.812","0.01","101.113","0.009","816.81","0.17","296","1","296","1","","","","","","","","3","P 1","P 1","1","","(E)-(20S,25S)-20,23-Diacetyl-5β-furost-22-ene-3β,26-diyl diacetate","","- C35 H52 O7 -","- C35 H52 O7 -","- C35 H52 O7 -","1","1","OB6376","Meza-Reyes, Socorro; Montiel-Smith, Sara; Sandoval-Ramírez, Jesús; Bernès, Sylvain; Hernández-Linares, Guadalupe; Santillan, Rosa L.; Rincón, Susana","(<i>E</i>)-(20<i>S</i>,25<i>S</i>)-20,23-Diacetyl-5β-furost-22-ene-3β,26-diyl diacetate","Acta Crystallographica Section E","2004","60","7","o1137","o1139","10.1107/S1600536804013443","","","0.71073","MoKα","","0.0444","0.0409","","","0.1116","0.1158","","","","","","0.966","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203938","17.728","0.004","8.5045","0.0019","22.575","0.005","90","","105.925","0.004","90","","3273","1.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1-Ethyl-2-oxo-5-phenyl-1,6-dihydro-2H- oxazolo[4',5':5,6]pyrido[3,4-b]indole methanol hemisolvate","","- C20.5 H17 N3 O2.5 -","- C20.5 H17 N3 O2.5 -","- C164 H136 N24 O20 -","8","1","OB6377","Yu, Gang; Li, Yi-Zhi; Cao, Li-Ya; Zhang, Xiao-Mo; Wang, Kai; Hu, Hong-Wen","1-Ethyl-2-oxo-5-phenyl-1,6-dihydro-2<i>H</i>-oxazolo[4',5':5,6]pyrido[3,4-<i>b</i>]indole methanol hemisolvate","Acta Crystallographica Section E","2004","60","7","o1271","o1272","10.1107/S1600536804015193","","","0.71073","MoKα","","0.0665","0.0524","","","0.1398","0.1472","","","","","","1.063","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203939","10.001","0.003","11.929","0.003","9.544","0.003","90","","107.656","0.004","90","","1085","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-amino-2-methyl-5,6,7,8-tetrahydro-1-benzothieno[2,3-d]pyrimidin-4(3H)-one","","- C11 H13 N3 O S -","- C11 H13 N3 O S -","- C44 H52 N12 O4 S4 -","4","1","OB6381","Vasu; K. A. Nirmala; Deepak Chopra; S. Mohan; J. Saravanan","3-Amino-2-methyl-5,6,7,8-tetrahydro-1-benzothieno[2,3-<i>d</i>]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2004","60","7","o1239","o1240","10.1107/S1600536804014862","","","0.71073","MoKα","","0.1015","0.0897","","","0.2247","0.2342","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203940","9.268","0.003","9.985","0.003","11.193","0.004","100.386","0.005","92.652","0.005","106.543","0.005","971.4","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N-[(3-Methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4- ylidene)(phenyl)methyl]glycine ethyl ester","","- C21 H21 N3 O3 -","- C21 H21 N3 O3 -","- C42 H42 N6 O6 -","2","1","RN6015","Zhang, Xin; Zhu, Hualing; Xu, Haizhen; Dong, Mei","<i>N</i>-[(3-Methyl-5-oxo-1-phenyl-4,5-dihydro-1<i>H</i>-pyrazol-4-ylidene)(phenyl)methyl]glycine ethyl ester","Acta Crystallographica Section E","2004","60","7","o1157","o1158","10.1107/S1600536804013212","","","0.71073","MoKα","","0.0845","0.0498","","","0.1133","0.1309","","","","","","1.011","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203941","12.585","0.002","21.175","0.003","12.704","0.002","90","","90.211","0.003","90","","3385.4","0.9","273","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[1-(5-Chloro-2-oxidophenyl)ethanone 4-nitrobenzoylhydrazonato(2-)]tripyridinenickel(II) pyridine solvate","","- C35 H30 Cl N7 Ni O4 -","- C35 H30 Cl N7 Ni O4 -","- C140 H120 Cl4 N28 Ni4 O16 -","4","1","SU6095","Hapipah, Ali; Khamis, Nur Ashikin; Basirun, W. Jefri.; Bohari, M.Yamin","[1-(5-Chloro-2-oxidophenyl)ethanone 4-nitrobenzoylhydrazonato(2{-})]tris(pyridine)nickel(II) pyridine solvate","Acta Crystallographica Section E","2004","60","7","m912","m914","10.1107/S1600536804013030","","","0.71073","MoKα","","0.091","0.057","","","0.123","0.139","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203942","7.332","0.003","15.185","0.005","17.37","0.006","90","","90","","90","","1933.9","1.2","293","2","293","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","Dichlorobis(2-methylquinoline N-oxide-κO)copper(II)","","- C20 H18 Cl2 Cu N2 O2 -","- C20 H18 Cl2 Cu N2 O2 -","- C80 H72 Cl8 Cu4 N8 O8 -","4","0.5","SU6105","Victor B. Rybakov; Tatiana A. Semenova; Lyudmila A. Aleshina; Vladimir P. Andreev; Yakov P. Nizhnik; Vladimir V. Chernyshev","Dichlorobis(2-methylquinoline <i>N</i>-oxide-κ<i>O</i>)copper(II)","Acta Crystallographica Section E","2004","60","7","m901","m903","10.1107/S1600536804012942","","","1.5418","CuKα","","0.1087","0.0425","","","0.048","0.0623","","","","","","0.879","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203943","6.3949","0.0007","8.7222","0.0007","11.0868","0.0012","90","","92.345","0.009","90","","617.88","0.11","293","","250","","","","","","","","","4","P 1 21 1","P 2yb","4","","1-(2-Morpholinoethhyl)benzimidazole","","- C13 H17 N3 O -","- C13 H17 N3 O -","- C26 H34 N6 O2 -","2","1","SU6107","Mehmet Akkurt; Sema Öztürk; Nihat Şireci; Hasan Küçükbay; Orhan Büyükgüngör","1-(2-Morpholinoethyl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2004","60","7","o1185","o1187","10.1107/S1600536804012930","","","0.71073","MoKα","","0.0442","0.0308","","","0.0715","0.0746","","","","","","0.886","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203944","10.244","0.003","15.246","0.005","20.302","0.006","94.58","0.02","101","0.02","95.88","0.03","3080.1","1.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","bis(cis-cyclohexano-12-crown-4)-potassium chlorochromate","bis(cis-dodecahydro-1,4,7,10-benzotetraoxacyclododecin)- potassium chlorochromate","","- C24 H44 Cl Cr K O11 -","- C24 H44 Cl Cr K O11 -","- C96 H176 Cl4 Cr4 K4 O44 -","4","2","SU6110","Kotlyar, Sergey A.; Zubatyuk, Roman I.; Shishkin, Oleg V.; Chuprin, Gennady N.; Kiriyak, Andrey V.; Kamalov, Gerbert L.","Bis(<i>cis</i>-cyclohexano-12-crown-4)potassium chlorochromate","Acta Crystallographica Section E","2004","60","7","m907","m909","10.1107/S1600536804012966","","","0.71073","MoKα","","0.1438","0.0666","","","0.1629","0.1801","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203945","18.4374","0.0002","6.8192","0.0001","18.433","0.0002","90","","90","","90","","2317.55","0.05","173","2","173","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Ditetramethylammonium tetraaquodichlorochromate(III) trichloride dihydrate","","- C8 H36 Cl5 Cr N2 O6 -","- C8 H36 Cl5 Cr N2 O6 -","- C32 H144 Cl20 Cr4 N8 O24 -","4","0.5","SU6111","Eriksson, Annika K.; Casari, Barbara M.; Langer, Vratislav","Tetramethylammonium tetraaquadichlorochromium(III) trichloride dihydrate","Acta Crystallographica Section E","2004","60","7","m930","m932","10.1107/S1600536804013078","","","0.71073","MoKα","","0.0792","0.0529","","","0.1318","0.1488","","","","","","1.001","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2203946","27.253","0.002","16.662","0.001","17.179","0.001","90","","114.429","0.001","90","","7102.4","0.8","123","2","123","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","Bis[1,1'-bis(diphenylphosphino)ferrocenethiocyanatocopper(I)] dichloromethane disolvate","","- C72 H60 Cl4 Cu2 Fe2 N2 P4 S2 -","- C72 H60 Cl4 Cu2 Fe2 N2 P4 S2 -","- C288 H240 Cl16 Cu8 Fe8 N8 P16 S8 -","4","0.5","SU6112","Li, Dan; Luo, Ya-Fang; Wu, Tao; Ng, Seik Weng","Di-μ-thiocyanato-bis{[1,1'-bis(diphenylphosphino)ferrocene-κ^2^<i>P</i>,<i>P</i>']copper(I)} dichloromethane disolvate","Acta Crystallographica Section E","2004","60","7","m927","m929","10.1107/S1600536804013637","","","0.71073","MoKα","","0.067","0.056","","","0.158","0.166","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203947","7.1326","0.0002","12.0376","0.0004","9.8312","0.0003","90","","99.42","0.0014","90","","832.72","0.04","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[dibromozinc(II)]-di-μ-1,4-dioxan-κ^2^O:O']","","- C4 H8 Br2 O2 Zn -","- C4 H8 Br2 O2 Zn -","- C16 H32 Br8 O8 Zn4 -","4","1","SU6113","Barnes, John C.","<i>catena</i>-Poly[[dibromozinc(II)]-di-μ-1,4-dioxan-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2004","60","7","m971","m972","10.1107/S1600536804014072","","","0.71074","MoKα","","0.0519","0.0415","","","0.1009","0.1059","","","","","","1.101","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203948","15.173","0.003","5.7317","0.0012","10.9836","0.0018","90","","108.22","0.009","90","","907.3","0.3","170","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H20 S2 Si2 -","- C16 H20 S2 Si2 -","- C32 H40 S4 Si4 -","2","0.5","SU6114","Khan, Muhammad S.; Al-Naamani, Ruqaya S.; Ahrens, Birte; Raithby, Paul R.","2,5-Bis(trimethylsilylethynyl)thieno[3,2-<i>b</i>]thiophene","Acta Crystallographica Section E","2004","60","7","o1202","o1203","10.1107/S160053680401414X","","","0.71073","MoKα","","","0.0365","","","","0.1004","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203949","6.191","0.002","28.671","0.009","12.066","0.004","90","","92.51","0.02","90","","2139.7","1.2","150","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H20 S3 Si2 -","- C18 H20 S3 Si2 -","- C72 H80 S12 Si8 -","4","1","SU6115","Khan, Muhammad S.; Ahrens, Birte; Raithby, Paul R.; Teat, Simon J.","2,6-Bis(trimethylsilylethynyl)dithieno[3,2-<i>b</i>:2',3'-<i>d</i>]thiophene","Acta Crystallographica Section E","2004","60","7","o1226","o1228","10.1107/S1600536804014369","","","0.6887","Synchrotron","","","0.0554","","","","0.1143","","","","","","1.166","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203950","8.0397","0.0016","5.202","0.001","11.318","0.002","90","","90.426","0.004","90","","473.33","0.16","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3-dithiolan-2-one","","- C3 H4 O S2 -","- C3 H4 O S2 -","- C12 H16 O4 S8 -","4","1","SU6116","Reinheimer, Eric; Bacsa, John; Kim R. Dunbar","1,3-Dithiolan-2-one","Acta Crystallographica Section E","2004","60","7","o1206","o1207","10.1107/S1600536804014382","","","0.71073","MoKα","","0.0297","0.0203","","","0.0509","0.0518","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203951","12.58","0.003","13.247","0.003","15.216","0.003","90","","107.48","0.03","90","","2418.6","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","trans-Bis(isothiocynato-κN)tetrapyridinecadmium(II)","","- C22 H20 Cd N6 S2 -","- C22 H20 Cd N6 S2 -","- C88 H80 Cd4 N24 S8 -","4","0.5","SU6117","Qu Yang; Zhao-Di Liu; Hai-Liang Zhu; Tan, Min-Yu","<i>trans</i>-Bis(isothiocyanato-κ<i>N</i>)tetrapyridinecadmium(II)","Acta Crystallographica Section E","2004","60","7","m1013","m1014","10.1107/S160053680401517X","","","0.71073","MoKα","","0.0413","0.0371","","","0.0897","0.0925","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203952","6.996","0.003","19.569","0.004","16.659","0.002","90","","97.328","0.019","90","","2262.1","1.1","298","2","298","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C40 H46 Co2 Mo N10 O17 -","- C40 H46 Co2 Mo N10 O17 -","- C80 H92 Co4 Mo2 N20 O34 -","2","1","SU6119","Gustavo Liendo; Alexander Briceño; Teresa González; Reinaldo Atencio","Bis[bis(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')(nitrato-κ^2^<i>O,O</i>')cobalt(II)] molybdate heptahydrate","Acta Crystallographica Section E","2004","60","7","m1028","m1031","10.1107/S1600536804015417","","","0.71073","MoKα","","0.0494","0.0379","","","0.0848","0.091","","","","","","1.035","","","","has coordinates,has Fobs","189124","2020-10-21","18:00:00",""
"2203953","12.7397","0.0008","15.6191","0.001","25.0173","0.0015","90","","90","","90","","4978","0.5","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","catena-Poly[[[dichlorocopper(II)]-μ-1,3,5-tris(2-pyridyloxymethyl)benzene] methanol solvate]","","- C25 H25 Cl2 Cu N3 O4 -","- C25 H25 Cl2 Cu N3 O4 -","- C200 H200 Cl16 Cu8 N24 O32 -","8","1","TK6171","David J. Bray; Li-Ling Liao; Leonard F. Lindoy; John C. McMurtrie; Gang Wei","<i>catena</i>-Poly[[[dichlorocopper(II)]-μ-1,3,5-tris(2-pyridyloxymethyl)benzene] methanol solvate]","Acta Crystallographica Section E","2004","60","7","m918","m920","10.1107/S1600536804013315","","","0.71073","MoKα","","0.038","0.028","","","0.07","0.075","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203954","12.328","0.006","10.362","0.004","12.149","0.002","90","","99.6","0.03","90","","1530.2","1","295","","295","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(1RS,2RS,6SR,8SR)-2-Methyl-8-(phenylsulfonyl)bicyclo[4.2.0]octan-1-ol","","- C15 H20 O3 S -","- C15 H20 O3 S -","- C60 H80 O12 S4 -","4","1","TK6172","Wendy A. Loughlin; Michelle A. McCleary; Peter C. Healy","(1<i>RS</i>,2<i>RS</i>,6<i>S</i><i>R</i>,8<i>S</i><i>R</i>)-2-Methyl-8-(phenylsulfonyl)bicyclo[4.2.0]octan-1-ol","Acta Crystallographica Section E","2004","60","7","o1151","o1153","10.1107/S1600536804013649","","","0.71069","MoKα","","0.156","0.053","","","0.134","0.174","","","","","","0.98","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203955","11.34","0.003","18.026","0.006","7.8442","0.0016","90","","106.788","0.018","90","","1535.1","0.7","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(1RS,2SR,6SR,8SR)-2,6-Dimethyl-8-(phenylsulfonyl)bicyclo[4.2.0]octan-1-ol","","- C16 H22 O3 S -","- C16 H22 O3 S -","- C64 H88 O12 S4 -","4","1","TK6173","Wendy A. Loughlin; Michelle A. McCleary; Peter C. Healy","(1<i>RS</i>,2<i>S</i><i>R</i>,6<i>S</i><i>R</i>,8<i>S</i><i>R</i>)-2,6-Dimethyl-8-(phenylsulfonyl)bicyclo[4.2.0]octan-1-ol","Acta Crystallographica Section E","2004","60","7","o1154","o1156","10.1107/S1600536804013650","","","0.71069","MoKα","","0.128","0.047","","","0.106","0.131","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203956","7.406","0.003","11.074","0.003","13.886","0.005","112.54","0.02","94.82","0.03","101.69","0.03","1013.4","0.7","295","","295","","","","","","","","","5","P -1","-P 1","2","","4-amino-2-chloro-5-nitro-6-(propylamino)pyrimidine","","- C7 H10 Cl N5 O2 -","- C7 H10 Cl N5 O2 -","- C28 H40 Cl4 N20 O8 -","4","2","TK6175","McKeveney, Declan; Quinn, Ronald J.; Janssen, Christian O.; Healy, Peter C.","4-Amino-2-chloro-5-nitro-6-(propylamino)pyrimidine","Acta Crystallographica Section E","2004","60","7","o1260","o1262","10.1107/S1600536804015028","","","0.7107","MoKα","","0.1209","0.05","","","0.129","0.158","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203957","12.921","0.002","11.882","0.002","13.264","0.002","90","","90","","90","","2036.4","0.6","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","dichloro-N,N,N'-rimethylethylenediaminozinc","","- C5 H14 Cl2 N2 Zn -","- C5 H14 Cl2 N2 Zn -","- C40 H112 Cl16 N16 Zn8 -","8","1","WK6018","Johansson, Anna; Hakansson, Mikael","Dichloro(<i>N,N,N</i>'-trimethylethylenediamine)zinc(II)","Acta Crystallographica Section E","2004","60","7","m955","m957","10.1107/S160053680401390X","","","0.71073","MoKα","","0.05","0.04","","","0.093","0.098","","","","","","1.103","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203958","12.2491","0.0012","12.2491","0.0012","12.2491","0.0012","90","","90","","90","","1837.9","0.3","100","2","100","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","","","","- Cr H28 N O20 S2 -","- Cr H28.002 N O20 S2 -","- Cr4 H112.008 N4 O80 S8 -","4","0.166667","WM6019","Rempfer, Nora; Lerner, Hans-Wolfram; Bolte, Michael","The ammonium chromium(III) alum NH~4~Cr(SO~4~)~2~.12H~2~O","Acta Crystallographica, Section E","2004","60","7","i80","i81","10.1107/S1600536804011900","","","0.71073","MoKα","","0.0245","0.019","","","0.0496","0.0506","","","","","","1.037","","","","has coordinates","277836","2022-09-14","17:02:02",""
"2203959","4.5955","0.0009","5.842","0.0012","8.3811","0.0016","103.678","0.015","98.069","0.016","95.638","0.016","214.43","0.08","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- Fe H9 N O10 S2 -","- Fe H8 N O10 S2 -","- Fe H8 N O10 S2 -","1","0.5","WM6020","Heinicke, Friederike; Lerner, Hans-Wolfram; Bolte, Michael","NH~4~Fe^II^H(SO~4~)~2~.2H~2~O","Acta Crystallographica, Section E","2004","60","7","i84","i85","10.1107/S160053680401373X","","","0.71073","MoKα","","0.0185","0.0175","","","0.0481","0.0485","","","","","","1.124","","","","has coordinates,has disorder","282068","2023-03-26","10:12:33",""
"2203960","4.3788","0.0003","4.3788","0.0003","10.9062","0.0008","90","","90","","90","","209.11","0.03","295","2","295","2","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","cerium cadmium diantimonide","cerium cadmium diantimonide","","- Cd0.66 Ce Sb2 -","- Cd0.66 Ce Sb2 -","- Cd1.32 Ce2 Sb4 -","2","0.125","WM6021","Tkachuk, Andriy V.; Mar, Arthur","Cerium cadmium diantimonide, CeCd~0.660~Sb~2~","Acta Crystallographica Section E","2004","60","7","i82","i83","10.1107/S1600536804012814","","","0.71073","MoKα","","0.0184","0.0179","","","0.0449","0.0451","","","","","","1.198","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203961","6.7815","0.0004","14.0948","0.0012","15.0855","0.001","90","","90.05","0.005","90","","1441.93","0.18","293","2","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-[(4-Acetyl-phenylamino)-methylene]naphthalen-2(1H)-one","","- C19 H15 N O2 -","- C19 H15 N O2 -","- C76 H60 N4 O8 -","4","1","WN6245","Yüce, Süheyla; Özek, Arzu; Albayrak, Çiǧdem; Odabas̨oǧlu, Mustafa; Büyükgüngör, Orhan","1-[(4-Acetylphenylamino)methylene]naphthalen-2(1<i>H</i>)-one","Acta Crystallographica Section E","2004","60","7","o1217","o1218","10.1107/S1600536804010633","","","0.71073","MoKα","","0.0665","0.0361","","","0.0817","0.0891","","","","","","0.849","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203962","9.3902","0.0017","14.9426","0.0013","19.455","0.004","102.125","0.014","98.065","0.017","92.267","0.011","2635.8","0.8","173","2","173","2","","","","","","","","7","P -1","-P 1","2","[(tmedaH2){V2Cl5(tmeda)2}][BPh4].(THF)","","","- C46 H78 B Cl5 N6 O V2 -","- C46 H78 B Cl5 N6 O V2 -","- C92 H156 B2 Cl10 N12 O2 V4 -","2","1","WN6256","Raimondi, Angela Cristina; Hasegawa, Tai; Nunes, Fábio Souza","<i>N,N,N</i>',<i>N</i>'-Tetramethylethane-1,2-diaminium tri-μ-chloro-bis[(<i>N,N,N</i>',<i>N</i>'-tetramethylethane-1,2-diamine)vanadium(II)] tetraphenylborate tetrahydrofuran solvate","Acta Crystallographica Section E","2004","60","7","m1010","m1012","10.1107/S1600536804015004","","","0.71073","MoKα","","0.0769","0.0458","","","0.1019","0.1182","","","","","","0.983","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2203963","7.293","0.005","7.865","0.005","13.628","0.005","88.973","0.005","74.668","0.005","63.876","0.005","672.5","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-[(5-Chloro-2-hydroxy-phenylamino)methylene]-1H-naphthalen-2-one","","- C17 H12 Cl N O2 -","- C17 H12 Cl N O2 -","- C34 H24 Cl2 N2 O4 -","2","1","WN6257","Özek, Arzu; Yüce, Süheyla; Albayrak, Çiǧdem; Odabaşoǧlu, Mustafa; Büyükgüngör, Orhan","1-[(5-Chloro-2-hydroxyphenylamino)methylene]naphthalen-2(1<i>H</i>)-one","Acta Crystallographica Section E","2004","60","7","o1162","o1164","10.1107/S1600536804013728","","","0.71069","MoKα","","0.1472","0.0632","","","0.0913","0.112","","","","","","0.944","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203964","9.794","0.005","7.388","0.003","26.946","0.012","90","","90","","90","","1949.8","1.5","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","trans-2-(2-Phenylethenyl)pyrazine","","- C12 H10 N2 -","- C12 H10 N2 -","- C96 H80 N16 -","8","1","WN6258","Shi, Xue-Fang; Liu, Hui-Min; Zhang, Wen-Qin","<i>trans</i>-2-(2-Phenylethenyl)pyrazine","Acta Crystallographica Section E","2004","60","7","o1255","o1256","10.1107/S1600536804015107","","","0.71073","MoKα","","0.0751","0.0451","","","0.0905","0.1026","","","","","","1.092","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203965","9.333","0.003","13.456","0.004","7.181","0.002","90","","103.55","0.01","90","","876.7","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2-Bis(1-phenyl-1H-tetrazol-5-ylsulfanyl)ethane","","- C16 H14 N8 S2 -","- C16 H14 N8 S2 -","- C32 H28 N16 S4 -","2","0.5","WW6222","Wang, Wei; Liu, Hui-Min; Zheng, Yan; Zhang, Wen-Qin","1,2-Bis(1-phenyl-1H-tetrazol-5-ylsulfanyl)ethane","Acta Crystallographica, Section E","2004","60","8","o1279","o1280","10.1107/S1600536804015363","","","0.71073","MoKα","","0.073","0.0374","","","","0.0928","","","","","","1.005","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203966","11.449","0.002","11.2395","0.0017","11.918","0.003","90","","114.04","0.016","90","","1400.6","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4,6-dipiperidino-1,3,5-triazin-2(1H)-one","","- C13 H21 N5 O -","- C13 H21 N5 O -","- C52 H84 N20 O4 -","4","1","YA6207","Foces-Foces, C.","Self-assembly of 4,6-dipiperidino-1,3,5-triazin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2004","60","7","o1159","o1161","10.1107/S1600536804013066","","","1.5418","CuKα","","0.148","0.081","","","0.18","0.218","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203967","11.3171","0.0003","13.9042","0.0004","16.429","0.0005","104.36","0.001","98.795","0.001","100.214","0.002","2411.61","0.12","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","tris-(μ-α-methylacrylato-1:2κ^2^O:O')tris-(μ-α-methylacrylato- 2:3κ^2^O:O')(2,2'-bipyridine-1κ^2^N,N')(2,2'-bipyridine-3κ^2^N,N')(nitro- 3κ^2^O,O')dizinc(II)lanthanum(III)","","- C44 H46 La N5 O15 Zn2 -","- C44 H46 La N5 O15 Zn2 -","- C88 H92 La2 N10 O30 Zn4 -","2","1","YA6208","Zhu, Yue; Lu, Wei-Min; Chen, Fang","A zinc‒lanthanum carboxylate complex, [LaZn~2~<i>L</i>~6~(NO~3~)(bipy)~2~] (<i>L</i> = α-methylacrylate and bipy = 2,2'-bipyridine)","Acta Crystallographica Section E","2004","60","7","m963","m965","10.1107/S1600536804013613","","","0.71073","MoKα","","0.044","0.033","","","0.086","0.101","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203968","10.958","0.004","9.683","0.006","20.861","0.009","90","","96.56","0.05","90","","2199","1.9","188","","188","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Bis(η^3^-indenyl)bis(tetrahydrofuran)magnesium(II)","","- C26 H30 Mg O2 -","- C26 H30 Mg O2 -","- C104 H120 Mg4 O8 -","4","0.5","BR6152","Holger Gritzo; Frank Schaper; Hans-Herbert Brintzinger","Bis(η^3^-indenyl)bis(tetrahydrofuran)magnesium(II)","Acta Crystallographica Section E","2004","60","8","m1108","m1110","10.1107/S1600536804016149","","","0.71073","MoKα","","0.1045","0.0697","","","0.1672","0.1899","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203969","11.4472","0.0007","18.136","0.002","19.063","0.002","117.072","0.003","96.767","0.002","91.495","0.003","3485.2","0.6","183.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C96 H66 N6 Zn -","- C96 H66 N6 Zn -","- C192 H132 N12 Zn2 -","2","1","BR6154","Kojima, Takahiko; Harada, Ryosuke","(Acetonitrile-κ<i>N</i>)(2,3,5,7,8,10,12,13,15,17,18,20-dodecaphenylporphyrinato-κ^4^<i>N</i>)zinc(II) acetonitrile solvate","Acta Crystallographica Section E","2004","60","8","m1097","m1099","10.1107/S1600536804016447","","","0.7107","MoKα","","","0.0535","","","","0.1649","","","","","","1","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2203970","16.194","0.003","7.024","0.001","9.498","0.002","90","","125.91","0.01","90","","875","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","LiYb(PO~3~)~4~","","- Li O12 P4 Yb -","- Li O12 P4 Yb -","- Li4 O48 P16 Yb4 -","4","0.5","BR6155","Ben Zarkouna, Emna; Driss, Ahmed","LiYb(PO~3~)~4~","Acta Crystallographica, Section E","2004","60","8","i102","i104","10.1107/S1600536804017283","","","0.71073","MoKα","","0.018","0.0176","","","0.0466","0.0467","","","","","","1.165","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203971","10.6692","0.0015","17.257","0.002","13.399","0.0018","90","","99.7","0.02","90","","2431.7","0.6","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","bis[3,7-bis(cyclopropylmethyl)-7-aza-3-azoniaspiro[bicyclo[3.3.1]nonane-9,1'- cyclopentane]] (2E)-but-2-enedionate bis[(2E)-but-2-enedioic acid]","","- C50 H76 N4 O12 -","- C50 H76 N4 O12 -","- C100 H152 N8 O24 -","2","0.5","BT6477","Jones, Peter G.; Schön, Uwe; Finner, Emil","Tedisamil sesquifumarate","Acta Crystallographica Section E","2004","60","8","o1285","o1287","10.1107/S1600536804015521","","","0.71073","MoKα","","0.0873","0.0594","","","0.1454","0.1657","","","","","","0.978","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203972","8.873","0.001","6.567","0.001","10.629","0.002","90","","100.437","0.002","90","","609.09","0.16","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","Dimolybdato(VI)bis[(1,10-phenanthroline)iron(II)]","","- C24 H16 Fe2 Mo2 N4 O8 -","- C24 H16 Fe2 Mo2 N4 O8 -","- C24 H16 Fe2 Mo2 N4 O8 -","1","0.25","BT6478","Zhang, Xian-Ming; Fang, Rui-Qin; Ng, Seik Weng","Rerefinement of poly[[tetra-μ-oxo-dioxobis(1,10-phenanthroline-κ^2^<i>N,N</i>)dimolybdenum(VI)iron(II)]-di-μ-oxo] in the centrosymmetric space group <i>P</i>2~1~/<i>m</i>","Acta Crystallographica Section E","2004","60","8","m1049","m1050","10.1107/S1600536804015685","","","0.71073","MoKα","","0.027","0.024","","","0.064","0.065","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203973","15.8338","0.001","6.3209","0.0004","15.5019","0.001","90","","93.703","0.001","90","","1548.25","0.17","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","poly[[aquamanganese(II)]-di-μ-(4-pyridylthioacetato)-κ^6^O,O':N;N:O,O']","","- C14 H14 Mn N2 O5 S2 -","- C14 H14 Mn N2 O5 S2 -","- C56 H56 Mn4 N8 O20 S8 -","4","0.5","BT6479","Huang, Yong-Qing; Zhang, Hui; Chen, Jian-Gu; Ng, Seik Weng","A second <i>C</i>-centered monoclinic polymorph of poly[[aquamanganese(II)]-di-μ-(4-pyridylthioacetato)-κ^6^<i>O,O</i>':<i>N,N</i>:<i>O,O</i>']","Acta Crystallographica Section E","2004","60","8","m1051","m1052","10.1107/S1600536804015697","","","0.71073","MoKα","","0.0304","0.0292","","","0.0833","0.0843","","","","","","1.079","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203974","19.851","0.001","12.89","0.001","16.301","0.001","90","","105.518","0.001","90","","4019","0.4","163","2","163","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Di-μ-isopropoxy-bis[(8-hydroxyquinolinolato)diisopropoxyzirconium(IV)]","","- C36 H54 N2 O8 Zr2 -","- C36 H54 N2 O8 Zr2 -","- C144 H216 N8 O32 Zr8 -","4","0.5","BT6481","Amini, Mostafa M.; Mahmoodi, Ayoob; Mirzaee, Mehdi; Ng, Seik Weng","Di-μ-isopropoxy-bis[(8-hydroxyquinolinolato)diisopropoxyzirconium(IV)]","Acta Crystallographica Section E","2004","60","8","m1053","m1054","10.1107/S1600536804015740","","","0.71073","MoKα","","0.046","0.032","","","0.075","0.082","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203975","8.088","0.0006","8.9192","0.0006","9.7063","0.0007","92.372","0.001","95.354","0.001","108.663","0.001","658.6","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-iodo-bis[(3-cyanopyridine-κN)copper(I)]","","- C24 H16 Cu2 I2 N8 -","- C24 H16 Cu2 I2 N8 -","- C24 H16 Cu2 I2 N8 -","1","0.5","BT6482","Huang, Xiao-Chun; Ng, Seik Weng","Di-μ-iodo-bis[(3-cyanopyridine-κ<i>N</i>)copper(I)]","Acta Crystallographica Section E","2004","60","8","m1055","m1056","10.1107/S1600536804015752","","","0.71073","MoKα","","0.026","0.023","","","0.059","0.06","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203976","9.99","0.0012","16.5228","0.0018","9.4745","0.001","90","","115.005","0.008","90","","1417.3","0.3","293","2","293","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Cl18 K4 Ta6 -","- Cl18 K4 Ta6 -","- Cl36 K8 Ta12 -","2","0.25","BT6483","Jongen, Liesbet; Meyer, Gerd","Tetrapotassium dodeca-μ-chloro-hexachloro-<i>octahedro</i>-hexatantalate, K~4~[Ta~6~Cl~12~]Cl~6~","Acta Crystallographica Section E","2004","60","8","i100","i101","10.1107/S1600536804017106","","","0.71073","MoKα","","0.0355","0.0287","","","0.0648","0.0674","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203977","9.9935","0.0016","9.9935","0.0016","9.9935","0.0016","90","","90","","90","","998.1","0.3","293","2","293","2","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","","- Cl6 K2 Ta -","- Cl6 K2 Ta -","- Cl24 K8 Ta4 -","4","0.0208333","BT6484","Jongen, Liesbet; Meyer, Gerd","Dipotassium hexachlorotantalate(IV), K~2~TaCl~6~","Acta Crystallographica Section E","2004","60","8","i91","i92","10.1107/S1600536804016198","","","0.71073","MoKα","","0.0202","0.0202","","","0.0423","0.0423","","","","","","1.231","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2203978","10.107","0.002","11.957","0.002","12.836","0.002","64.832","0.005","78.988","0.005","72.857","0.005","1337.7","0.4","133","2","133","2","","","","","","","","4","P -1","-P 1","2","N-cyclohexyl-4-methoxycarbonylbenzamide","methyl 4-(cyclohexylaminocarbonyl)benzoate","","- C15 H19 N O3 -","- C15 H19 N O3 -","- C60 H76 N4 O12 -","4","2","BT6485","Jones, Peter G.; Kuś, Piotr","<i>N</i>-Cyclohexyl-4-(methoxycarbonyl)benzamide","Acta Crystallographica Section E","2004","60","8","o1299","o1300","10.1107/S1600536804015971","","","0.71073","MoKα","","0.0931","0.0653","","","0.1578","0.1698","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203979","7.427","0.0006","21.6166","0.0015","8.3108","0.0007","90","","115.768","0.006","90","","1201.59","0.17","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(1α,2β,5β,6α)-5,6-Dichloro-3-cyclohexene-1,2-diyl diacetate","","- C10 H12 Cl2 O4 -","- C10 H12 Cl2 O4 -","- C40 H48 Cl8 O16 -","4","1","BT6486","Sema Öztürk; Mehmet Akkurt; Arif Baran; Hasan Seçen; Orhan Büyükgüngör","(1α,2β,5β,6α)-5,6-Dichloro-3-cyclohexene-1,2-diyl diacetate","Acta Crystallographica, Section E","2004","60","8","o1322","o1324","10.1107/S1600536804016526","","","0.71073","MoKα","","0.0651","0.049","","","0.1417","0.1486","","","","","","1.072","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203980","10.4586","0.0019","11.3387","0.0019","11.5813","0.0019","62.71","0.01","74.36","0.011","86.041","0.011","1172.9","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Bis[μ-bis(2,6-di-1-naphthylphenyl)phosphanido]bis[(tetrahdyrofuran)lithium(I)]","","- C60 H52 Li2 O2 P2 -","- C60 H52 Li2 O2 P2 -","- C60 H52 Li2 O2 P2 -","1","0.5","BT6487","Rabe, Gerd W.; Incarvito, Christopher D.; Golen, James A.; Rheingold, Arnold L.","Bis[μ-bis(2,6-di-1-naphthylphenyl)phosphanido]bis[(tetrahydrofuran)lithium(I)]","Acta Crystallographica Section E","2004","60","8","m1156","m1157","10.1107/S1600536804017155","","","0.71073","MoKα","","0.161","0.0829","","","0.2105","0.2621","","","","","","1.055","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2203981","6.9076","0.001","4.895","0.003","25.213","0.004","90","","91.349","0.007","90","","852.2","0.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","not relevant","4-hydroxy-3,5-dimethoxybenzaldehyde","","- C9 H10 O4 -","- C9 H10 O4 -","- C36 H40 O16 -","4","1","BT6488","Tsonko Kolev; Rüdiger Wortmann; Michael Spiteller; William S. Sheldrick; Maik Heller","4-Hydroxy-3,5-dimethoxybenzaldehyde (syringaldehyde)","Acta Crystallographica, Section E","2004","60","8","o1386","o1387","10.1107/S1600536804017015","","","0.71073","MoKα","","0.0474","0.04","","","0.106","0.1114","","","","","","1.035","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203982","13.855","0.001","14.995","0.001","19.245","0.001","90","","93.571","0.001","90","","3990.5","0.4","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diiodo(4'-phenyl-2,2':6',2''-terpyridine-κ^3^N)copper(II)","","- C21 H15 Cu I2 N3 -","- C21 H15 Cu I2 N3 -","- C168 H120 Cu8 I16 N24 -","8","1","BT6490","Hou, Lei; Li, Dan; Wu, Tao; Yin, Ye-Gao; Ng, Seik Weng","Diiodo(4'-phenyl-2,2':6',2''-terpyridine-κ^3^<i>N</i>)copper(II)","Acta Crystallographica Section E","2004","60","8","m1181","m1182","10.1107/S1600536804017672","","","0.71073","MoKα","","0.049","0.04","","","0.106","0.111","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203983","7.763","0.006","9.152","0.004","8.619","0.006","90","","98.08","0.06","90","","606.3","0.7","298","2","298","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","catena-Poly[silver(I)-μ-isonicotinato-κ^2^O:N]","","- C6 H4 Ag N O2 -","- C6 H4 Ag N O2 -","- C24 H16 Ag4 N4 O8 -","4","1","BT6491","Yang, Yang-Yi; Huang, Zhong-Qi; Ouyang, Gang-Feng; Ng, Seik Weng","catena-Poly[silver(I)-μ-isonicotinato-κ^2^O:N]","Acta Crystallographica, Section E","2004","60","8","m1158","m1159","10.1107/S1600536804017684","","","0.71073","MoKα","","0.103","0.058","","","0.134","0.155","","","","","","1.03","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203984","23.048","0.007","23.048","","5.663","0.003","90","","90","","90","","3008","2","295","2","295","2","","","","","","","","4","I -4","I -4","82","","4,5-Diphenyl-1H-imidazole-1-acetic acid","","- C17 H14 N2 O2 -","- C17 H14 N2 O2 -","- C136 H112 N16 O16 -","8","1","BT6492","Gao, Shan; Zhao, Hui; Huo, Li-Hua; Gao, Jin-Shan; Zain, Sharifuddin M.; Ng, Seik Weng","4,5-Diphenyl-1H-imidazole-1-acetic acid","Acta Crystallographica, Section E","2004","60","8","o1390","o1392","10.1107/S1600536804017696","","","0.71073","MoKα","","0.083","0.075","","","0.238","0.244","","","","","","1.25","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2203985","7.468","0.003","8.55","0.004","9.525","0.005","104.03","0.03","91.42","0.05","94.33","0.03","587.8","0.5","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","2-(3-Carboxymethyl-4-nitrophenyl)propionic acid","","- C11 H11 N O6 -","- C11 H11 N O6 -","- C22 H22 N2 O12 -","2","1","BT6493","Huo, Li-Hua; Gao, Shan; Zhao, Hui; Zain, Sharifuddin M.; Ng, Seik Weng","2-(3-Carboxymethyl-4-nitrophenyl)propionic acid","Acta Crystallographica, Section E","2004","60","8","o1393","o1395","10.1107/S1600536804017817","","","0.71073","MoKα","","0.093","0.067","","","0.179","0.195","","","","","","1.04","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2203986","7.5134","0.0019","11.261","0.003","13.859","0.004","99.674","0.004","90.793","0.005","105.622","0.004","1111.1","0.5","150","2","150","2","","","","","","","","4","P -1","-P 1","2","6-methyl-2-pyridone","6-methyl-2-pyridone pentahydrate","","- C6 H17 N O6 -","- C6 H17 N O6 -","- C24 H68 N4 O24 -","4","2","BT6495","Clegg, William; Nichol, Gary S.","6-Methyl-2-pyridone pentahydrate","Acta Crystallographica Section E","2004","60","8","o1433","o1436","10.1107/S1600536804018367","","","0.71073","MoKα","","0.0735","0.0475","","","0.1181","0.133","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203987","4.581","0.0009","11.744","0.002","16.594","0.003","90","","96.69","0.03","90","","886.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-methoxypyridinium-3-squarate","2-(4-methoxypyridinio)-3,4-dioxocyclobut-1-en-1-olate","","- C10 H7 N O4 -","- C10 H7 N O4 -","- C40 H28 N4 O16 -","4","1","BT6496","T. Kolev; R. Wortmann; M. Spiteller; W. S. Sheldrick; H. Mayer-Figge","4-Methoxypyridinium betaine of squaric acid","Acta Crystallographica Section E","2004","60","8","o1449","o1450","10.1107/S1600536804018379","","","0.71073","MoKα","","0.0785","0.0441","","","0.0929","0.1073","","","","","","1.026","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203988","7.969","0.0016","11.952","0.002","14.336","0.003","90","","101.69","0.03","90","","1337.1","0.5","573","2","573","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Pyrazine-2,3-dicarboxylic acid","","- C6 H4 N2 O4 -","- C6 H4 N2 O4 -","- C48 H32 N16 O32 -","8","2","CF6358","Premkumar, Thathan; Govindarajan, Subbiah; Starosta, Wojciech; Leciejewicz, Janusz","Pyrazine-2,3-dicarboxylic acid","Acta Crystallographica Section E","2004","60","8","o1305","o1306","10.1107/S1600536804016216","","","0.71073","MoKα","","0.0666","0.0305","","","0.0962","0.1098","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203989","16.287","0.007","17.201","0.009","34.07","0.016","90","","90","","90","","9545","8","293","2","293","2","","","","","","","","6","I b c a","-I 2b 2c","73","","","","- C40 H32 Cd2 N8 O12 V4 -","- C40 H32 Cd2 N8 O12 V4 -","- C320 H256 Cd16 N64 O96 V32 -","8","0.5","CF6361","Xian-Zhong Sun; Bao-Yu Wang; Ling-Yun Zhong","μ-Tetravanadato-bis[bis(2,2'-bipyridine)cadmium(II)]","Acta Crystallographica Section E","2004","60","8","m1100","m1102","10.1107/S160053680401623X","","","0.71073","MoKα","","0.1321","0.0705","","","0.1734","0.21","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203990","20.4427","0.0002","12.7593","0.0002","21.0262","0.0002","90","","112.619","0.0007","90","","5062.53","0.11","200","","200","","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C51.73 H52.92 Cl F6 O2.73 P5 Ru -","- C51.73 H44 Cl F6 O2.73 P5 Ru -","- C206.92 H176 Cl4 F24 O10.92 P20 Ru4 -","4","1","CF6366","Anthony C. Willis; Gulliver T. Dalton; Joseph P. Morrall; Marie P. Cifuentes; Mark G. Humphrey","<i>cis</i>,<i>cis</i>,<i>cis</i>-Aquabis[bis(diphenylphosphino)methane-κ^2^<i>P</i>,<i>P</i>']chlororuthenium(II) hexafluorophosphate methanol 1.73-solvate","Acta Crystallographica Section E","2004","60","8","m1122","m1123","10.1107/S1600536804016253","","","0.71073","MoKα","","","0.0323","","","","0.0356","","","","","","1.0508","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2203991","15.341","0.011","7.4","0.005","12.149","0.009","90","","98.902","0.011","90","","1362.6","1.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aqua[N-(2-hydroxy-5-nitrobenzyl)iminodiacetato-κ^4^O,N,O',O'']copper(II)","","- C11 H12 Cu N2 O8 -","- C11 H12 Cu N2 O8 -","- C44 H48 Cu4 N8 O32 -","4","1","CF6367","Meng, Bianhong; Gao, Fei; Du, Xiuqing","Aqua[<i>N</i>-(2-hydroxy-5-nitrobenzyl)iminodiacetato-κ^4^<i>O,N,O</i>',<i>O</i>'']copper(II)","Acta Crystallographica Section E","2004","60","8","m1103","m1105","10.1107/S1600536804016484","","","0.71073","MoKα","","0.0914","0.0534","","","0.0763","0.0856","","","","","","0.868","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203992","11.43","0.002","11.406","0.002","15.087","0.003","90","","96.765","0.004","90","","1953.2","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[N,N'-Bis[2-(methylsulfanyl)phenyl]pyridine-2,6-dicarboxamidato(2-)]nickel(II)","","- C21 H17 N3 Ni O2 S2 -","- C21 H17 N3 Ni O2 S2 -","- C84 H68 N12 Ni4 O8 S8 -","4","1","CF6369","Liu, Sheng-Gui; Li, Yi-Zhi; Zuo, Jing-Lin; You, Xiao-Zeng","{<i>N,N</i>'-Bis[2-(methylsulfanyl)phenyl]pyridine-2,6-dicarboxamidato(2‒)}nickel(II)","Acta Crystallographica Section E","2004","60","8","m1153","m1155","10.1107/S1600536804017143","","","0.71073","MoKα","","0.067","0.0516","","","0.1232","0.1321","","","","","","0.924","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203993","25.757","0.005","9.053","0.003","11.623","0.002","90","","93.05","0.03","90","","2706.4","1.1","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[[(ethylenediamine-κ^2^N,N')zinc(II)]-μ-oxalato] dihydrate]","","- C4 H12 N2 O6 Zn -","- C4 H12 N2 O6 Zn -","- C48 H144 N24 O72 Zn12 -","12","1.5","CI6390","Albada, Gerard A. van; Mohamadou, Aminou; Mutikainen, Ilpo; Turpeinen, Urho; Reedijk, Jan","<i>catena</i>-Poly[[[(ethylenediamine-κ^2^<i>N,N</i>')zinc(II)]-μ-oxalato] dihydrate]","Acta Crystallographica Section E","2004","60","8","m1160","m1162","10.1107/S160053680401668X","","","0.71073","MoKα","","0.0774","0.0596","","","0.1514","0.1626","","","","","","1.229","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2203994","8.1871","0.0016","10.785","0.002","13.101","0.003","102.12","0.03","104.65","0.03","102.46","0.03","1049.1","0.5","292","2","","","","","","","","","","6","P -1","-P 1","2","","","","- C43 H42 Cl O7 P2 Rh -","- C43 H42 Cl O7 P2 Rh -","- C43 H42 Cl O7 P2 Rh -","1","0.5","CI6394","Meijboom, Reinout; Muller, Alfred; Roodt, Andreas","<i>trans</i>-Carbonylchlorobis[tris(2-methylphenyl)phosphito]rhodium(I)","Acta Crystallographica Section E","2004","60","8","m1071","m1073","10.1107/S1600536804015594","","","0.71073","MoKα","","","0.0399","","","","0.0933","","","","","","1.019","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2203995","6.679","0.0002","8.336","0.0003","10.712","0.0004","82.907","0.0019","83.34","0.002","67.368","0.002","544.74","0.03","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","Trichloro(η^5^-1,2,3-cyclopentadienyl)titanium(IV)","","- C8 H11 Cl3 Ti -","- C8 H11 Cl3 Ti -","- C16 H22 Cl6 Ti2 -","2","1","CI6395","Erben, Milan; Císařová, Ivana; Vinklárek, Jaromír; Holeček, Jaroslav","Trichloro(η^5^-1,2,3-trimethylcyclopentadienyl)titanium(IV)","Acta Crystallographica Section E","2004","60","8","m1120","m1121","10.1107/S1600536804015715","","","0.71073","MoKα","","0.0278","0.0246","","","0.0627","0.0647","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203996","10.435","0.002","11.199","0.002","15.228","0.003","86.001","0.003","73.202","0.003","72.859","0.003","1627.7","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","2,3-dithien-2-ylquinoxalin-1-ium perchlorate","","- C16 H11 Cl N2 O4 S2 -","- C16 H11 Cl N2 O4 S2 -","- C64 H44 Cl4 N8 O16 S8 -","4","2","CI6396","Foss, Paul C. D.; Crundwell, Guy; Updegraff, III, James B.; Zeller, Matthias; Hunter, Allen D.","2,3-Dithien-2-ylquinoxalin-1-ium perchlorate","Acta Crystallographica Section E","2004","60","8","o1281","o1282","10.1107/S1600536804015703","","","0.71073","MoKα","","0.0626","0.0572","","","0.1462","0.1497","","","","","","1.183","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2203997","7.15","0.003","7.8","0.002","15.481","0.005","90.68","0.02","102.62","0.03","98.48","0.03","832.4","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","2-4-(Bromophenyl)-8-cyano-5,7-dimethyloxazolo[3,2-a]pyridin-1-ylium perchlorate","","- C16 H12 Br Cl N2 O5 -","- C16 H12 Br Cl N2 O5 -","- C32 H24 Br2 Cl2 N4 O10 -","2","1","CI6397","Dmitry V. Albov; Eugenia I. Turubanova; Victor B. Rybakov; Eugene V. Babaev; Leonid A. Aslanov","2-(4-Bromophenyl)-8-cyano-5,7-dimethyloxazolo[3,2-<i>a</i>]pyridin-1-ylium perchlorate","Acta Crystallographica Section E","2004","60","8","o1303","o1304","10.1107/S1600536804015995","","","1.5418","CuKα","","0.0506","0.0447","","","0.1278","0.1323","","","","","","1.062","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2203998","10.937","0.008","20.406","0.014","7.484","0.005","90","","101.864","0.011","90","","1635","2","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","bis[μ-N,N'-bis(μ-2-oxidophenylmethyleneamino)propane-1,2- diaminato(3-)]iron(III)","","- C34 H32 Cl2 Fe2 N4 O4 -","- C34 H32 Cl2 Fe2 N4 O4 -","- C68 H64 Cl4 Fe4 N8 O8 -","2","0.5","CI6398","You, Zhong-Lu; Zhu, Hai-Liang","A dinuclear Schiff base iron(III) complex with the ligand <i>N</i>,<i>N</i>'-bis(2-oxidophenylmethyleneimino)propane-1,2-diamine","Acta Crystallographica Section E","2004","60","8","m1046","m1048","10.1107/S1600536804015727","","","0.71073","MoKα","","0.1363","0.086","","","0.2008","0.2244","","","","","","0.939","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203999","6.131","0.001","7.144","0.001","14.498","0.003","95.72","0.03","96.37","0.03","115.15","0.03","563.6","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Diaquabis(ethylenediamine-κ^2^N,N')copper(II) bis(4-fluorobenzoate)","","- C18 H28 Cu F2 N4 O6 -","- C18 H28 Cu F2 N4 O6 -","- C18 H28 Cu F2 N4 O6 -","1","0.5","CI6399","Liu, Zhao-Di; Tan, Min-Yu; Zhu, Hai-Liang","Diaquabis(ethylenediamine-κ^2^<i>N</i>,<i>N</i>')copper(II) bis(4-fluorobenzoate)","Acta Crystallographica Section E","2004","60","8","m1081","m1083","10.1107/S1600536804016277","","","0.71073","MoKα","","0.0586","0.0574","","","0.1799","0.1805","","","","","","1.183","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204000","8.5665","0.0015","8.7759","0.0016","9.5372","0.0017","91.796","0.015","91.407","0.014","116.386","0.012","641.4","0.2","293","2","293","","","","","","","","","5","P -1","-P 1","2","","5-Furan-2-yl-4-p-tolyl-2,4-dihydro-1,2,4-triazole-3-thione","","- C13 H11 N3 O S -","- C13 H11 N3 O S -","- C26 H22 N6 O2 S2 -","2","1","CI6403","Dege, Necmi; Andac, Omer; Cansız, Ahmet; Çetin, Ahmet; Şekerci, Memet; Dinçer, Muharrem","5-(Furan-2-yl)-4-(<i>p</i>-tolyl)-2,4-dihydro-1,2,4-triazole-3-thione","Acta Crystallographica Section E","2004","60","8","o1405","o1407","10.1107/S1600536804017660","","","0.71073","MoKα","","0.1117","0.0575","","","0.0961","0.1101","","","","","","1.012","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204001","15.093","0.003","7.394","0.002","15.062","0.003","90","","112.766","0.003","90","","1549.9","0.6","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Nitrato-κO)[1-(pyridin-2-ylmethyliminomethyl)naphthalen-2-olato-κO]copper(II)","","- C17 H13 Cu N3 O4 -","- C17 H13 Cu N3 O4 -","- C68 H52 Cu4 N12 O16 -","4","1","CI6404","You, Zhong-Lu; Zhu, Hai-Liang","(Nitrato-κ<i>O</i>)[1-(pyridin-2-ylmethyliminomethyl)naphthalen-2-olato-κ<i>O</i>]copper(II)","Acta Crystallographica Section E","2004","60","8","m1079","m1080","10.1107/S1600536804016265","","","0.71073","MoKα","","0.0503","0.0373","","","0.0939","0.1014","","","","","","1.012","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204002","7.094","0.002","7.353","0.002","12.139","0.002","102.68","0.03","100.27","0.03","99.53","0.03","593.9","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","bis[N-(2-hydroxyethyl)ethylenediamine-κ^3^N,N',O]copper(II) bis(4-fluorobenzoate)","","- C22 H32 Cu F2 N4 O6 -","- C22 H32 Cu F2 N4 O6 -","- C22 H32 Cu F2 N4 O6 -","1","0.5","CI6408","Qu, Yang; You, Zhong-Lu; Liu, Zhao-Di; Zhu, Hai-Liang; Tan, Min-Yu","A mononuclear copper(II) compound derived from <i>N</i>-(2-hydroxyethyl)ethylenediamine","Acta Crystallographica Section E","2004","60","8","m1187","m1188","10.1107/S1600536804018227","","","0.71073","MoKα","","0.085","0.0568","","","0.1297","0.1678","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204003","11.759","0.001","18.65","0.001","11.88","0.001","90","","111.29","0.02","90","","2427.5","0.5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","[1,9-Bis(3,5-dimethylpyrazol-1-yl-κN^2^)-3,7-dithianonane- κ^2^S,S']palladate(II) bis(tetrafluoroborate)","","- C17 H28 B2 F8 N4 Pd S2 -","- C17 H28 B2 F8 N4 Pd S2 -","- C68 H112 B8 F32 N16 Pd4 S8 -","4","1","CV6321","García-Antón, Jordi; Pons, Josefina; Ros, Josep; Solans, Xavier; Font-Bardia, Mercè","[1,9-Bis(3,5-dimethylpyrazol-1-yl-κ<i>N</i>^2^)-3,7-dithianonane-κ^2^<i>S,S</i>']palladium(II) bis(tetrafluoroborate)","Acta Crystallographica Section E","2004","60","8","m1087","m1089","10.1107/S1600536804016022","","","0.71069","MoKα","","0.0549","0.035","","","0.0598","0.0604","","","","","","1.154","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204004","9.4505","0.0002","28.9468","0.0008","13.7255","0.0002","90","","94.608","0.001","90","","3742.63","0.14","200","","200","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[triaquabis(2,6-diacetamidobenzoato)terbium(III)]-μ-2,6- diacetamidobenzoato] monohydrate]","","- C33 H41 N6 O16 Tb -","- C33 H41 N6 O16 Tb -","- C132 H164 N24 O64 Tb4 -","4","1","CV6322","Onoda, Akira; Okamura, Taka-aki; Yamamoto, Hitoshi; Ueyama, Norikazu","<i>catena</i>-Poly[[[triaquabis(2,6-diacetamidobenzoato)terbium(III)]-μ-2,6-diacetamidobenzoato] monohydrate]","Acta Crystallographica Section E","2004","60","8","m1196","m1198","10.1107/S1600536804016939","","","0.71069","MoKα","","0.0376","0.0282","","","0.0722","0.0826","","","","","","1.159","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204005","10.5593","0.0009","12.8979","0.0011","10.1875","0.0009","90","","111.703","0.002","90","","1289.11","0.19","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N'-(Benzenesulfonyl)-4-methylthiazole-5-carbohydrazide","","- C11 H11 N3 O3 S2 -","- C11 H11 N3 O3 S2 -","- C44 H44 N12 O12 S8 -","4","1","CV6326","Qing Bao Song; Zhi Min Jin; Hai Bin Wang; Biao Jiang","<i>N</i>'-(Benzenesulfonyl)-4-methylthiazole-5-carbohydrazide","Acta Crystallographica Section E","2004","60","8","o1292","o1293","10.1107/S1600536804015806","","","0.71073","MoKα","","0.0377","0.0337","","","0.0913","0.0936","","","","","","1.044","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204006","10.329","0.0011","10.4271","0.0011","10.7795","0.0011","90","","103.115","0.012","90","","1130.7","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","L-Threoninium trichloroacetate","L-Threoninium trichloroacetate","","- C6 H10 Cl3 N O5 -","- C6 H10 Cl3 N O5 -","- C24 H40 Cl12 N4 O20 -","4","2","CV6333","Rajagopal, K.; Franklin, R. Dinesh; Krishnakumar, R. V.; Ravikumar, K.; Natarajan, S.","DL-Threoninium trichloroacetate","Acta Crystallographica, Section E","2004","60","8","o1354","o1356","10.1107/S1600536804016630","","","0.71073","MoKα","","0.0342","0.0328","","","0.0836","0.0848","","","","","","1.052","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204007","11.4847","0.0003","11.4847","0.0003","12.8612","0.0004","90","","90","","90","","1696.37","0.08","295","2","295","2","","","","","","","","6","I -4","I -4","82","","","","- C28 H32 Cl Cu N8 S4 -","- C28 H32 Cl Cu N8 S4 -","- C56 H64 Cl2 Cu2 N16 S8 -","2","0.25","CV6337","Yu Liu; Duan-Jun Xu","Tetrakis(phenylthiourea-κ<i>S</i>)copper(I) chloride","Acta Crystallographica Section E","2004","60","8","m1057","m1059","10.1107/S160053680401582X","","","0.71069","MoKα","","0.028","0.026","","","0.065","0.065","","","","","","1.089","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204008","8.5896","0.0008","10.6112","0.001","14.2017","0.0013","71.36","0.002","73.261","0.001","79.67","0.002","1169.11","0.19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis{μ-N'-[1-(2-oxidophenyl)ethylidene]-3- methoxybenzohydrazidato}bis[pyridinezinc(II)] pyridine solvate","","- C52 H48 N8 O6 Zn2 -","- C52 H48 N8 O6 Zn2 -","- C52 H48 N8 O6 Zn2 -","1","0.5","CV6338","Hapipah Ali; Khamis, Nur Ashikin; M. Sukeri. M. Yusof; Bohari. M. Yamin","Bis{μ-3-methoxy-<i>N</i>'-[1-(2-oxidophenyl)ethylidene]benzohydrazidato}bis[pyridinezinc(II)] pyridine solvate","Acta Crystallographica Section E","2004","60","8","m1191","m1192","10.1107/S1600536804018100","","","0.71073","MoKα","","0.034","0.032","","","0.086","0.087","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204009","12.106","0.0006","13.7927","0.0008","13.8994","0.0009","60.813","0.003","88.719","0.003","80.625","0.002","1994.7","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[[aquabis(1H-benzimidazole-κN^3^)nickel(II)]-μ- isophthalato-κ^2^O:O'] hemihydrate]","","- C22 H19 N4 Ni O5.5 -","- C22 H19 N4 Ni O5.5 -","- C88 H76 N16 Ni4 O22 -","4","2","CV6339","Yu Liu; Duan-Jun Xu","<i>catena</i>-Poly[[[aquabis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)nickel(II)]-μ-isophthalato-κ^2^<i>O</i>:<i>O</i>'] hemihydrate]","Acta Crystallographica Section E","2004","60","8","m1092","m1094","10.1107/S1600536804016381","","","0.71073","MoKα","","0.103","0.058","","","0.09","0.101","","","","","","1.052","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204010","15.968","0.005","12.342","0.004","21.607","0.007","90","","105.682","0.006","90","","4100","2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(3,4-methylenedioxyphenyl)-1-phenyl-3-(p-toluenesulfonylamino)propan-1-one","","- C23 H21 N O5 S -","- C23 H21 N O5 S -","- C184 H168 N8 O40 S8 -","8","2","CV6340","Yu, Zhifang; Gu, Xiuyan; Zhao, Bing; Li, Yan","3-(3,4-Methylenedioxyphenyl)-1-phenyl-3-(p-toluenesulfonylamino)propan-1-one","Acta Crystallographica, Section E","2004","60","8","o1357","o1358","10.1107/S160053680401685X","","","0.71073","MoKα","","0.164","0.0615","","","0.1175","0.1468","","","","","","0.98","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204011","8.2289","0.0005","19.2134","0.0011","15.6534","0.0005","90","","95.803","0.003","90","","2462.2","0.2","293","2","293","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","acetatobis(1,10-phenantroline)zinc(II) tetrafluorborate","","- C26 H19 B F4 N4 O2 Zn -","- C26 H19 B F4 N4 O2 Zn -","- C104 H76 B4 F16 N16 O8 Zn4 -","4","1","CV6341","Rodrigues, B. L.","Acetatobis(1,10-phenanthroline)zinc(II) tetrafluoroborate","Acta Crystallographica Section E","2004","60","8","m1166","m1168","10.1107/S1600536804017477","","","0.71073","MoKα","","","0.0501","","","","0.1156","","","","","","0.939","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204012","8.4489","0.0004","10.0482","0.0005","14.9191","0.0008","77.264","0.003","87.306","0.003","86.554","0.003","1232.44","0.11","293","2","293","","","","","","","","","7","P -1","-P 1","2","","acetatobis(2,2'-bipyridil)znic(II) hexafluorphosphate monohydrate","","- C22 H21 F6 N4 O3 P Zn -","- C22 H21 F6 N4 O3 P Zn -","- C44 H42 F12 N8 O6 P2 Zn2 -","2","1","CV6342","Rodrigues, B. L.","Acetatobis(2,2'-bipyridyl)zinc(II) hexafluorophosphate monohydrate","Acta Crystallographica Section E","2004","60","8","m1169","m1171","10.1107/S1600536804017489","","","0.71073","MoKα","","","0.0519","","","","0.1527","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204013","5.6482","0.001","8.0559","0.0012","12.7628","0.0011","75.619","0.002","87.92","0.002","86.918","0.001","561.56","0.14","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis(1H-imidazole-κN^3^)bis(4-nitrobenzoato-κO)cobalt(II)","","- C20 H20 Co N6 O10 -","- C20 H20 Co N6 O10 -","- C20 H20 Co N6 O10 -","1","0.5","CV6343","Tu-Gen Xu; Duan-Jun Xu","Diaquabis(1<i>H</i>-imidazole-κ<i>N</i>^3^)bis(4-nitrobenzoato-κ<i>O</i>)cobalt(II)","Acta Crystallographica Section E","2004","60","8","m1131","m1133","10.1107/S1600536804017246","","","0.71069","MoKα","","0.028","0.025","","","0.064","0.066","","","","","","1.077","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204014","18.5029","0.0011","10.6914","0.0007","21.3741","0.0013","90","","90","","90","","4228.3","0.5","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","N,N'-Bis(p-methylphenyl)-2,2'-(m-phenylenedioxy)diacetamide","","- C24 H24 N2 O4 -","- C24 H24 N2 O4 -","- C192 H192 N16 O32 -","8","1","CV6345","Shu-Sheng Zhang; Yong-Hong Wen; Juan Liang; Xue-Mei Li","N,N'-Bis(p-methylphenyl)-2,2'-(m-phenylenedioxy)diacetamide","Acta Crystallographica, Section E","2004","60","8","o1388","o1389","10.1107/S1600536804017751","","","0.71073","MoKα","","0.122","0.085","","","0.2272","0.257","","","","","","1.023","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204015","6.821","0.0003","8.528","0.0003","11.077","0.0003","92.547","0.002","95.901","0.002","113.397","0.0017","585.66","0.04","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","Tribromo(η^5^-1,2,3-trimethylcyclopentadienyl)titanium(IV)","","- C8 H11 Br3 Ti -","- C8 H11 Br3 Ti -","- C16 H22 Br6 Ti2 -","2","1","CV6348","Erben, Milan; Císařová, Ivana; Vinklárek, Jaromír; Pavlišta, Martin","Tribromo(η^5^-1,2,3-trimethylcyclopentadienyl)titanium(IV)","Acta Crystallographica Section E","2004","60","8","m1183","m1184","10.1107/S1600536804018069","","","0.71073","MoKα","","0.0327","0.0261","","","0.0604","0.0637","","","","","","1.071","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204016","8.523","0.002","10.272","0.002","11.11","0.002","68.42","0.02","87.05","0.02","67.8","0.02","833.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","tetraammonium dilitium decavanadate","","","- H36 Li2 N4 O38 V10 -","- H36 Li2 N4 O38 V10 -","- H36 Li2 N4 O38 V10 -","1","0.5","DN6142","Ksiksi, Regaya; Graia, Mohsen; Driss, Ahmed; Jouini, Tahar","Décavanadate sel double de dilithium et tétraammonium décahydrate, (NH~4~)~4~Li~2~[V~10~O~28~]·10H~2~O","Acta Crystallographica Section E","2004","60","8","i105","i107","10.1107/S1600536804017416","","","0.71073","MoKα","","0.0327","0.0304","","","0.0905","0.0927","","","","","","1.159","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204017","10.8082","0.001","10.9099","0.0011","19.6832","0.0015","91.483","0.005","90.796","0.003","104.374","0.005","2247.1","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(ethylenediammonium) tetra-μ-oxo-tetrakis[(nitrilotriacetato)titanate] monohydrate","","- C28 H46 N8 O29 Ti4 -","- C28 H46 N8 O29 Ti4 -","- C56 H92 N16 O58 Ti8 -","2","1","DN6144","Sun, Qiaozhen; Sun, Qiaohong; Zhang, Hanhui; Surname, Forename; Huang, Changcang; Cao, Yanning; Sun, Ruiqing","Bis(ethylenediammonium) tetra-μ-oxo-tetrakis[(nitrilotriacetato)titanate(IV)] monohydrate","Acta Crystallographica Section E","2004","60","8","m1084","m1086","10.1107/S1600536804016186","","","0.71073","MoKα","","0.0838","0.0498","","","0.1091","0.1236","","","","","","1.011","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204018","8.6173","0.0015","5.2953","0.0007","15.588","0.003","90","","93.214","0.014","90","","710.2","0.2","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","S,S'-Bis(methoxycarbonylmethyl)dithioglyoxime monohydrate","dimethyl [1,2-bis(hydroxyimino)ethane-1,2-diyl]dithiodiacetate monohydrate","","- C8 H14 N2 O7 S2 -","- C8 H14 N2 O7 S2 -","- C16 H28 N4 O14 S4 -","2","0.5","DN6146","Serkan Soylu; Mehmet Kandaz; Nezihe Çalıs̨kan","S,S'-Bis(methoxycarbonylmethyl)dithioglyoxime monohydrate","Acta Crystallographica, Section E","2004","60","8","o1347","o1349","10.1107/S1600536804015922","","","0.71069","MoKα","","0.0728","0.0584","","","0.1481","0.1566","","","","","","0.934","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204019","9.974","0.002","10.575","0.002","11.547","0.002","90","","112.9","0.03","90","","1121.9","0.4","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-tert-Butyl-4,6-dinitrophenol","","- C10 H12 N2 O5 -","- C10 H12 N2 O5 -","- C40 H48 N8 O20 -","4","1","DN6148","Daniel E. Lynch; Ian McClenaghan","2-<i>tert</i>-Butyl-4,6-dinitrophenol","Acta Crystallographica Section E","2004","60","8","o1288","o1289","10.1107/S1600536804015855","","","0.71073","MoKα","","0.0775","0.0555","","","0.1501","0.1647","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204020","5.0207","0.0009","12.109","0.002","20.797","0.004","90","","90","","90","","1264.4","0.4","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","D-histidine (2R,3R)-tartrate","","","- C10 H15 N3 O8 -","- C10 H15 N3 O8 -","- C40 H60 N12 O32 -","4","1","DN6153","Johnson, M. N.; Feeder, N.","D-Histidinium (2R,3R)-tartrate","Acta Crystallographica, Section E","2004","60","8","o1373","o1374","10.1107/S1600536804017088","","","0.71073","MoKα","","0.0364","0.0291","","","0.0554","0.0567","","","","","","0.912","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2204021","8.0171","0.0003","12.3697","0.0004","15.0866","0.0005","90","","95.685","0.001","90","","1488.77","0.09","296","1","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H13 I O2 S -","- C15 H13 I O2 S -","- C60 H52 I4 O8 S4 -","4","1","DN6154","Xiu-Rong Hu; Wei-Ming Xu; Jian-Ming Gu","(<i>R</i>)-1-Iodo-1-phenyl-2-(<i>p</i>-tolylsulfonyl)ethene","Acta Crystallographica Section E","2004","60","8","o1427","o1428","10.1107/S1600536804018148","","","0.7107","MoKα","","","0.028","","","","0.076","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204022","12.539","0.003","11.113","0.002","13.315","0.003","90","","92.23","0.03","90","","1854","0.7","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(pyridin-2-ylmethanolato-κ^2^N,O)bis(trifluoroacetato)nickel(II)","","- C16 H14 F6 N2 Ni O6 -","- C16 H14 F6 N2 Ni O6 -","- C64 H56 F24 N8 Ni4 O24 -","4","0.5","FL6106","Bacsa, John; Zhao, Hanhua; Kim R. Dunbar","Bis(pyridin-2-ylmethanolato-κ^2^<i>N,O</i>)bis(trifluoroacetato)nickel(II)","Acta Crystallographica Section E","2004","60","8","m1040","m1042","10.1107/S160053680401565X","","","0.71073","MoKα","","0.0428","0.0357","","","0.0769","0.0797","","","","","","1.092","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204023","13.9369","0.0014","19.0631","0.0017","23.503","0.002","90","","90","","90","","6244.3","1","110","2","110","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-[Dichloro(phenoxy)methyl]phenyl dichlorophosphonate","","- C13 H9 Cl4 O3 P -","- C13 H9 Cl4 O3 P -","- C208 H144 Cl64 O48 P16 -","16","2","FL6107","Pinkus, A. G.; Klausmeyer, Kevin K.; Feazell, Rodney P.; Wang, Ching T.; Moseley, Charles G.","2-[Dichloro(phenoxy)methyl]phenyl dichlorophosphonate","Acta Crystallographica Section E","2004","60","8","o1312","o1313","10.1107/S1600536804016290","","","0.71073","MoKα","","0.0325","0.0241","","","0.0604","0.0646","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204024","27.166","0.002","5.9811","0.0005","24.158","0.002","90","","90.944","0.008","90","","3924.7","0.6","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H17 Cl4 O3 P -","- C17 H17 Cl4 O3 P -","- C136 H136 Cl32 O24 P8 -","8","1","FL6108","Pinkus, A. G.; Klausmeyer, Kevin K.; Feazell, Rodney P.; Wang, Ching T.; Moseley, Charles G.","2-[(4-tert-Butylphenoxy)dichloromethyl]phenyl dichlorophosphoonate","Acta Crystallographica, Section E","2004","60","8","o1313","o1314","10.1107/S1600536804016289","","","0.71073","MoKα","","0.0293","0.0251","","","0.0664","0.0687","","","","","","1.072","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204025","10.7882","0.0005","15.3791","0.0009","25.4634","0.0013","90","","90","","90","","4224.7","0.4","293","2","110","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","tris(pyrazolyl)methane","tris(pyrazol-1-yl)methane","","- C10 H10 N6 -","- C10 H10 N6 -","- C160 H160 N96 -","16","4","FL6109","McLauchlan, Craig C.; Varda, Amy N.; Giles, Julian R.","Tris(pyrazol-1-yl)methane (Tpm)","Acta Crystallographica Section E","2004","60","8","o1419","o1420","10.1107/S1600536804017490","","","0.71073","MoKα","","0.082","0.0609","","","0.1178","0.1255","","","","","","1.126","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204026","8.349","0.0017","9.212","0.0015","13.899","0.0015","83.301","0.011","79.651","0.013","65.499","0.014","955.8","0.3","140","2","140","2","","","","","","","","6","P -1","-P 1","2","[(MeNC)(PPh3)AgBr]2","Di-μ-bromo-bis[(methyl isocyanide-κC)(triphenylphosphine-κP)silver(I)]","","- C40 H36 Ag2 Br2 N2 P2 -","- C40 H36 Ag2 Br2 N2 P2 -","- C40 H36 Ag2 Br2 N2 P2 -","1","0.5","FL6110","Olmstead, Marilyn M.; Sheffrin, Meera; Jiang, Feilong","Di-μ-bromo-bis[(methyl isocyanide-κ<i>C</i>)(triphenylphosphine-κ<i>P</i>)silver(I)]","Acta Crystallographica Section E","2004","60","8","m1142","m1143","10.1107/S1600536804017179","","","0.71073","MoKα","","0.059","0.0433","","","0.1055","0.1138","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204027","5.827","0.0007","23.98","0.003","6.1406","0.0008","90","","92.306","0.002","90","","857.34","0.19","148","2","148","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Bis(dimethylammonium) 1,4-phenylenediacrylate","Bis(dimethylammonium) 1,4-phenylenediacrylate","","- C16 H24 N2 O4 -","- C16 H24 N2 O4 -","- C32 H48 N4 O8 -","2","0.5","FL6111","Wheeler, Kraig A.; Deschamps, Jeffrey R.","Bis(dimethylammonium) 1,4-phenylenediacrylate","Acta Crystallographica Section E","2004","60","8","o1421","o1423","10.1107/S1600536804017921","","","0.71073","MoKα","","0.0658","0.0533","","","0.1251","0.1308","","","","","","1.115","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204028","10.595","0.002","14.75","0.003","22.285","0.005","90","","96.186","0.009","90","","3462.3","1.2","105","","105","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","(bis{[2-(diethylphosphino- κP)ethyl]phenylphosphino}methane)dichloro[]rhodium(III) tetrafluoroborate acetone solvate","","- C28 H46 B Cl2 F4 O P4 Rh -","- C28 H46 B Cl2 F4 O P4 Rh -","- C112 H184 B4 Cl8 F16 O4 P16 Rh4 -","4","1","HB6060","Gueorguieva, Petia; Stanley, George G.; Fronczek, Frank R.","A mononuclear Rh^III^ tetraphosphine complex, [RhCl~2~(C~25~H~40~P~4~)]BF~4~·C~3~D~6~O, crystallized as a perdeuteroacetone solvate","Acta Crystallographica Section E","2004","60","8","m1043","m1045","10.1107/S1600536804015533","","","0.71073","MoKα","","0.049","0.031","","","0.066","0.071","","","","","","1.009","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204029","15.286","0.0004","8.362","0.0002","15.69","0.0004","90","","101.086","0.0016","90","","1968.1","0.09","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","μ-Oxo-bis[azidobis(η^5^-cyclopentadienyl)titanium(IV)]","","- C20 H20 N6 O Ti2 -","- C20 H20 N6 O Ti2 -","- C80 H80 N24 O4 Ti8 -","4","1","HB6061","Honzíček, Jan; Vinklárek, Jaromír; Erben, Milan; Císařová, Ivana","μ-Oxo-bis[azidobis(η^5^-cyclopentadienyl)titanium(IV)]","Acta Crystallographica Section E","2004","60","8","m1090","m1091","10.1107/S1600536804016162","","","0.71073","MoKα","","0.0557","0.0342","","","0.077","0.0871","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204030","7.2693","0.0003","9.5506","0.0003","16.6714","0.0004","90","","90","","90","","1157.43","0.07","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H10 Cu N2 O5 -","- C11 H10 Cu N2 O5 -","- C44 H40 Cu4 N8 O20 -","4","1","HB6062","Lei Cao; Ning Li; Duan-Jun Xu","Poly[[(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)copper(II)]-μ~3~-oxydiacetato]","Acta Crystallographica Section E","2004","60","8","m1066","m1067","10.1107/S1600536804016009","","","0.71073","MoKα","","0.022","0.021","","","0.052","0.052","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204031","16.777","0.001","7.8257","0.0006","19.447","0.001","90","","90.356","0.002","90","","2553.2","0.3","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(Acetonitrile-κN)(4'-phenyl-2,2':6',2''-terpyridine-κ^3^N)silver(I) hexafluorophosphate acetonitrile solvate","","- C25 H21 Ag F6 N5 P -","- C25 H21 Ag F6 N5 P -","- C100 H84 Ag4 F24 N20 P4 -","4","1","HB6063","Hou, Lei; Li, Dan; Yin, Ye-Gao; Wu, Tao; Ng, Seik Weng","(Acetonitrile-κ<i>N</i>)(4'-phenyl-2,2':6',2''-terpyridine-κ^3^<i>N</i>)silver(I) hexafluorophosphate acetonitrile solvate","Acta Crystallographica Section E","2004","60","8","m1106","m1107","10.1107/S1600536804016472","","","0.71073","MoKα","","0.083","0.057","","","0.153","0.178","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204032","16.4537","0.001","8.1471","0.0011","14.5814","0.0012","90","","127.535","0.012","90","","1550","0.4","295","2","295","2","","","","","","","","5","C 1 c 1","C -2yc","9","","2-Chloro-3,4-dimethoxybenzaldehyde (4-nitrophenyl)hydrazone","","- C15 H14 Cl N3 O4 -","- C15 H14 Cl N3 O4 -","- C60 H56 Cl4 N12 O16 -","4","1","HB6065","Shang Shan; Xiao-Juan Wang; Wei-Xiao Hu; Duan-Jun Xu","2-Chloro-3,4-dimethoxybenzaldehyde (4-nitrophenyl)hydrazone","Acta Crystallographica, Section E","2004","60","8","o1344","o1346","10.1107/S1600536804016642","","","0.71073","MoKα","","0.03","0.028","","","0.077","0.078","","","","","","1.033","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204033","14.071","0.007","8.985","0.006","17.23","0.03","90","","90","","90","","2178","4","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","Diazidobis(1,10-phenanthroline-κ^2^N,N')cadmium(II)","","- C24 H16 Cd N10 -","- C24 H16 Cd N10 -","- C96 H64 Cd4 N40 -","4","0.5","HB6066","Xiang He; Can-Zhong Lu; Xiao-Yuan Wu; Quan-Zheng Zhang; Shui-Mei Chen; Jiu-Hui Liu","Diazidobis(1,10-phenanthroline-κ^2^<i>N,N</i>')cadmium(II)","Acta Crystallographica Section E","2004","60","8","m1124","m1125","10.1107/S1600536804016654","","","0.71073","MoKα","","0.0733","0.0537","","","0.1161","0.125","","","","","","1.075","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204034","11.5","0.02","7.35","0.01","14.3","0.02","90","","92.42","0.02","90","","1208","3","173.2","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H24 N2 O10 S -","- C22 H24 N2 O10 S -","- C44 H48 N4 O20 S2 -","2","1","HG6044","Zao-Zao Qiu; Peng-Fei Xu","5-Phenyl-1,3,4-dioxazol-2-yl 2,3,4,6-tetra-O-acetyl-1-thio-D-glucopyranoside","Acta Crystallographica, Section E","2004","60","8","o1364","o1365","10.1107/S1600536804014734","","","0.7107","MoKα","","","0.0355","","","","0.0458","","","","","","1.064","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204035","8.866","0.003","9.2962","0.0016","19.361","0.003","90","","90","","90","","1595.8","0.7","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1.2.5.6-Di-O-isopropylidene-3-O-methylsulfonyl-α-D-glucofuranose","","- C13 H22 O8 S -","- C13 H22 O8 S -","- C52 H88 O32 S4 -","4","1","HG6051","Ziemer, Burkhard; Mahrwald, Rainer","1.2.5.6-Di-O-isopropylidene-3-O-methylsulfonyl- α-D-glucofuranose","Acta Crystallographica, Section E","2004","60","8","o1342","o1343","10.1107/S1600536804013455","","","0.71073","MoKα","","0.0491","0.039","","","0.0876","0.0901","","","","","","0.933","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204036","10.5207","0.0001","11.8587","0.0001","10.9164","0.0002","90","","90","","90","","1361.95","0.03","120","2","120","2","","","","","","","","6","P n a 21","P 2c -2n","33","Strontium clodronate","Pentaaqua(dichloromethylenebisphosphonato)strontium(II)","","- C H12 Cl2 O11 P2 Sr -","- C H12 Cl2 O11 P2 Sr -","- C4 H48 Cl8 O44 P8 Sr4 -","4","1","HG6061","Kontturi, Mervi; Peräniemi, Sirpa; Vepsäläinen, Jouko J.; Ahlgrén, Markku","Pentaaqua(dichloromethylenebisphosphonato)strontium(II)","Acta Crystallographica Section E","2004","60","8","m1060","m1062","10.1107/S1600536804015764","","","0.71073","MoKα","","0.0202","0.0189","","","0.046","0.0466","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204037","13.586","0.008","13.586","0.008","32.6","0.04","90","","90","","90","","6017","9","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","[2,2'-(ethylenedioxy)dibenzaldehyde bis(thiosemicarbazone)]nickel(II) diperchlorate methanol disolvate","","- C20 H26 Cl2 N6 Ni O12 S2 -","- C20 H26 Cl2 N6 Ni O12 S2 -","- C160 H208 Cl16 N48 Ni8 O96 S16 -","8","0.5","HG6062","Xiao-Hang, Qiu; Hong-Yan, Wu","[2,2'-(Ethylenedioxy)dibenzaldehyde bis(thiosemicarbazone)]nickel(II) diperchlorate methanol disolvate","Acta Crystallographica Section E","2004","60","8","m1151","m1152","10.1107/S1600536804017192","","","0.71073","MoKα","","0.079","0.052","","","0.141","0.158","","","","","","1.08","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204038","14.81","0.003","7.94","0.01","12.049","0.002","90","","99.99","0.1","90","","1395.4","1.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(3-chloro-3-methyl-1,2,3,4-tetrahydrocarbazole-2-yl)-propanenitrile","","- C16 H17 Cl N2 -","- C16 H17 Cl N2 -","- C64 H68 Cl4 N8 -","4","1","HG6063","Shi, Hai-Jian; Hu, Yue-Fei; Hu, Hong-Wen","3-(3-Chloro-3-methyl-1,2,3,4-tetrahydrocarbazole-2-yl)propanenitrile","Acta Crystallographica, Section E","2004","60","8","o1380","o1381","10.1107/S1600536804017210","","","0.71073","MoKα","","0.0947","0.0348","","","0.0883","0.1071","","","","","","1.045","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204039","15.0847","0.0012","7.6587","0.0006","18.4907","0.0015","90","","92.216","0.001","90","","2134.6","0.3","180","2","180","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,6-bis[bis(2-pyridyl)hydroxymethyl]pyridine","","- C27 H21 N5 O2 -","- C27 H21 N5 O2 -","- C108 H84 N20 O8 -","4","0.5","HG6065","Görlitz, Jessica J.; Nielsen, Pia; Toftlund, Hans; Bond, Andrew D.","2,6-Bis[bis(2-pyridyl)hydroxymethyl]pyridine","Acta Crystallographica, Section E","2004","60","8","o1318","o1319","10.1107/S1600536804016368","","","0.71073","MoKα","","0.0461","0.0355","","","0.089","0.0947","","","","","","1.035","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204040","15.0059","0.0003","10.4719","0.0002","16.9266","0.0003","90","","93.547","0.001","90","","2654.76","0.09","155","2","155","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N,N'-Dicyclohexyl-N-[(1RS,2RS,6SR)-4-(4-methoxyphenyl)-2,6-dimethyl-3- cyclohexene-1-carbonyl]urea","","- C29 H42 N2 O3 -","- C29 H42 N2 O3 -","- C116 H168 N8 O12 -","4","1","HG6067","Xie, Songwen; Meyers, Cal Y.; Robinson, Paul D.","N,N'-Dicyclohexyl-N-[(1RS,2RS,6SR)-4-(4-methoxyphenyl)-2,6-dimethyl-3- cyclohexene-1-carbonyl]urea: an unusual crystalline enantiomeric pairing","Acta Crystallographica, Section E","2004","60","8","o1361","o1363","10.1107/S1600536804016800","","","0.71073","MoKα","","0.089","0.073","","","0.212","0.232","","","","","","1.1","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204041","6.2189","0.0002","16.0064","0.0006","12.978","0.0004","90","","93.967","0.001","90","","1288.76","0.08","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","S-Phenyl 3-methanesulfonyl-2-oxoimidazolidine-1-carbothioate","","- C11 H12 N2 O4 S2 -","- C11 H12 N2 O4 S2 -","- C44 H48 N8 O16 S8 -","4","1","HG6068","Yong-Shu Li; Xian-rui Liang; Wen Feng; Wei-Ke Su","S-Phenyl 3-methanesulfonyl-2-oxoimidazolidine-1-carbothioate","Acta Crystallographica, Section E","2004","60","8","o1378","o1379","10.1107/S1600536804017337","","","0.71073","MoKα","","0.0374","0.0336","","","0.0888","0.0917","","","","","","1.066","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204042","7.574","0.003","11.104","0.004","14.122","0.005","90","","91.719","0.008","90","","1187.1","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-Phenethyl-2-thioxo-2,3,5,6-tetrahydropyrimidin-4(1H)-one","","- C12 H14 N2 O S -","- C12 H14 N2 O S -","- C48 H56 N8 O4 S4 -","4","1","HG6069","Chang-Sheng Yao; Hai-Bin Song; You-Quan Zhu; Ying Gao; Fang-Zhong Hu; Xiao-Mao Zou; Hua-Zheng Yang","3-Phenethyl-2-thioxo-2,3,5,6-tetrahydropyrimidin-4(1<i>H</i>)-one","Acta Crystallographica Section E","2004","60","8","o1411","o1413","10.1107/S160053680401801X","","","0.71073","MoKα","","0.068","0.0409","","","0.0878","0.0985","","","","","","1.024","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204043","10.3942","0.0008","12.501","0.001","14.348","0.001","74.028","0.004","73.954","0.004","65.501","0.005","1602.7","0.2","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","25,27-Bis(benzyloxy)-26,28-dihydroxycalix[4]arene","","- C42 H36 O4 -","- C42 H36 O4 -","- C84 H72 O8 -","2","1","HG6070","Bolte, Michael; Sakhaii, Peyman","25,27-Bis(benzyloxy)-26,28-dihydroxycalix[4]arene","Acta Crystallographica, Section E","2004","60","8","o1359","o1360","10.1107/S1600536804017040","","","0.71073","MoKα","","0.1039","0.0598","","","0.1154","0.1336","","","","","","1.048","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2204044","13.0117","0.0012","6.3408","0.0004","17.5237","0.0015","90","","110.854","0.007","90","","1351.1","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(Benzothiazol-2-yliminomethyl)-6-methoxyphenol","","- C15 H12 N2 O2 S -","- C15 H12 N2 O2 S -","- C60 H48 N8 O8 S4 -","4","1","HG6071","Orhan Büyükgüngör; Nezihe Çalışkan; Ceyda Davran; Hümeyra Batı","2-(Benzothiazol-2-yliminomethyl)-6-methoxyphenol","Acta Crystallographica Section E","2004","60","8","o1414","o1416","10.1107/S1600536804018008","","","0.71073","MoKα","","0.0683","0.05","","","0.125","0.1327","","","","","","0.949","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204045","6.0562","0.0013","9.827","0.002","11.1075","0.0016","109.289","0.014","102.766","0.015","92.771","0.019","603.2","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","7-Hydroxy-2,2,7-trimethylperhydronaphthalene-1,5-dione","","- C13 H20 O3 -","- C13 H20 O3 -","- C26 H40 O6 -","2","1","HG6072","Silvia Russi; Leopoldo Suescun; Mirta Mischne; Alvaro W. Mombrú","7-Hydroxy-2,2,7-trimethylperhydronaphthalene-1,5-dione","Acta Crystallographica Section E","2004","60","8","o1444","o1446","10.1107/S1600536804017313","","","0.71069","MoKα","","0.0729","0.0514","","","0.1481","0.1668","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204046","7.2905","0.0008","9.481","0.001","11.886","0.001","90","","93.28","0.002","90","","820.23","0.14","126.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H11 N O4 -","- C8 H11 N O4 -","- C32 H44 N4 O16 -","4","1","LH6219","Jose Escalada; Danna Freedman; Eric J. Werner","2,3-Dihydroxy-<i>N</i>-methylbenzamide monohydrate","Acta Crystallographica Section E","2004","60","8","o1296","o1298","10.1107/S1600536804015302","","","0.7107","MoKα","","","0.0435","","","","0.0519","","","","","","2.024","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204047","16.49","0.003","16.49","0.003","8.3485","0.0011","90","","90","","120","","1966","0.6","193","2","193","2","","","","","","","","6","P -3 1 c","-P 3 2c","163","Tris-bis(trimethylsilyl)amido-samarium","Tris[bis(trimethylsilyl)amido]samarium tetrahydrofuran solvate","","- C22 H62 N3 O Si6 Sm -","- C22.08 H62.16 N3 O1.02 Si6 Sm -","- C44.16 H124.32 N6 O2.04 Si12 Sm2 -","2","0.166667","LH6224","Jörg Sundermeyer; Alexandre Khvorost; Klaus Harms","Tris[bis(trimethylsilyl)amido]samarium tetrahydrofuran solvate","Acta Crystallographica Section E","2004","60","8","m1117","m1119","10.1107/S1600536804016435","","","0.71073","MoKα","","0.0972","0.0609","","","0.0949","0.1039","","","","","","1.035","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204048","16.0613","0.0004","18.1719","0.0005","28.35","0.0007","90","","95.303","0.001","90","","8238.9","0.4","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Sb Ag3 Cl6 P6 F6 C77 H70","Tris[μ-bis(diphenylphosphino)methane-κ^2^P:P']di-μ~3~-chloro-trisilver(I) hexafluoroantimonate dichloromethane disolvate","","- C77 H70 Ag3 Cl6 F6 P6 Sb -","- C77 H70 Ag3 Cl6 F6 P6 Sb -","- C308 H280 Ag12 Cl24 F24 P24 Sb4 -","4","1","LH6228","Wu, Mei-Mei; Qin, Yong-Hai","Tris[μ-bis(diphenylphosphino)methane-κ^2^<i>P</i>:<i>P</i>']di-μ~3~-chloro-trisilver(I) hexafluoroantimonate dichloromethane disolvate","Acta Crystallographica Section E","2004","60","8","m1185","m1186","10.1107/S1600536804018112","","","0.71073","MoKα","","0.1119","0.072","","","0.1451","0.1706","","","","","","1.218","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204049","9.512","0.002","10.424","0.002","19.421","0.004","90","","101.118","0.014","90","","1889.5","0.7","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","catena-Poly[[trimethyltin(IV)]-μ-2-(4-chlorophenyl)-3-(4-methoxyphenyl) -propenoato-κ^2^O:O'],","catena-Poly[[trimethyltin(IV)]-μ-2-(4-chlorophenyl)-3-(4-methoxyphenyl) -propenoato-κ^2^O:O'],","","- C19 H21 Cl O3 Sn -","- C19 H21 Cl O3 Sn -","- C76 H84 Cl4 O12 Sn4 -","4","1","LH6235","Sadiq-ur-Rehman; Abdelrehman, Doaa; Ali, Saqib; Badshah, Amin; Parvez, Masood","<i>catena</i>-Poly[[trimethyltin(IV)]-μ-2-(4-chlorophenyl)-3-(4-methoxyphenyl)propenoato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2004","60","8","m1076","m1078","10.1107/S1600536804015314","","","0.71073","MoKα","","0.043","0.03","","","0.069","0.075","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204050","26.524","0.003","11.3288","0.0018","9.231","0.0011","90","","104.643","0.009","90","","2683.7","0.6","150","","150","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","5-(2-Hydroxyphenyl)-4-(p-tolyl)-2,4-dihydro-1,2,4-triazole-3-thione","","- C15 H13 N3 O S -","- C15 H13 N3 O S -","- C120 H104 N24 O8 S8 -","8","1","LH6236","Genç, Sadık; Dege, Necmi; Çetin, Ahmet; Cansız, Ahmet; Şekerci, Memet; Dinçer, Muharrem","5-(2-Hydroxyphenyl)-4-(p-tolyl)-2,4-dihydro-1,2,4-triazole-3-thione","Acta Crystallographica, Section E","2004","60","8","o1339","o1341","10.1107/S1600536804016551","","","0.71073","MoKα","","0.0787","0.054","","","0.1338","0.1478","","","","","","0.983","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204051","4.989","0.003","5.305","0.003","7.368","0.004","104.429","0.01","97.886","0.009","93.797","0.01","186.05","0.19","293","2","293","2","","","","","","","","4","P -1","-P 1","2","1,4-phenylenediboronic acid","1,4-phenylenediboronic acid","","- C6 H8 B2 O4 -","- C6 H8 B2 O4 -","- C6 H8 B2 O4 -","1","0.5","LH6237","Rodríguez-Cuamatzi, Patricia; Vargas-Dáz, Gabriela; Maris, Thierry; Wuest, James D.; Höpfl, Herbert","1,4-Phenylenediboronic acid","Acta Crystallographica, Section E","2004","60","8","o1315","o1317","10.1107/S1600536804016150","","","0.71073","MoKα","","0.0529","0.05","","","0.1322","0.1346","","","","","","1.213","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2204052","7.4878","0.001","12.009","0.002","13.585","0.002","110.872","0.009","102.803","0.007","100.404","0.007","1066.9","0.3","102","","102","","","","","","","","","6","P -1","-P 1","2","","2-[(ethylaminothioylhydrazono)(2-pyridyl)methyl]pyridinium tetrachlorodiphenylstannate(IV)","","- C40 H42 Cl4 N10 S2 Sn -","- C40 H42 Cl4 N10 S2 Sn -","- C40 H42 Cl4 N10 S2 Sn -","1","0.5","LH6238","Venkatraman, Ramaiyer; Ray, Paresh Chandra; Fronczek, Frank R.","The tetrachlorodiphenylstannate(IV) salt of protonated di-2-pyridyl ketone <i>N</i>^4^-ethylthiosemicarbazone","Acta Crystallographica Section E","2004","60","8","m1035","m1037","10.1107/S1600536804015508","","","0.71073","MoKα","","0.038","0.029","","","0.063","0.066","","","","","","1.054","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204053","6.155","0.002","9.676","0.004","22.507","0.008","90","","93.543","0.006","90","","1337.8","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(2E)-2-(2,4-Dichlorobenzylidene)-6,7-dihydro-2H-thiazolo[3,2-a]pyrimidin- 3(5H)-one","","- C13 H10 Cl2 N2 O S -","- C13 H10 Cl2 N2 O S -","- C52 H40 Cl8 N8 O4 S4 -","4","1","LH6239","Liang, Zu-Pei; Cao, Chang-Qing","(2E)-2-(2,4-Dichlorobenzylidene)-6,7-dihydro-2H-thiazolo[3,2-a]pyrimidin- 3(5H)-one","Acta Crystallographica, Section E","2004","60","8","o1333","o1334","10.1107/S160053680401654X","","","0.71073","MoKα","","0.0574","0.0384","","","","0.0944","","","","","","1.062","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204054","13.5852","0.0007","10.4183","0.0004","19.5622","0.0007","90","","104.065","0.002","90","","2685.7","0.2","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H27 Mn N7 O6 -","- C25 H27 Mn N7 O6 -","- C100 H108 Mn4 N28 O24 -","4","1","LH6240","Jian-Rong Su; Kai-Liang Yin; Duan-Jun Xu","Tris(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)(iminodiacetato-κ^2^<i>O,O</i>')manganese(II) dihydrate","Acta Crystallographica Section E","2004","60","8","m1063","m1065","10.1107/S1600536804015910","","","0.71073","MoKα","","0.058","0.042","","","0.104","0.111","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204055","9.2286","0.0005","11.4896","0.0006","12.0277","0.0007","80.517","0.004","82.803","0.004","73.69","0.004","1203.07","0.12","238","1","238","1","","","","","","","","7","P 1","P 1","1","","bis[(S,S)-1,2-dimethoxy-1,2-bis(1-methyl-1H-benzimidazol-2-yl)ethane]copper(II) bis(tetrafluoroborate) acetonitrile disolvate","","- C44 H50 B2 Cu F8 N10 O4 -","- C44 H50 B2 Cu F8 N10 O4 -","- C44 H50 B2 Cu F8 N10 O4 -","1","1","LH6241","Robert T. Stibrany; Harvey J. Schugar; Joseph A. Potenza","A chiral facially coordinated Cu^II^ complex derived from a tridentate bis(benzimidazole) ligand: bis[(<i>S,S</i>)-1,2-dimethoxy-1,2-bis(1-methylbenzimidazol-2-yl)ethane]copper(II) bis(tetrafluoroborate) acetonitrile disolvate","Acta Crystallographica Section E","2004","60","8","m1147","m1150","10.1107/S1600536804017295","","","0.71073","MoKα","","0.0656","0.0513","","","0.1279","0.1488","","","","","","1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204056","9.8777","0.0008","10.488","0.0008","9.9723","0.0008","90","","93.131","0.002","90","","1031.56","0.14","93","2","93","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N-Phthaloyl-dl-alanine","dl-2-(1,3-dioxoisoindolin-2-yl)propanoic acid","","- C11 H9 N O4 -","- C11 H9 N O4 -","- C44 H36 N4 O16 -","4","1","LH6242","Wheeler, Kraig A.; Matthew Gordineer; Deschamps, Jeffrey R.","N-Phthaloyl-dl-alanine","Acta Crystallographica, Section E","2004","60","8","o1398","o1400","10.1107/S1600536804016459","","","0.71073","MoKα","","0.0424","0.0359","","","0.0916","0.096","","","","","","1.052","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204057","7.12","0.002","17.501","0.004","13.73","0.003","90","","96.05","0.02","90","","1701.3","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis{2-[3-(diethylamino)propyliminomethyl]phenolato}copper(II) diperchlorate","","- C28 H44 Cl2 Cu N4 O10 -","- C28 H44 Cl2 Cu N4 O10 -","- C56 H88 Cl4 Cu2 N8 O20 -","2","0.5","LH6243","You, Zhong-Lu; Xiong, Zhong-Duo; Zhu, Hai-Liang","Bis{2-[3-(diethylamino)propyliminomethyl]phenolato}copper(II) diperchlorate","Acta Crystallographica Section E","2004","60","8","m1114","m1116","10.1107/S1600536804016563","","","0.71073","MoKα","","0.1285","0.0735","","","0.1943","0.2395","","","","","","1.023","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204058","11.877","0.002","21.552","0.003","14.817","0.002","90","","91.696","0.007","90","","3791.1","1","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Bis[2,3-bis(4-chlorophenyl)propenoato-κ^2^O:O']di-n-butyltin(IV)","Bis[2,3-bis(4-chlorophenyl)propenoato-κ^2^O:O']di-n-butyltin(IV)","","- C38 H36 Cl4 O4 Sn -","- C38.008 H36 Cl4 O4 Sn -","- C152.032 H144 Cl16 O16 Sn4 -","4","1","LH6244","Sadiq-ur-Rehman; Ly, Hanh Vien; Ali, Saqib; Badshah, Amin; Parvez, Masood","Bis[2,3-bis(4-chlorophenyl)propenoato-κ^2^<i>O</i>:<i>O</i>']di-<i>n</i>-butyltin(IV)","Acta Crystallographica Section E","2004","60","8","m1144","m1146","10.1107/S1600536804017039","","","0.71073","MoKα","","0.094","0.047","","","0.116","0.138","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204059","23.607","0.003","6.7381","0.0008","12.7583","0.0016","90","","110.215","0.002","90","","1904.4","0.4","93","2","93","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,5,7-trinitro-2,5,7,9-tetraazabicyclo[4.3.0]nonan-8-one","","- C5 H7 N7 O7 -","- C5 H7 N7 O7 -","- C40 H56 N56 O56 -","8","1","LH6248","Butcher, Ray J.; Evans, Robin; Gilardi, R.","2,5,7-Trinitro-2,5,7,9-tetraazabicyclo[4.3.0]nonan-8-one","Acta Crystallographica, Section E","2004","60","8","o1375","o1377","10.1107/S1600536804017301","","","0.71073","MoKα","","0.0588","0.05","","","0.105","0.1079","","","","","","1.251","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204060","12.2172","0.0007","11.0152","0.0007","19.5064","0.0012","90","","106.999","0.001","90","","2510.4","0.3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","cis-Bis(2,2'-bipyridine-4,4'-dicarboxylic acid\-κ^2^N,N')dichlororuthenium(II) monohydrate","","- C24 H18 Cl2 N4 O9 Ru -","- C24 H16 Cl2 N4 O9 Ru -","- C96 H64 Cl8 N16 O36 Ru4 -","4","1","LH6249","Fujihara, Takashi; Kobayashi, Atsuo; Iwai, Miho; Nagasawa, Akira","<i>cis</i>-Bis(2,2'-bipyridine-4,4'-dicarboxylic acid-κ^2^<i>N</i>,<i>N</i>')dichlororuthenium(II) monohydrate","Acta Crystallographica Section E","2004","60","8","m1172","m1174","10.1107/S1600536804017507","","","0.71073","MoKα","","0.0287","0.026","","","0.071","0.0732","","","","","","1.052","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204061","10.7932","0.0002","9.8543","0.0002","17.8692","0.0003","90","","103.967","0.001","90","","1844.37","0.06","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Triphenyl(propyl)phosphonium bromide","Triphenyl(propyl)phosphonium bromide","","- C21 H22 Br P -","- C21 H22 Br P -","- C84 H88 Br4 P4 -","4","1","LH6251","Czerwinski, Edmund W.","Triphenyl(propyl)phosphonium bromide","Acta Crystallographica Section E","2004","60","8","o1442","o1443","10.1107/S1600536804018331","","","1.5418","CuKα","","0.0366","0.0333","","","","0.0899","","","","","","1.073","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204062","19.32","0.0009","11.1284","0.0004","25.6676","0.0012","90","","108.638","0.004","90","","5229.1","0.4","153","2","153","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","cis-{trans-1,2-bis[2-(diphenylphosphino)benzamido]cyclohexane- κ^2^P,P'}dichloroplatinum(II) chloroform trisolvate","","- C47 H43 Cl11 N2 O2 P2 Pt -","- C47 H43 Cl11 N2 O2 P2 Pt -","- C188 H172 Cl44 N8 O8 P8 Pt4 -","4","1","NA6337","Burger, Sylvain; Therrien, Bruno; Süss-Fink, Georg","<i>cis</i>-{<i>trans</i>-1,2-Bis[2-(diphenylphosphino)benzamido]cyclohexane-κ^2^<i>P,P</i>'}dichloroplatinum(II) chloroform trisolvate","Acta Crystallographica Section E","2004","60","8","m1163","m1165","10.1107/S1600536804017209","","","0.71073","MoKα","","0.0457","0.0364","","","0.0866","0.0919","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204063","7.8301","0.0009","18.6827","0.0019","13.884","0.0014","90","","103.013","0.009","90","","1978.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(4-Chlorophenyl)-5-methyl-6,7,8,9,10,11- hexahydrocycloocta[e][1,3]oxazolo[3,2-a]pyridin-12-ium perchlorate","","- C20 H21 Cl2 N O5 -","- C20 H21 Cl2 N O5 -","- C80 H84 Cl8 N4 O20 -","4","1","NA6346","Dmitry V. Albov; Victor B. Rybakov; Eugene V. Babaev; Leonid A. Aslanov","2-(4-Chlorophenyl)-5-methyl-6,7,8,9,10,11-hexahydrocycloocta[<i>e</i>][1,3]oxazolo[3,2-<i>a</i>]pyridin-12-ium perchlorate","Acta Crystallographica Section E","2004","60","8","o1301","o1302","10.1107/S1600536804014345","","","1.5418","CuKα","","0.0744","0.0452","","","0.112","0.1244","","","","","","0.929","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204064","12.699","0.004","13.885","0.004","7.252","0.002","90","","90","","90","","1278.7","0.6","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","catena-Poly[[chlorocopper(I)]-μ-1,3-di-4-pyridylpropane-k^2^N:N']","","- C13 H14 Cl Cu N2 -","- C13 H14 Cl Cu N2 -","- C52 H56 Cl4 Cu4 N8 -","4","0.5","NG6036","En Tang; Yu-Mei Dai; Shen Lin","<i>catena</i>-Poly[[chlorocopper(I)]-μ-1,3-di-4-pyridylpropane-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2004","60","8","m1095","m1096","10.1107/S1600536804016320","","","0.71073","MoKα","","","0.0887","","","0.1752","0.2003","","","","","","1.109","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204065","7.499","0.001","14.525","0.002","15.049","0.001","90","","101.15","0.04","90","","1608.2","0.4","293","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 Cl2 N4 Zn -","- C16 H12 Cl2 N4 Zn -","- C64 H48 Cl8 N16 Zn4 -","4","1","OB6380","Ömer Çelik; Semra İde; Mustafa Kurt; Şenay Yurdakul","Dichlorobis(phthalazine)zinc(II)","Acta Crystallographica Section E","2004","60","8","m1134","m1136","10.1107/S1600536804016915","","","0.71073","MoKα","","","0.0402","","","","0.10005","","","","","","0.992","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204066","29.7459","0.0006","11.2443","0.0002","8.8337","0.0002","90","","90","","90","","2954.6","0.1","293","1","","","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C16 H16 O3 S -","- C16 H16 O3 S -","- C128 H128 O24 S8 -","8","1","OB6382","Weiming Xu; Xiu-Rong Hu; Jian-Ming Gu","(Z)-1-Methoxy-1-phenyl-2-(4-toluenesulfonyl)ethene","Acta Crystallographica, Section E","2004","60","8","o1325","o1326","10.1107/S1600536804016356","","","0.7107","MoKα","","","0.047","","","","0.143","","","","","","1.003","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2204067","11.432","0.003","14.722","0.003","9.321","0.002","90","","113.32","0.003","90","","1440.6","0.6","293","2","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-amino-N-(2-chlorophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide","","- C15 H15 Cl N2 O S -","- C15 H15 Cl N2 O S -","- C60 H60 Cl4 N8 O4 S4 -","4","1","OB6383","Vasu; K. A. Nirmala; Deepak Chopra; S. Mohan; J.Saravanan","2-Amino-<i>N</i>-(2-chlorophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide","Acta Crystallographica Section E","2004","60","8","o1431","o1432","10.1107/S1600536804016575","","","0.71073","MoKα","","0.0604","0.0522","","","0.1351","0.1429","","","","","","1.055","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204068","17.882","0.006","7.494","0.003","18.596","0.006","90","","105.2","0.005","90","","2404.8","1.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","μ-1,5-Dicyanamido-bis[chloro(1,4,7-triazacyclononane)copper(II)] perchlorate","","- C14 H30 Cl3 Cu2 N9 O4 -","- C14 H30 Cl3 Cu2 N9 O4 -","- C56 H120 Cl12 Cu8 N36 O16 -","4","1","OB6384","Zhao-Dong Wang; Wei Han; Shi-Ping Yan; Dai-Zheng Liao; Zong-Hui Jiang; Peng Cheng","μ-1,5-Dicyanamido-bis[chloro(1,4,7-triazacyclononane)copper(II)] perchlorate","Acta Crystallographica Section E","2004","60","8","m1137","m1138","10.1107/S1600536804017076","","","0.71073","MoKα","","0.0776","0.0425","","","0.0918","0.1026","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204069","7.979","0.002","11.888","0.003","10.618","0.002","90","","111.21","0.01","90","","938.9","0.4","296","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C5 H11 N5 S2 -","- C5 H11 N5 S2 -","- C20 H44 N20 S8 -","4","1","OB6385","Tetsuzo Ito; Hiroshi Ohki; Takayuki Suyama","N^1^,N^1^-Dimethyl-N^5^-dithiocarboxybiguanide","Acta Crystallographica, Section E","2004","60","8","o1396","o1397","10.1107/S1600536804017775","","","0.7107","MoKα","","","0.0334","","","","0.0367","","","","","","1.713","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204070","6.934","0.009","8.103","0.008","15.1","0.02","95.92","0.04","102.76","0.05","98.04","0.04","811.4","1.7","296.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H13 Ag N2 O10 -","- C14 H13 Ag N2 O10 -","- C28 H26 Ag2 N4 O20 -","2","1","OB6386","Wang, Yue; Odoko, Mamiko; Okabe, Nobuo","(6-Carboxylatopyridine-2-carboxylic acid-κ^2^<i>N</i>,<i>O</i>)(pyridine-2,6-dicarboxylic acid-κ^2^<i>N</i>,<i>O</i>)silver(I) dihydrate","Acta Crystallographica Section E","2004","60","8","m1178","m1180","10.1107/S1600536804018033","","","0.7107","MoKα","","","0.025","","","","0.079","","","","","","1.106","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2204071","5.482","0.004","5.383","0.002","37.412","0.002","90","","91.5","0.02","90","","1103.6","0.9","296","1","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H40 Br2 -","- C20 H40 Br2 -","- C40 H80 Br4 -","2","0.5","OB6387","Naotake Nakamura; Akira Ohishi","1,20-Dibromoicosane","Acta Crystallographica Section E","2004","60","8","o1408","o1410","10.1107/S1600536804017556","","","1.5418","CuKα","","","0.038","","","","0.116","","","","","","1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204072","8.1435","0.0008","12.3788","0.0013","13.2782","0.0014","90","","95.332","0.002","90","","1332.7","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N'-Benzoyl-N-(o-cholorophenyl)thiourea","","- C14 H11 Cl N2 O S -","- C14 H11 Cl N2 O S -","- C56 H44 Cl4 N8 O4 S4 -","4","1","OB6388","M. Sukeri M. Yusof; Bohari M. Yamin","<i>N</i>-Benzoyl-<i>N</i>'-(2-chlorophenyl)thiourea","Acta Crystallographica Section E","2004","60","8","o1403","o1404","10.1107/S1600536804017544","","","0.71073","MoKα","","0.058","0.043","","","0.103","0.113","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204073","8.3813","0.0013","9.6623","0.0016","27.056","0.004","90","","90","","90","","2191.1","0.6","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","2-[4-(2-Hydroxyethyl)piperazin-1-yl]ethanesulfonic acid","2-[4-(2-Hydroxyethyl)piperazin-1-yl]ethanesulfonic acid","","- C8 H18 N2 O4 S -","- C8 H18 N2 O4 S -","- C64 H144 N16 O32 S8 -","8","1","OB6390","Fei Gao; Caixia Yin; Pin Yang; Gang Xue","2-[4-(2-Hydroxyethyl)piperazin-1-yl]ethanesulfonic acid","Acta Crystallographica, Section E","2004","60","8","o1327","o1328","10.1107/S1600536804016587","","","0.71073","MoKα","","0.0449","0.0406","","","0.1113","0.1146","","","","","","1.064","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2204074","15.559","0.003","11.1768","0.0019","23.057","0.004","90","","90","","90","","4009.6","1.2","193","2","193","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","3,3,7-trimethyl-9-(5,5-dimethyl-3-hydroxy-2-cyclohexene- 1-one-2-yl)-1-oxo-1,2,3,4,9,10-hexahydroxanthene","","- C24 H28 O4 -","- C24 H28 O4 -","- C192 H224 O32 -","8","1","OB6392","Yu-Ling Li; Xiang-Shan Wang; Da-Qing Shi; Shu-Jiang Tu; Yong Zhang","9-(2-Hydroxy-4,4-dimethyl-6-oxocyclohex-1-enyl)-3,3,7-trimethyl-1,2,3,4-hexahydro-9<i>H</i>-xanthen-1-one","Acta Crystallographica Section E","2004","60","8","o1439","o1441","10.1107/S1600536804018276","","","0.7107","MoKα","","0.0971","0.084","","","0.1611","0.1668","","","","","","1.258","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204075","7.649","0.001","9.332","0.001","14.725","0.002","74.34","0.01","75.77","0.01","71.16","0.01","943.2","0.2","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 9-amino-7-(4-methoxyphenyl)-7H-pyrano[3,2-c]coumarin-8-carboxylate","","- C22 H19 N O6 -","- C22 H19 N O6 -","- C44 H38 N2 O12 -","2","1","OB6393","Jing Wang; Daqing Shi; Xiangshan Wang","Ethyl 9-amino-7-(4-methoxyphenyl)-7<i>H</i>-pyrano[3,2-<i>c</i>]coumarin-8-carboxylate","Acta Crystallographica Section E","2004","60","8","o1401","o1402","10.1107/S1600536804017787","","","0.71073","MoKα","","0.0589","0.0371","","","0.0904","0.0948","","","","","","0.949","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204076","19.006","0.006","12.836","0.003","11.484","0.004","90","","107.764","0.007","90","","2668.1","1.4","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","6-chloro-3-(4-methylphenyl)-3,4-dihydroquinazolin-2(1H)-one","","- C15 H13 Cl N2 O -","- C15 H13 Cl N2 O -","- C120 H104 Cl8 N16 O8 -","8","1","OB6394","Daqing Shi; Chunling Shi; Zhengyi Li; Xiangshan Wang","6-Chloro-3-(<i>p</i>-tolyl)-3,4-dihydroquinazolin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2004","60","8","o1429","o1430","10.1107/S1600536804018124","","","0.7107","MoKα","","0.0707","0.065","","","0.1636","0.1689","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204077","10.5362","0.0006","6.5254","0.0002","10.6656","0.0004","90","","97.79","0.001","90","","726.52","0.05","296","1","","","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C19 H18 O -","- C19 H18 O -","- C38 H36 O2 -","2","0.5","OB6395","Xiu-Rong Hu; Jian-Ming Gu; Wei-Ming Xu","2,4-Dimethyl-1,5-diphenylpenta-1,4-dien-3-one","Acta Crystallographica Section E","2004","60","8","o1437","o1438","10.1107/S1600536804018021","","","0.7107","MoKα","","","0.034","","","","0.099","","","","","","1.008","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204078","10.14","0.0016","12.3079","0.0019","10.6624","0.0018","90","","110.95","0.012","90","","1242.7","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-[(2,4-Dinitrophenyl)hydrazono]butan-2-one oxime","","- C10 H11 N5 O5 -","- C10 H11 N5 O5 -","- C40 H44 N20 O20 -","4","1","RN6016","Hanife Saraçoĝlu; Ceyda Davran; Serkan Soylu; Ömer Andaç; Hümeyra Batı; Nezihe Çalışkan","3-[(2,4-Dinitrophenyl)hydrazono]butan-2-one oxime","Acta Crystallographica Section E","2004","60","8","o1307","o1309","10.1107/S1600536804015235","","","0.71069","MoKα","","0.0969","0.0496","","","0.1151","0.1322","","","","","","0.871","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204079","7.8173","0.0019","19.979","0.004","9.3411","0.0018","90","","91.004","0.009","90","","1458.7","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dichloro(N-cyclohexyl-N,N',N'-trimethylethylenediamine)copper(II)","","- C11 H24 Cl2 Cu N2 -","- C11 H24 Cl2 Cu N2 -","- C44 H96 Cl8 Cu4 N8 -","4","1","RN6018","Johansson, Anna; Hakansson, Mikael","Dichloro(<i>N</i>-cyclohexyl-<i>N,N</i>',<i>N</i>'-trimethylethylenediamine-κ^2^<i>N,N</i>')copper(II)","Acta Crystallographica Section E","2004","60","8","m1068","m1070","10.1107/S1600536804015909","","","0.71073","MoKα","","0.0587","0.0428","","","0.0997","0.1067","","","","","","1.07","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204080","10.423","0.003","16.223","0.003","13.244","0.003","90","","99.62","0.02","90","","2208","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","cis-Dibromobis(1,10-phenanthroline)manganese(II)","","- C24 H16 Br2 Mn N4 -","- C24 H16 Br2 Mn N4 -","- C96 H64 Br8 Mn4 N16 -","4","1","RN6019","Shen, Xiao-Ping; Yuan, Ai-Hua","<i>cis</i>-Dibromobis(1,10-phenanthroline)manganese(II)","Acta Crystallographica Section E","2004","60","8","m1074","m1075","10.1107/S1600536804015983","","","0.71073","MoKα","","0.0701","0.0477","","","0.0954","0.0993","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204081","7.229","0.003","13.112","0.005","19.334","0.007","90","","90","","90","","1832.6","1.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","11-Hydroxy-16,17-epoxypregn-4-ene-3,20-dione","","- C21 H28 O4 -","- C21 H28 O4 -","- C84 H112 O16 -","4","1","SU6093","Yongli Wang; Shi Wang; Hongxun Hao; Wei Chen; Qiang Nie","11-Hydroxy-16,17-epoxypregn-4-ene-3,20-dione","Acta Crystallographica, Section E","2004","60","8","o1337","o1338","10.1107/S1600536804012115","","","0.71073","MoKα","","0.0788","0.0467","","","0.0906","0.1015","","","","","","1.045","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204082","9.21","0.005","18.394","0.01","13.215","0.007","90","","109.657","0.008","90","","2108","2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H19 Cl2 N5 O3 Zn -","- C19 H19 Cl2 N5 O3 Zn -","- C76 H76 Cl8 N20 O12 Zn4 -","4","1","SU6118","Dong-Zhao, Gao; Shou-Rong, Zhu; Hua-Kuan, Lin","A new zinc(II) complex with a peptide ligand: aqua{<i>N,N</i>-bis[2-(2-pyridyl)methyl]pyridine-2,6-dicarboxamide}dichlorozinc(II)","Acta Crystallographica Section E","2004","60","8","m1038","m1039","10.1107/S1600536804015569","","","0.71073","MoKα","","0.0912","0.0543","","","0.1109","0.1245","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204083","12.8261","0.001","8.9942","0.0007","14.6896","0.0012","90","","104.217","0.001","90","","1642.7","0.2","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-(2,5-dioxo-2,5-dihydro-1H- pyrrol-1-yl)-1H-pyrazole-3-carbonitrile","","- C15 H5 Cl2 F3 N4 O2 -","- C15 H5 Cl2 F3 N4 O2 -","- C60 H20 Cl8 F12 N16 O8 -","4","1","SU6121","Yang, Zhiping; Zhong, Ping; Hu, Maolin","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-(2,5-dioxo-2,5-dihydro-1H- pyrrol-1-yl)-1H-pyrazole-3-carbonitrile","Acta Crystallographica, Section E","2004","60","8","o1350","o1351","10.1107/S1600536804016678","","","0.71073","MoKα","","0.0652","0.0552","","","0.1571","0.165","","","","","","1.056","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204084","4.805","0.001","12.047","0.002","14.666","0.003","114.06","0.03","90.4","0.03","101.19","0.03","756.9","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C7 H5 Br O3 -","- C7 H5 Br O3 -","- C28 H20 Br4 O12 -","4","2","SU6123","Liu, Zhao-Di; Qu, Yang; Tan, Min-Yu; Zhu, Hai-Liang","5-Bromosalicylic acid","Acta Crystallographica Section E","2004","60","8","o1310","o1311","10.1107/S1600536804016411","","","0.71073","MoKα","","0.0885","0.048","","","0.0952","0.1106","","","","","","0.949","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204085","8.3129","0.0011","11.2119","0.0015","10.2947","0.0014","90","","92.769","0.002","90","","958.4","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-3-Nitrobenzaldehyde O-acetyloxime","","- C9 H8 N2 O4 -","- C9 H8 N2 O4 -","- C36 H32 N8 O16 -","4","1","SU6124","Marco A. Brito-Arias; Efrén V. García-Báez; Gustavo Valencia del Toro; Herbert Höpfl","(<i>E</i>)-3-Nitrobenzaldehyde <i>O</i>-acetyloxime","Acta Crystallographica Section E","2004","60","8","o1451","o1452","10.1107/S1600536804018410","","","0.71073","MoKα","","0.0742","0.0612","","","0.1498","0.1576","","","","","","1.124","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204086","7.725","0.005","15.67","0.009","10.342","0.006","90","","90","","90","","1251.9","1.3","298","2","298","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","1,3-Bis(2-furylmethylidene)-3,4,5,6-tetrahydropyrimidin-2(1H)-one","","- C14 H14 N2 O3 -","- C14 H14 N2 O3 -","- C56 H56 N8 O12 -","4","0.5","SU6125","You, Zhong-Lu; Zhu, Hai-Liang","1,3-Bis(2-furylmethylidene)-3,4,5,6-tetrahydropyrimidin-2(1H)-one","Acta Crystallographica, Section E","2004","60","8","o1352","o1353","10.1107/S1600536804016927","","","0.71073","MoKα","","0.1125","0.0631","","","0.1471","0.1695","","","","","","0.911","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2204087","5.638","0.002","8.394","0.002","9.897","0.002","90","","90.61","0.03","90","","468.4","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","catena-Poly[[(2-amino-3-hydroxypropionato)nickel(II)]-μ-2-amino-3- hydroxypropionato]","","- C6 H12 N2 Ni O6 -","- C6 H12 N2 Ni O6 -","- C12 H24 N4 Ni2 O12 -","2","1","SU6126","Sun, Yu-Xi; You, Zhong-Lu","<i>catena</i>-Poly[[(2-amino-3-hydroxypropionato)nickel(II)]-μ-2-amino-3-hydroxypropionato]","Acta Crystallographica Section E","2004","60","8","m1199","m1201","10.1107/S1600536804018422","","","0.71073","MoKα","","0.0398","0.0366","","","0.0651","0.0666","","","","","","0.961","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204088","13.439","0.003","4.878","0.003","15.483","0.003","90","","97.05","0.03","90","","1007.3","0.7","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","2-Ammonio-3-phenylpropanoic acid‒monohydrogen sulfate‒2-ammonio-3-phenylpropanoate (1/1/1)","","- C18 H24 N2 O8 S -","- C18 H24 N2 O8 S -","- C36 H48 N4 O16 S2 -","2","1","SU6127","Sun, Yu-Xi; You, Zhong-Lu","2-Ammonio-3-phenylpropanoic acid‒monohydrogen sulfate‒2-ammonio-3-phenylpropanoate (1/1/1)","Acta Crystallographica Section E","2004","60","8","o1447","o1448","10.1107/S1600536804018434","","","0.71073","MoKα","","0.1221","0.0745","","","0.1392","0.1627","","","","","","0.948","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204089","12.178","0.002","14.414","0.003","23.357","0.005","90","","90","","90","","4099.9","1.4","100","2","","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C19 H13 F3 N3 O6 Re S -","- C19 H13 F3 N3 O6 Re S -","- C152 H104 F24 N24 O48 Re8 S8 -","8","1","TK6168","Kayode Oshin; Arthur M. Landis; Bradley W. Smucker; David M. Eichhorn; D. Paul Rillema","<i>fac</i>-Bipyridyltricarbonyl(pyridine)rhenium(I) trifluoromethanesulfonate","Acta Crystallographica Section E","2004","60","8","m1126","m1127","10.1107/S1600536804015016","","","0.71073","MoKα","","","0.033","","","","0.074","","","","","","1.03","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204090","8.5568","0.0014","13.822","0.002","23.295","0.004","90","","90.842","0.019","90","","2754.9","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2,4,2',4'-tetrabromo diphenyl ether","bis(2,4-dibromophenyl) ether","","- C12 H6 Br4 O -","- C12 H6 Br4 O -","- C96 H48 Br32 O8 -","8","2","TK6176","Eriksson, Lars; Eriksson, Johan; Hu, Jiwei","Bis(2,4-dibromophenyl) ether","Acta Crystallographica Section E","2004","60","8","o1424","o1426","10.1107/S1600536804017520","","","0.71073","MoKα","","0.07","0.029","","","0.044","0.05","","","","","","0.86","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204091","7.651","0.003","9.268","0.002","16.721","0.004","79.36","0.02","84.17","0.02","69.78","0.02","1092.6","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H20 N12 Ni O -","- C20 H20 N12 Ni O -","- C40 H40 N24 Ni2 O2 -","2","1","TK6177","Villanueva, Mónica; Urtiaga, M. Karmele; Mesa, José L.; Arriortua, M. Isabel","Diazidobis(2,2'-dipyridylamine)nickel(II) monohydrate","Acta Crystallographica Section E","2004","60","8","m1175","m1177","10.1107/S1600536804017532","","","0.7107","MoKα","","0.058","0.035","","","","0.093","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204092","6.4237","0.0018","13.445","0.004","14.054","0.004","90","","90","","90","","1213.8","0.6","273","2","273","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C9 H10 Br2 N2 O3 -","- C9 H10 Br2 N2 O3 -","- C36 H40 Br8 N8 O12 -","4","1","WK6020","Xiang Chao Zeng; Shi Hai Xu; Qin Ying Deng; Ji Wen Cai; Shu Hao Guo; Jian Gu; Dong Hong He","Methyl (4,5-dibromo-1-methyl-1<i>H</i>-pyrrole-2-carbonylamino)acetate","Acta Crystallographica Section E","2004","60","8","o1283","o1284","10.1107/S1600536804015491","","","0.71073","MoKα","","0.0363","0.0275","","","0.0649","0.0682","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204093","11.5621","0.0008","11.5621","0.0008","11.5621","0.0008","90","","90","","90","","1545.65","0.19","293","2","298","2","","","","","","","","5","P n -3 m :2","-P 4bc 2bc 3","224","Potassium/hydronium 12-Tungstophosphate","","","- H1.62 K2.46 O40.54 P W12 -","- K2.46 O40.54 P W12 -","- K4.92 O81.08 P2 W24 -","2","0.0416667","WM6022","Youjun Kang; Manrong Li; Jingtai Zhao; Shaoyu Mao","The Keggin-type potassium/hydronium 12-tungstophosphate, K~2.4~(H~3~O)~0.6~PO~4~W~12~O~36~","Acta Crystallographica Section E","2004","60","8","i97","i99","10.1107/S160053680401551X","","","0.71073","MoKα","","0.0445","0.0377","","","0.0878","0.0915","","","","","","1.149","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204094","7.1357","0.001","16.986","0.003","7.8957","0.0012","90","","90.585","0.002","90","","957","0.3","153","2","153","2","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","","","- Cu Se6 Sm3 -","- Cu Se6 Sm3 -","- Cu4 Se24 Sm12 -","4","1","WM6023","Ijjaali, Ismail; Ibers, James A.","An ordered polymorph of copper trisamarium hexaselenide, CuSm~3~Se~6~","Acta Crystallographica Section E","2004","60","8","i89","i90","10.1107/S1600536804015776","","","0.71073","MoKα","","0.05","0.0394","","","0.0968","0.1033","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204095","11.474","0.001","10.894","0.001","6.1885","0.0004","90","","90","","90","","773.55","0.11","11","0.5","11","0.5","","","","","","","","3","P n m a","-P 2ac 2n","62","Chromium hexacarbonyl","Hexacarbonylchromium(0)","","- C6 Cr O6 -","- C6 Cr O6 -","- C24 Cr4 O24 -","4","0.5","WM6024","Figgis, Brian N.; Sobolev, Alexandre N.","Hexacarbonylchromium(0) at 11K","Acta Crystallographica Section E","2004","60","8","i93","i94","10.1107/S1600536804016174","","","0.71073","MoKα","","0.0206","0.0199","","","0.0539","0.0543","","","","","","1.137","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204096","4.003","0.0003","13.7095","0.001","13.8146","0.001","90","","90","","90","","758.13","0.1","153","2","153","2","","","","","","","","4","C m c m","-C 2c 2","63","","Rubidium digadolinium copper tetrasulfide","","- Cu Gd2 Rb S4 -","- Cu Gd2 Rb S4 -","- Cu4 Gd8 Rb4 S16 -","4","0.25","WM6025","Yao, Jiyong; Ibers, James A.","RbGd~2~CuS~4~","Acta Crystallographica Section E","2004","60","8","i95","i96","10.1107/S1600536804016460","","","0.71073","MoKα","","0.02","0.0198","","","0.0582","0.0584","","","","","","1.403","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204097","24.02","0.02","10.563","0.009","16.41","0.014","90","","100.9","0.018","90","","4089","6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","3-(4-Chlorophenyl)-4-(O,O'-diethylphosphono)-2-phenylisoxazolidine","","- C19 H23 Cl N O4 P -","- C19 H23 Cl N O4 P -","- C152 H184 Cl8 N8 O32 P8 -","8","1","WN6248","Ye, Yong; Liu, Lun-Zu; Zhao, Yu-Fen","3-(4-Chlorophenyl)-4-(O,O'-diethylphosphono)-2-phenylisoxazolidine","Acta Crystallographica, Section E","2004","60","8","o1329","o1330","10.1107/S1600536804016599","","","0.71073","MoKα","","0.1775","0.0698","","","0.161","0.2112","","","","","","1.013","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2204098","9.884","0.003","9.924","0.003","11.738","0.003","94.267","0.005","91.985","0.004","116.676","0.004","1023","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-(4-methoxyphenyl)-1-phenyl-3-(p-toluenesulfonylamino)propan-1-one","","- C23 H23 N O4 S -","- C23 H23 N O4 S -","- C46 H46 N2 O8 S2 -","2","1","WN6259","Yu, Zhifang; Gu, Xiuyan; Zhao, Bing; Li, Yan","3-(4-Methoxyphenyl)-1-phenyl-3-(<i>p</i>-toluenesulfonylamino)propan-1-one","Acta Crystallographica Section E","2004","60","8","o1290","o1291","10.1107/S1600536804015661","","","0.71073","MoKα","","0.0805","0.05","","","0.111","0.1271","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204099","7.404","0.003","10.276","0.004","14.963","0.005","90","","90","","90","","1138.4","0.7","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","7-(4-Methylphenyl)pyrazolo[2,3-a]pyrimidine-3-carbonitrile","","- C14 H10 N4 -","- C14 H10 N4 -","- C56 H40 N16 -","4","1","WN6260","Li-Rong Wen; Shu-Wen Wang; Hai-Zhen Xu; Xiu-Li Zhang; Ming Li; Jin-Hong Liu","7-(4-Methylphenyl)pyrazolo[1,5-<i>a</i>]pyrimidine-3-carbonitrile","Acta Crystallographica Section E","2004","60","8","o1294","o1295","10.1107/S1600536804015673","","","0.71073","MoKα","","0.0514","0.0361","","","0.0807","0.0873","","","","","","1.063","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204100","18.531","0.005","13.431","0.003","24.043","0.004","90","","95.23","0.02","90","","5959","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","4,4,6,6-Tetrachloro-1',3'-[2,2'-(3-oxapentane-1,5-dioxy)dibenzyl]- 2λ^5^,4λ^5^,6λ^5^-cyclotriphosphazene-2-spiro-2'-1,3,2-diazaphospholane benzene hemisolvate","","- C23 H27 Cl4 N5 O3 P3 -","- C23 H27 Cl4 N5 O3 P3 -","- C184 H216 Cl32 N40 O24 P24 -","8","1","WN6263","Tercan, Barış; Hökelek, Tuncer; Bilge, Selen; Demiriz, Şemsay; Kılıç, Zeynel","4,4,6,6-Tetrachloro-1',3'-[2,2'-(3-oxapentane-1,5-dioxy)dibenzyl]- 2λ^5^,4λ^5^,6λ^5^-cyclotriphosphazene-2-spiro-2'-1,3,2-diazaphospholane benzene hemisolvate","Acta Crystallographica, Section E","2004","60","8","o1369","o1372","10.1107/S1600536804017118","","","1.54184","CuKα","","0.1042","0.0674","","","0.1717","0.197","","","","","","1.034","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204101","6.817","0.003","8.598","0.004","10.457","0.005","97.748","0.006","99.66","0.006","110.765","0.005","552.3","0.4","183","2","183","2","","","","","","","","4","P -1","-P 1","2","Methyl 2-[hydroxy(4-nitrophenyl)methyl]acrylate","Methyl 2-[hydroxy(4-nitrophenyl)methyl]acrylate","","- C11 H11 N O5 -","- C11 H11 N O5 -","- C22 H22 N2 O10 -","2","1","WN6264","Yin, Caixia; Huo, Fangjun; Yang, Pin","Methyl 2-[hydroxy(4-nitrophenyl)methyl]acrylate","Acta Crystallographica, Section E","2004","60","8","o1331","o1332","10.1107/S1600536804016605","","","0.71073","MoKα","","0.0608","0.0427","","","0.0984","0.1065","","","","","","0.962","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2204102","15.651","0.003","7.597","0.002","18.848","0.004","90","","90","","90","","2241","0.9","293","2","293","2","","","","","","","","6","P c c a","-P 2a 2ac","54","","Dichlorotetrakis(3-hydroxypyridine)cobalt(II)","","- C20 H20 Cl2 Co N4 O4 -","- C20 H20 Cl2 Co N4 O4 -","- C80 H80 Cl8 Co4 N16 O16 -","4","0.5","WN6266","Gao, Shan; Zhang, Xian-Fa; Huo, Li-Hua; Lu, Zhen-Zhong; Zhao, Hui; Zhao, Jing-Gui","Dichlorotetrakis(3-hydroxypyridine)cobalt(II)","Acta Crystallographica Section E","2004","60","8","m1128","m1130","10.1107/S160053680401712X","","","0.71073","MoKα","","0.055","0.038","","","0.09","0.098","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204103","37.557","0.005","5.3553","0.0006","12.3209","0.0015","90","","107.412","0.004","90","","2364.6","0.5","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1,1'-Bis(3-methoxybenzyl)-3,3'-methylenediimidazolium dibromide","","- C23 H25 Br2 N4 O2 -","- C23 H25 Br2 N4 O2 -","- C92 H100 Br8 N16 O8 -","4","0.5","WN6267","Lee, Hon Man; Chiu, Pei Ling","1,1'-Bis(3-methoxybenzyl)-3,3'-methylenediimidazolium dibromide","Acta Crystallographica, Section E","2004","60","8","o1384","o1385","10.1107/S160053680401757X","","","0.71073","MoKα","","0.0446","0.029","","","0.0696","0.0768","","","","","","1.003","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2204104","9.465","0.002","10.316","0.002","12.518","0.003","79.521","0.017","88.45","0.017","64.259","0.017","1080.8","0.4","293","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C23 H25 N3 O4 -","- C23 H25 N3 O4 -","- C46 H50 N6 O8 -","2","1","WN6269","Baumer, Vyacheslav N.; Kovalenko, Sergiy M.; Sytnyk, Kostyantyn M.; Chernykh, Valentyn P.","6-Hexyl-7-hydroxy-3-(3-phenyl-1<i>H</i>-1,2,4-triazol-5-yl)-2<i>H</i>-chromen-2-one monohydrate","Acta Crystallographica Section E","2004","60","8","o1417","o1418","10.1107/S1600536804018082","","","0.71073","MoKα","","","0.045","","","","0.099","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204105","9.613","0.004","11.759","0.005","16.571","0.007","90","","90","","90","","1873.1","1.4","293","2","293","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","2-[7-Fluoro-3,4-dihydro-4-(3-iodoprop-2-ynyl)-3-oxo-2H-1,4-benzoxazin-6-yl]- 4,5,6,7-tetrahydro-2H-isoindole-1,3-dione","","- C19 H14 F I N2 O4 -","- C19 H14 F I N2 O4 -","- C76 H56 F4 I4 N8 O16 -","4","1","WW6219","Hou, Zhong-Ke; Ren, Ye-Guo; Huang, Ming-Zhi; Song, Jian; Chen, Li-Gong","2-[7-Fluoro-3,4-dihydro-4-(3-iodoprop-2-ynyl)-3-oxo-2H-1,4-benzoxazin-6-yl]- 4,5,6,7-tetrahydro-2H-isoindole-1,3-dione","Acta Crystallographica, Section E","2004","60","8","o1335","o1336","10.1107/S160053680401637X","","","0.71073","MoKα","","0.0534","0.0299","","","","0.06","","","","","","0.989","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2204106","14.46","0.004","10.112","0.003","20.394","0.005","90","","91.459","0.005","90","","2981","1.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[(p-phenylenedioxy)diacetato]bis(2,2'-bipyridine)copper(II) tetrahydrate","","- C30 H32 Cu N4 O10 -","- C30 H32 Cu N4 O10 -","- C120 H128 Cu4 N16 O40 -","4","1","WW6234","Du, Miao; Cai, Hua; Zhao, Xiao-Jun","A two-dimensional hydrogen-bonding supramolecular architecture of bis(2,2'-bipyridine)[(<i>p</i>-phenylenedioxy)diacetato]copper(II) tetrahydrate","Acta Crystallographica Section E","2004","60","8","m1139","m1141","10.1107/S1600536804017064","","","0.71073","MoKα","","0.1331","0.054","","","0.1223","0.1504","","","","","","0.975","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204107","7.6985","0.0003","10.9638","0.0003","11.3244","0.0004","87.081","0.002","76.032","0.002","73.524","0.002","889.33","0.05","120","2","120","2","","","","","","","","5","P -1","-P 1","2","Methylene blue nitrate dihydrate","3,7-Bis(dimethylamino)phenothiazin-5-ium nitrate dihydrate","","- C16 H22 N4 O5 S -","- C16 H22 N4 O5 S -","- C32 H44 N8 O10 S2 -","2","1","WW6237","Savaridasson Jose Kavitha; Mani Mohan Raj; Krishnaswamy Panchanatheswaran; Daniel E. Lynch","3,7-Bis(dimethylamino)phenothiazin-5-ium nitrate dihydrate","Acta Crystallographica, Section E","2004","60","8","o1366","o1368","10.1107/S1600536804017222","","","0.71073","MoKα","","0.0854","0.0682","","","0.1963","0.2055","","","","","","1.129","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2204108","9.379","0.002","11.655","0.003","7.322","0.003","90","","105.31","0.03","90","","772","0.4","298.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H14 Cl2 N2 O2 -","- C16 H14 Cl2 N2 O2 -","- C32 H28 Cl4 N4 O4 -","2","0.5","WW6240","Kubono, Koji; Kazumasa, Kushida; Yokoi, Kunihiko","N,N'-Bis(5-chlorosalicylidene)ethane-1,2-diamine","Acta Crystallographica, Section E","2004","60","8","o1382","o1383","10.1107/S1600536804017052","","","0.7107","MoKα","","","0.042","","","","0.132","","","","","","0.978","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204109","14.535","0.003","5.34","0.001","9.731","0.002","90","","90","","90","","755.3","0.3","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","catena-Poly[[diaquamanganese(II)]-μ-iminodiacetato-κ^4^O,N,O':O'']","","- C4 H9 Mn N O6 -","- C4 H7 Mn N O6 -","- C16 H28 Mn4 N4 O24 -","4","1","WW6246","Zhang, Quan-Zheng; Lu, Can-Zhong","<i>catena</i>-Poly[[diaquamanganese(II)]-μ-iminodiacetato-κ^4^<i>O,N,O</i>':<i>O</i>'']","Acta Crystallographica Section E","2004","60","08","m1189","m1190","10.1107/S1600536804017908","","","0.71073","MoKα","","0.0179","0.0176","","","0.0465","0.0466","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204110","16.612","0.009","18.311","0.009","12.598","0.007","90","","90","","90","","3832","4","295","2","295","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","Di-μ-hydroxo-[(N,N,N',N'-tetramethylethylenediamine)copper(II)] dichloride","","- C12 H34 Cl2 Cu2 N4 O2 -","- C12 H34 Cl2 Cu2 N4 O2 -","- C96 H272 Cl16 Cu16 N32 O16 -","8","0.25","YA6211","Dmitry V. Albov; Dmitry V. Davydov; Vladimir V. Chernyshev","Di-μ-hydroxo-bis[(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine)copper(II)] dichloride from X-ray powder data","Acta Crystallographica Section E","2004","60","8","m1193","m1195","10.1107/S1600536804018264","","","1.5406","CuKα~1~","","","","","","","","","","3.702","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204111","15.202","0.005","11.241","0.004","12.268","0.004","90","","90","","90","","2096.4","1.2","293","2","293","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","Bis(2-aminoethyl-1H-benzimidazole-κN^3^)chlorocopper(II) perchlorate","","- C18 H22 Cl2 Cu N6 O4 -","- C18 H22 Cl2 Cu N6 O4 -","- C72 H88 Cl8 Cu4 N24 O16 -","4","0.5","YA6212","Hai-Yan, Zhao; Xiao-Hang, Qiu; Pan-Wen, Shen","Bis(2-aminoethyl-1<i>H</i>-benzimidazole-κ<i>N</i>^3^)chlorocopper(II) perchlorate","Acta Crystallographica Section E","2004","60","8","m1111","m1113","10.1107/S1600536804016332","","","0.71073","MoKα","","0.05","0.03","","","0.07","0.079","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204112","6.372","0.002","8.184","0.003","8.649","0.003","72.349","0.005","81.745","0.006","80.865","0.005","422.2","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2,5-bis(1-piperidinylmethyl)benzene-1,4-diol","","- C18 H28 N2 O2 -","- C18 H28 N2 O2 -","- C18 H28 N2 O2 -","1","0.5","YA6213","Dongyan Yuan; Mingjie Zhang; Zhaohui Pan; Penggao Ma","2,5-Bis(1-piperidinylmethyl)benzene-1,4-diol","Acta Crystallographica, Section E","2004","60","8","o1320","o1321","10.1107/S1600536804016344","","","0.71073","MoKα","","0.084","0.051","","","0.113","0.128","","","","","","1.06","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2204113","9.8997","0.0006","10.5514","0.0006","13.739","0.001","90","","103.613","0.003","90","","1394.8","0.16","133","2","133","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","1-phosphoramido-2-aminobenzimidazole","1-(N,N,N',N'-Tertramethylphosphoramido)-2-aminobenz[d]imidazole","","- C11 H18 N5 O P -","- C11 H18 N5 O P -","- C44 H72 N20 O4 P4 -","4","1","AC6108","Raouafi, NourEddine; Freytag, Matthias; Jones, Peter G.; BenKhoud, Mohamed Lamine","2-Amino-1-[bis(<i>N</i>,<i>N</i>-dimethylamino)phosphoramido]benzimidazole","Acta Crystallographica Section E","2004","60","9","o1583","o1585","10.1107/S1600536804020161","","","0.71073","MoKα","","0.0452","0.0353","","","0.0969","0.1023","","","","","","1.054","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204114","7.2089","0.0001","11.6317","0.0002","26.3219","0.0005","90","","90","","90","","2207.14","0.06","150","1","150","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(7S)-N-(4-Phenyltricyclo[4.2.1.0^2,5^]non-3-ene-3-carbonyl)-2,10-camphorsultam","","- C26 H31 N O3 S -","- C26 H31 N O3 S -","- C104 H124 N4 O12 S4 -","4","1","AC6109","Lough, Alan J.; Villeneuve, Karine; Tam, William","(7<i>S</i>)-<i>N</i>-(4-Phenyltricyclo[4.2.1.0^2,5^]non-3-ene-3-carbonyl)-2,10-camphorsultam","Acta Crystallographica Section E","2004","60","9","o1566","o1567","10.1107/S1600536804019804","","","0.71073","MoKα","","0.0584","0.0415","","","0.0957","0.1035","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204115","16.699","0.003","6.0327","0.0012","18.977","0.004","90","","107.06","0.03","90","","1827.6","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","catena-Poly[[aquabis(1H-imidazole-κN^3^)copper(II)]-μ- benzene-1,4-dioxyacetato-κ^2^O:O']","Catena-poly[aquabis(1H-imidazole-κN^3^)copper(II)-μ-benzene- phenylenedioxydiacetato-κ^2^O,O']","","- C16 H18 Cu N4 O7 -","- C16 H18 Cu N4 O7 -","- C64 H72 Cu4 N16 O28 -","4","1","AC6110","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui; Zhao, Jing-Gui","<i>catena</i>-Poly[[aquabis(1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II)]-μ-benzene-1,4-dioxyacetato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2004","60","9","m1267","m1269","10.1107/S1600536804019798","","","0.71073","MoKα","","0.093","0.054","","","0.099","0.109","","","","","","1.05","","","","has coordinates,has Fobs","194596","2020-10-21","18:00:00",""
"2204116","13.659","0.002","16.16","0.002","9.5621","0.0014","90","","102.561","0.003","90","","2060.1","0.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-{3-Isopropoxy-4-methoxy-2-[(E)-1-propenyl]benzyl}(phenyl)methanesulfonamide","","- C21 H27 N O4 S -","- C21 H27 N O4 S -","- C84 H108 N4 O16 S4 -","4","1","AC6112","Otterlo, Willem A. L. van; Panayides, Jenny-Lee; Fernandes, Manuel A.","<i>N</i>-{3-Isopropoxy-4-methoxy-2-[(<i>E</i>)-1-propenyl]benzyl}(phenyl)methanesulfonamide","Acta Crystallographica Section E","2004","60","9","o1586","o1588","10.1107/S1600536804020379","","","0.71073","MoKα","","0.0632","0.048","","","0.1276","0.1354","","","","","","1.043","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204117","17.738","0.003","9.218","0.002","9.216","0.001","90","","90","","90","","1506.9","0.4","296","","","","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C4 H12 O4 P2 Pb S4 -","- C4 H12 O4 P2 Pb S4 -","- C16 H48 O16 P8 Pb4 S16 -","4","0.5","AC6113","Tetsuzo Ito; Yoshinori Maeda","Linear-chain bis(μ-<i>O,O</i>'-dimethyl dithiophosphato)lead(II)","Acta Crystallographica Section E","2004","60","9","m1349","m1350","10.1107/S1600536804020914","","","0.7107","MoKα","","","0.029","","","","0.028","","","","","","1.261","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204118","15.41","0.03","15.41","0.03","8.617","0.012","90","","90","","120","","1772","5","273","2","273","2","","","","","","","","6","P 32","P 32","145","","Dibromo[2,2',3,3'-tetrahydro-3,3'-bis(4-methoxylbenzyl)-1,1'-methylenedi- 1H-imidazole-κ^2^C^2^,C^2'^]palladium(II)","","- C23 H24 Br2 N4 O2 Pd -","- C23 H24 Br2 N4 O2 Pd -","- C69 H72 Br6 N12 O6 Pd3 -","3","1","BR6157","Lee, Hon Man; Chiu, Pei Ling","Dibromo[2,2',3,3'-tetrahydro-3,3'-bis(4-methoxybenzyl)-1,1'-methylenedi-1<i>H</i>-imidazole-κ^2^<i>C</i>^2^,<i>C</i>^2'^]palladium(II)","Acta Crystallographica Section E","2004","60","9","m1276","m1277","10.1107/S1600536804018574","","","0.71073","MoKα","","0.0696","0.0518","","","0.1069","0.1131","","","","","","1.015","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204119","10.5408","0.0009","11.5054","0.001","11.6538","0.001","61.951","0.001","75.18","0.001","87.642","0.001","1200.64","0.18","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Bis[μ-bis(2,6-di-1-naphthylphenyl)phosphanido]bis[(tetrahydrofuran)sodium(I)]","","- C60 H52 Na2 O2 P2 -","- C60 H52 Na2 O2 P2 -","- C60 H52 Na2 O2 P2 -","1","0.5","BR6158","Rabe, Gerd W.; Riederer, Florian A.; Incarvito, Christopher D.; Golen, James A.; Rheingold, Arnold L.","Bis[μ-bis(2,6-di-1-naphthylphenyl)phosphanido]bis[(tetrahydrofuran)sodium(I)]","Acta Crystallographica Section E","2004","60","9","m1264","m1266","10.1107/S1600536804019361","","","0.71073","MoKα","","0.0672","0.0532","","","0.1432","0.1542","","","","","","1.022","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204120","7.9192","0.0002","11.1648","0.0003","12.4204","0.0004","90","","90","","90","","1098.17","0.05","183","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3-ferrocenylprop-2-enal","","- C13 H12 Fe O -","- C13 H12 Fe O -","- C52 H48 Fe4 O4 -","4","1","BR6159","Imhof, Wolfgang","3-Ferrocenylprop-2-enal","Acta Crystallographica Section E","2004","60","9","m1234","m1236","10.1107/S1600536804019129","","","0.71073","MoKα","","0.0179","0.0174","","","0.0506","0.0512","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204121","10.0022","0.0001","20.6821","0.0003","13.732","0.0002","90","","106.09","0.001","90","","2729.41","0.06","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","fac-(bromo/chloro)tricarbonyl[1,3-bis(diphenylphosphino)propane]manganese(I)","","- C30 H26 Br0.3 Cl0.7 Mn O3 P2 -","- C30 H26 Br0.3 Cl0.7 Mn O3 P2 -","- C120 H104 Br1.2 Cl2.8 Mn4 O12 P8 -","4","1","BR6160","Light, Mark E.; Hursthouse, Michael B.; Beckett, Michael A.; Brassington, David S.","A mixed-halogen tricarbonylmanganese(I) complex: <i>fac</i>-[MnBr~0.3~Cl~0.7~{Ph~2~P(CH~2~)~3~PPh~2~}(CO)~3~]","Acta Crystallographica Section E","2004","60","9","m1245","m1247","10.1107/S1600536804019385","","","0.71073","MoKα","","0.0274","0.025","","","0.0627","0.064","","","","","","1.013","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2204122","3.9451","0.0011","13.915","0.004","16.408","0.005","90","","90","","90","","900.7","0.5","153","2","153","2","","","","","","","","4","C m c m","-C 2c 2","63","","rubidium diholmium tricopper pentasulfide","","- Cu3 Ho2 Rb S5 -","- Cu3 Ho2 Rb S5 -","- Cu12 Ho8 Rb4 S20 -","4","0.25","BR6161","Yao, Jiyong; Ibers, James A.","RbHo~2~Cu~3~S~5~","Acta Crystallographica Section E","2004","60","9","i118","i119","10.1107/S1600536804019786","","","0.71073","MoKα","","0.023","0.0226","","","0.0537","0.0539","","","","","","1.389","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204123","22.283","0.0007","7.6818","0.0003","16.1127","0.0003","90","","120.63","0.002","90","","2373.25","0.14","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaquatetrakis(1H-imidazole-κN^3^)cobalt(II) terephthalate","","- C20 H24 Co N8 O6 -","- C20 H24 Co N8 O6 -","- C80 H96 Co4 N32 O24 -","4","0.5","BR6162","Zhang, Quan-Zheng; Lu, Can-Zhong","Diaquatetrakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)cobalt(II) terephthalate","Acta Crystallographica Section E","2004","60","9","m1289","m1290","10.1107/S1600536804020069","","","0.71073","MoKα","","0.0575","0.0438","","","0.1151","0.1327","","","","","","1.079","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204124","7.7036","0.0015","9.962","0.002","14.548","0.003","82.6","0.03","78.23","0.03","82.77","0.03","1078.2","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-poly[[tris(1H-imidazole-κN^3^)cadmium(II)]-μ-benzene-1,4-dioxyacetato- κ^3^O,O':O'']","","- C19 H20 Cd N6 O6 -","- C19 H20 Cd N6 O6 -","- C38 H40 Cd2 N12 O12 -","2","1","BR6164","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui; Zhao, Jing-Gui","A one-dimensional chain Cd^II^ polymer: <i>catena</i>-poly[[tris(1<i>H</i>-imidazole-κ<i>N</i>^3^)cadmium(II)]-μ-benzene-1,4-dioxyacetato-κ^3^<i>O,O</i>':<i>O</i>'']","Acta Crystallographica Section E","2004","60","9","m1308","m1310","10.1107/S1600536804020409","","","0.71073","MoKα","","0.032","0.027","","","0.062","0.064","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204125","13.023","0.0004","8.947","0.0003","12.435","0.0003","90","","106.967","0.002","90","","1385.82","0.07","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","zinc","Dichlorobis(1,3-dimethylthiourea-κS)zinc(II)","","- C6 H16 Cl2 N4 S2 Zn -","- C6 H16 Cl2 N4 S2 Zn -","- C24 H64 Cl8 N16 S8 Zn4 -","4","0.5","BT6489","Burrows, Andrew D.; Harrington, Ross W.; Mahon, Mary F.","Dichlorobis(1,3-dimethylthiourea-κ<i>S</i>)zinc(II)","Acta Crystallographica Section E","2004","60","9","m1317","m1318","10.1107/S1600536804020550","","","0.7107","MoKα","","0.0319","0.0281","","","0.0655","0.0671","","","","","","1.135","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204126","7.8525","0.0007","7.8036","0.0005","20.4482","0.0012","90","","90","","90","","1253.02","0.16","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1α,2β,3α,6β)-3,6-Dichlorocyclohex-4-ene-1,2-diyl diacetate","","- C10 H12 Cl2 O4 -","- C10 H12 Cl2 O4 -","- C40 H48 Cl8 O16 -","4","1","BT6494","Mehmet Akkurt; Sema Öztürk; Arif Baran; Hasan Seçen; Orhan Büyükgüngör","(1α,2β,3α,6β)-3,6-Dichlorocyclohex-4-ene-1,2-diyl diacetate","Acta Crystallographica Section E","2004","60","9","o1453","o1455","10.1107/S1600536804018525","","","0.71073","MoKα","","0.0551","0.0486","","","0.1385","0.1447","","","","","","1.046","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204127","11.384","0.0012","21.504","0.002","10.1728","0.0011","90","","103.437","0.003","90","","2422.1","0.4","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-{[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridyl]phenylmethyl}-6,6- pentamethylene-2-phenyl-1,3-dioxa-4-aza-2-boracyclohexane","","- C27 H31 B N2 O4 -","- C27 H31 B N2 O4 -","- C108 H124 B4 N8 O16 -","4","1","BT6498","Kliegel, Wolfgang; Barakat, Mohamed; Jones, Peter G.","Phenylboronate of an <i>N</i>-hydroxy-<i>N</i>-(2-hydroxyalkyl)pyridoxamine","Acta Crystallographica Section E","2004","60","9","o1589","o1592","10.1107/S1600536804020434","","","0.71073","MoKα","","0.0582","0.0415","","","0.1136","0.1218","","","","","","1.089","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204128","10.6757","0.001","7.7798","0.0009","21.919","0.002","90","","99.14","0.01","90","","1797.4","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-Amino-3-anilino-N-(chlorophenyl)-1H-pyrazole-4-carboxamide ethanol solvate","","- C18 H20 Cl N5 O2 -","- C18 H20 Cl N5 O2 -","- C72 H80 Cl4 N20 O8 -","4","1","BT6501","Elgemeie, Galal H.; Jones, Peter G.","5-Amino-3-anilino-<i>N</i>-(chlorophenyl)-1<i>H</i>-pyrazole-4-carboxamide ethanol solvate","Acta Crystallographica Section E","2004","60","9","o1616","o1618","10.1107/S1600536804020689","","","0.71073","MoKα","","0.0521","0.0346","","","0.0778","0.0829","","","","","","0.934","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204129","6.7439","0.0001","8.2016","0.0001","8.2846","0.0002","114.052","0.001","95.798","0.001","107.406","0.001","385.992","0.013","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","Bis(μ-N,N-dimethylhydrazido-κ^2^N':N')bis[dimethylgallium(III)]","","- C8 H26 Ga2 N4 -","- C8 H26 Ga2 N4 -","- C8 H26 Ga2 N4 -","1","0.5","BT6502","Hecht, Elmar","Bis(μ-<i>N,N</i>-dimethylhydrazido-κ^2^<i>N</i>':<i>N</i>')bis[dimethylgallium(III)]","Acta Crystallographica Section E","2004","60","9","m1327","m1328","10.1107/S160053680402080X","","","0.71073","MoKα","","0.0373","0.032","","","0.0772","0.0795","","","","","","1.072","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204130","3.8501","0.0001","11.4482","0.0003","13.0504","0.0003","109.841","0.001","92.9891","0.0009","99.2004","0.001","530.59","0.02","90","0.2","90","0.2","","","","","","","","3","P -1","-P 1","2","","2,4,5-Trichlorobiphenyl","","- C12 H7 Cl3 -","- C12 H7 Cl3 -","- C24 H14 Cl6 -","2","1","BT6503","Kania-Korwel, Izabela; Parkin, Sean; Robertson, Larry W.; Lehmler, Hans-Joachim","2,4,5-Trichlorobiphenyl","Acta Crystallographica Section E","2004","60","9","o1652","o1653","10.1107/S1600536804020975","","","0.71073","MoKα","","0.0322","0.0256","","","0.0598","0.0629","","","","","","1.074","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204131","13.53","0.004","10.987","0.004","11.916","0.003","90","","90","","90","","1771.4","0.9","174.2","","","","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- C20 H24 Br2 -","- C20 H24 Br2 -","- C80 H96 Br8 -","4","0.5","CF6350","Hemamala Karunadasa; Christina Leggett; Shaun Wong","2,2'-Dibromo-3,3',4,4',5,5',6,6'-octamethyl-1,1'-biphenyl","Acta Crystallographica Section E","2004","60","9","o1499","o1500","10.1107/S160053680401709X","","","0.7107","MoKα","","","0.0377","","","","0.0499","","","","","","1.85","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204132","7.623","0.0002","7.623","0.0002","33.8174","0.001","90","","90","","90","","1965.13","0.09","150","","150","","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","(1R,2R,3S,6S,7S,7aR)-3-Hydroxymethyl-1,2,6,7- tetrahydroxypyrrolizidine monohydrate or (2S,3R,4R,5R,6S,7S)-2-Hydroxymethyl- 1-azabicyclo[3.3.0]-octan-3,4,6,7-tetraol monohydrate","","- C8 H17 N O6 -","- C8 H17 N O6 -","- C64 H136 N8 O48 -","8","1","CF6365","Christopher Newton; Jeroen van Ameijde; George W. J. Fleet; Robert J. Nash; Watkin, David J.","3-<i>epi</i>-Casuarine monohydrate","Acta Crystallographica Section E","2004","60","9","o1463","o1464","10.1107/S1600536804018665","","","0.71073","MoKα","","0.0469","0.0469","","0.0723","0.0723","0.0723","","","","","","1.0139","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204133","13.756","0.004","15.667","0.004","17.934","0.004","90","","90","","90","","3865.1","1.7","110","2","110","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","octa-O-acetyl-α,α-trehalose","octa O-acetyl α-D-glucopyranosyl α-D-glycopyranoside","","- C32 H50 O21 -","- C32 H50 O21 -","- C128 H200 O84 -","4","1","CF6368","Färnbäck, Magnus; Eriksson, Lars; Widmalm, Göran","Octa-<i>O</i>-acetyl-α,α-trehalose ethanol disolvate","Acta Crystallographica Section E","2004","60","9","o1483","o1485","10.1107/S1600536804018707","","","0.891","synchrotron","","0.0624","0.0435","","","0.1104","0.1123","","","","","","0.946","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204134","17.848","0.004","16.863","0.003","9.485","0.003","90","","108.79","0.01","90","","2702.6","1.2","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[[silver(I)-μ-4,4'-bipyridine-μ-formato] monohydrate formic acid solvate]","","- C12 H13 Ag N2 O5 -","- C12 H12 Ag N2 O5 -","- C96 H96 Ag8 N16 O40 -","8","1","CI6401","Zhang, Deng-Qing; Zhang, Wen-Hua; Xu, Qing-Feng; Lang, Jian-Ping; Ng, Seik Weng","Poly[[silver(I)-μ-4,4'-bipyridine-μ-formato] monohydrate formic acid solvate]","Acta Crystallographica Section E","2004","60","9","m1256","m1258","10.1107/S1600536804019221","","","0.71073","MoKα","","0.0815","0.0704","","","0.1321","0.1358","","","","","","1.374","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2204135","9.935","0.001","10.072","0.001","34.987","0.007","90","","90","","90","","3501","0.9","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","6-ethenyldecahydro-5-hydroxy-4,6,9,10-tetramethyl-1-oxo- 3a,9-propano-3aH-cyclopentacycloocten-8-yl [2-(diethylammonio)ethylsulfanyl]acetate (E)-3-carboxyprop-2-enoate methanol solvate","","- C33 H55 N O9 S -","- C33 H55 N O9 S -","- C132 H220 N4 O36 S4 -","4","1","CI6411","Xiao-Ji Cao; Cui-Rong Sun; Yuan-Jiang Pan","Tiamulin‒hydrogen fumarate‒methanol (1/1/1)","Acta Crystallographica Section E","2004","60","9","o1546","o1548","10.1107/S1600536804019713","","","0.71073","MoKα","","0.0672","0.0381","","","0.0792","0.0849","","","","","","0.837","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204136","5.0372","0.0002","17.1314","0.0007","9.2598","0.0004","90","","99.476","0.002","90","","788.16","0.06","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1-Carboxymethylthymine","5-methyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-3-acetic acid","","- C7 H8 N2 O4 -","- C7 H8 N2 O4 -","- C28 H32 N8 O16 -","4","1","CI6412","Liu, Miao-Chang; Wen Feng; Ding, Jin-Chang","1-(Carboxymethyl)thymine","Acta Crystallographica Section E","2004","60","9","o1611","o1612","10.1107/S1600536804019580","","","0.71073","MoKα","","0.0462","0.0425","","","0.1036","0.1066","","","","","","1.111","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204137","4.9515","0.0004","11.725","0.002","14.931","0.002","78","0.01","83.75","0.01","82.45","0.01","837.6","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Bis(β-alanine) hydrogen picrate","hydrogen picrate bis(β-alanine)","","- C12 H17 N5 O11 -","- C12 H17 N5 O11 -","- C24 H34 N10 O22 -","2","1","CI6413","K. Anitha; B. Sridhar; R. K. Rajaram","β-Alanine β-alaninium picrate","Acta Crystallographica Section E","2004","60","9","o1630","o1632","10.1107/S1600536804019853","","","0.71073","MoKα","","0.0937","0.0601","","","0.1689","0.1926","","","","","","1.034","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204138","9.9714","0.0013","6.293","0.0005","12.648","0.0009","90","","110.5","0.01","90","","743.4","0.13","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","L-valinium picrate","L-valinium picrate","","- C11 H14 N4 O9 -","- C11 H14 N4 O9 -","- C22 H28 N8 O18 -","2","1","CI6414","K. Anitha; B. Sridhar; R. K. Rajaram","<small>L</small>-Valinium picrate","Acta Crystallographica Section E","2004","60","9","o1530","o1532","10.1107/S160053680401949X","","","0.71073","MoKα","","0.048","0.0398","","","0.1117","0.1168","","","","","","1.157","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204139","6.2362","0.0013","12.521","0.003","9.2553","0.0019","90","","107.038","0.004","90","","691","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diammonium hexaaquacobalt(II) bis(sulfate)","","- Co H20 N2 O14 S2 -","- Co H20 N2 O14 S2 -","- Co2 H40 N4 O28 S4 -","2","0.5","CI6415","Li, Xin-Hua; Li, Zu-Guang","Diammonium hexaaquacobalt(II) bis(sulfate)","Acta Crystallographica Section E","2004","60","9","i114","i115","10.1107/S1600536804018872","","","0.71073","MoKα","","0.0344","0.0308","","","0.0716","0.0731","","","","","","1.048","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204140","9.126","0.002","11.102","0.002","23.411","0.002","90","","93.707","0.003","90","","2367","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(2-aminopyridine-κN^1^)bis(2-fluorobenzoato-κO)zinc(II)","","- C24 H20 F2 N4 O4 Zn -","- C24 H20 F2 N4 O4 Zn -","- C96 H80 F8 N16 O16 Zn4 -","4","1","CI6416","Yang, Hai-Lang; You, Zhong-Lu; Zhu, Hai-Liang","Bis(2-aminopyridine-κ<i>N</i>^1^)bis(2-fluorobenzoato-κ<i>O</i>)zinc(II)","Acta Crystallographica Section E","2004","60","9","m1213","m1214","10.1107/S1600536804018884","","","0.71073","MoKα","","0.0511","0.0416","","","0.1175","0.1258","","","","","","1.02","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2204141","11.379","0.002","12.971","0.003","10.158","0.002","90","","103.9","0.03","90","","1455.4","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(2-aminopyridine-κ^1^)silver(I) hexafluoroarsenate","","- C10 H12 Ag As F6 N4 -","- C10 H12 Ag As F6 N4 -","- C40 H48 Ag4 As4 F24 N16 -","4","0.5","CI6417","Yang, Hai-Lang; You, Zhong-Lu; Zhu, Hai-Liang","Bis(2-aminopyridine-κ<i>N</i>^1^)silver(I) hexafluoroarsenate","Acta Crystallographica Section E","2004","60","9","m1215","m1217","10.1107/S1600536804018896","","","0.71073","MoKα","","0.0442","0.0369","","","0.0955","0.0985","","","","","","1.082","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204142","9.9542","0.0006","8.8479","0.0006","21.223","0.001","90","","102.263","0.001","90","","1826.54","0.19","113","2","113","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","[5-Bromo-N-(2-pyridylethylsulfanylethyl)salicylideneiminato- κ^4^N,N',O,S]copper(II) perchlorate","","- C16 H16 Br Cl Cu N2 O5 S -","- C16 H16 Br Cl Cu N2 O5 S -","- C64 H64 Br4 Cl4 Cu4 N8 O20 S4 -","4","1","CI6418","Saghatforoush, Lotf A.; Hossaini Sadr, Moayad; Lewis, William; Wikaira, Jan; Robinson, Ward T.; Ng, Seik Weng","[5-Bromo-<i>N</i>-(2-pyridylethylsulfanylethyl)salicylideneiminato-κ^4^<i>N</i>,<i>N</i>',<i>O</i>,<i>S</i>]copper(II) perchlorate","Acta Crystallographica Section E","2004","60","9","m1259","m1260","10.1107/S1600536804019403","","","0.71073","MoKα","","0.078","0.039","","","0.092","0.107","","","","","","0.99","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204143","8.9625","0.0003","13.214","0.0005","13.9889","0.0005","90","","90.052","0.001","90","","1656.71","0.1","113","2","113","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bromotetrakis(1H-imidazole-κN^3^)copper(II) bromide","","- C12 H16 Br2 Cu N8 -","- C12 H16 Br2 Cu N8 -","- C48 H64 Br8 Cu4 N32 -","4","1","CI6419","Hossaini Sadr, Moayad; Zare, Davood; Lewis, William; Wikaira, Jan; Robinson, Ward T.; Ng, Seik Weng","Bromotetrakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II) bromide","Acta Crystallographica Section E","2004","60","9","m1324","m1326","10.1107/S1600536804019609","","","0.71073","MoKα","","0.0577","0.0534","","","0.1618","0.1677","","","","","","1.065","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204144","13.298","0.001","19.333","0.003","5.359","0.0005","90","","90","","90","","1377.7","0.3","295","2","295","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Diaqua(napthalene-2,7-disulfonato)barium(II)","","- C10 H10 Ba O8 S2 -","- C10 H10 Ba O8 S2 -","- C40 H40 Ba4 O32 S8 -","4","1","CI6420","Huo, Li-Hua; Gao, Shan; Xu, Shi-Xiao; Zhao, Hui; Ng, Seik Weng","Polymeric diaqua(naphthalene-2,7-disulfonato)barium(II)","Acta Crystallographica Section E","2004","60","9","m1240","m1241","10.1107/S1600536804019348","","","0.71073","MoKα","","0.035","0.028","","","0.06","0.063","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204145","30.983","0.006","4.92","0.001","9.981","0.002","90","","90","","90","","1521.5","0.5","295","2","295","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","1-Carboxymethyl-3-hydroxypyridinium chloride‒3-hydroxypyridinium-1-acetate (1/1)","","- C14 H15 Cl N2 O6 -","- C14 H15 Cl N2 O6 -","- C56 H60 Cl4 N8 O24 -","4","1","CI6421","Zhao, Hui; Huo, Li-Hua; Gao, Shan; Zhang, Zhu-Yan; Zhao, Jing-Gui; Ng, Seik Weng","1-Carboxymethyl-3-hydroxypyridinium chloride‒3-hydroxypyridinium-1-acetate (1/1)","Acta Crystallographica Section E","2004","60","9","o1501","o1503","10.1107/S1600536804018938","","","0.71073","MoKα","","0.035","0.033","","","0.087","0.09","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204146","11.323","0.001","18.517","0.002","41.438","0.004","90","","90","","90","","8688.2","1.5","295","2","295","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","catena-Poly[[[bis(1H-imidazole-κN^3^)zinc(II)]-μ-1,4- phenylenedioxydiacetatoκ^2^O:O'] tetrahydrate]","","- C16 H24 N4 O10 Zn -","- C16 H24 N4 O10 Zn -","- C256 H384 N64 O160 Zn16 -","16","0.5","CI6422","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","<i>catena</i>-Poly[[[bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)zinc(II)]-μ-1,4-phenylenedioxydiacetato-κ^2^<i>O</i>:<i>O</i>'] tetrahydrate]","Acta Crystallographica Section E","2004","60","9","m1329","m1330","10.1107/S1600536804020744","","","0.71073","MoKα","","0.075","0.0634","","","0.1931","0.2031","","","","","","1.093","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204147","10.679","0.004","10.913","0.004","12.14","0.004","112.43","0.03","104.07","0.03","100.1","0.03","1210.5","0.9","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","polymeric tris(μ~3~-4-carboxyphenoxyacetato)di-μ~3~-hydroxo-bis(μ~2~-4,4'- pyridine)tetrazinc(IV) dihydrate","","- C47 H40 N4 O19 Zn4 -","- C47 H40 N4 O19 Zn4 -","- C47 H40 N4 O19 Zn4 -","1","0.5","CI6423","Gao, Shan; Huo, Li-Hua; Gu, Chang-Sheng; Zhao, Jing-Gui; Ng, Seik Weng","Tetrahedral and octahedral coordination for zinc in polymeric tris(μ~3~-4-carboxyphenoxyacetato)di-μ~3~-hydroxo-bis(μ~2~-4,4'-bipyridine)tetrazinc(IV) dihydrate","Acta Crystallographica Section E","2004","60","9","m1331","m1333","10.1107/S1600536804020859","","","0.71073","MoKα","","0.061","0.051","","","0.124","0.128","","","","","","1.121","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2204148","8.59","0.003","11.631","0.003","24.709","0.005","97.79","0.009","93.76","0.01","103.828","0.009","2362.7","1.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(Acetato-κO)[benzoylacetone (4-methoxybenzoyl)hydrazonato-κ^3^O,N,O'](pyridine-κN)zinc(II)","","- C25 H25 N3 O5 Zn -","- C25 H25 N3 O5 Zn -","- C100 H100 N12 O20 Zn4 -","4","2","CI6425","Huo, Li-Hua; Gao, Shan; Liu, Ji-Wei; Zhao, Hui","(Acetato-κ<i>O</i>)[benzoylacetone (4-methoxybenzoyl)hydrazonato-κ^3^<i>O,N,O</i>'](pyridine-κ<i>N</i>)zinc(II)","Acta Crystallographica Section E","2004","60","9","m1281","m1283","10.1107/S1600536804019725","","","0.71073","MoKα","","0.108","0.053","","","0.096","0.109","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204149","5.7333","0.0004","19.1695","0.0016","11.6547","0.0008","90","","103.441","0.006","90","","1245.82","0.16","293","2","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(2-Hydroxyphenyl)-4-phenyl-1H-1,2,4-triazole-5(4H)-thione","","- C14 H11 N3 O S -","- C14 H11 N3 O S -","- C56 H44 N12 O4 S4 -","4","1","CI6428","Genç, Sadık; Dege, Necmi; Çetin, Ahmet; Cansız, Ahmet; Şekerci, Memet; Dinçer, Muharrem","3-(2-Hydroxyphenyl)-4-phenyl-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2004","60","9","o1580","o1582","10.1107/S1600536804020367","","","0.71073","MoKα","","0.0534","0.0384","","","0.0894","0.0942","","","","","","1.057","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204150","11.1091","0.0004","11.78","0.0003","15.9282","0.0005","90","","109.563","0.001","90","","1964.12","0.11","298","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dicyclohexylaminium 4-hydroxysulfonate monohydrate","","- C18 H31 N O5 S -","- C18 H31 N O5 S -","- C72 H124 N4 O20 S4 -","4","1","CI6429","Zhi-Min Jin; Mei-Chao Li; Ping Wang; Li Li; Mao-Lin Hu","Dicyclohexylaminium 4-hydroxybenzenesulfonate monohydrate","Acta Crystallographica Section E","2004","60","9","o1633","o1635","10.1107/S1600536804020768","","","0.71073","MoKα","","0.0602","0.0539","","","0.1292","0.1335","","","","","","1.119","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204151","7.7432","0.0004","8.8457","0.0004","19.2021","0.0009","90","","91.69","0.001","90","","1314.66","0.11","193","2","193","2","","","","","","","","4","P 1 21 1","P 2yb","4","","3,4,5,6-tetrahydro-5-methyl-6-phenyl-4-propyl-2H-1,3,4-oxadiazin-2-one","","- C13 H18 N2 O2 -","- C13 H18 N2 O2 -","- C52 H72 N8 O8 -","4","2","CV6344","Lisa F. Szczepura; Shawn R. Hitchcock; George P. Nora","(5<i>S</i>,6<i>R</i>)-3,4,5,6-Tetrahydro-5-methyl-6-phenyl-4-propyl-2<i>H</i>-1,3,4-oxadiazin-2-one","Acta Crystallographica Section E","2004","60","9","o1467","o1469","10.1107/S160053680401829X","","","0.71073","MoKα","","0.0319","0.031","","","0.087","0.088","","","","","","1.087","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204152","8.033","0.001","17.034","0.002","8.531","0.001","90","","96.09","0.01","90","","1160.7","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dichlorobispyridazinezinc(II)","","- C8 H8 Cl2 N4 Zn -","- C8 H8 Cl2 N4 Zn -","- C32 H32 Cl8 N16 Zn4 -","4","1","CV6346","Leszek Pazderski; Edward Szłyk; Andrzej Wojtczak; Lech Kozerski; Jerzy Sitkowski","Dichlorodipyridazinezinc(II)","Acta Crystallographica Section E","2004","60","9","m1270","m1272","10.1107/S1600536804019671","","","0.71073","MoKα","","0.0438","0.0337","","","0.0819","0.087","","","","","","1.06","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204153","16.9231","0.0017","5.8166","0.0006","8.058","0.0008","90","","92.687","0.002","90","","792.32","0.14","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4-Bis(4-methoxyphenyl)piperazine-2,5-dione","","- C18 H18 N2 O4 -","- C18 H18 N2 O4 -","- C36 H36 N4 O8 -","2","0.5","CV6347","Yong-Hong Wen; Shu-Sheng Zhang; Bao-Hui Yu; Xue-Mei Li","1,4-Bis(4-methoxyphenyl)piperazine-2,5-dione","Acta Crystallographica Section E","2004","60","9","o1494","o1496","10.1107/S1600536804018914","","","0.71073","MoKα","","0.0493","0.0423","","","0.1129","0.1194","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204154","5.3712","0.0018","7.637","0.003","8.46","0.003","72.025","0.005","73.872","0.005","81.144","0.005","316.2","0.2","291","2","291","2","","","","","","","","4","P 1","P 1","1","(R)-histidinium (2R, 3R)-tartrate","","","- C10 H15 N3 O8 -","- C10 H15 N3 O8 -","- C10 H15 N3 O8 -","1","1","CV6349","Johnson, M. N.; Feeder, N.","(<i>R</i>)-Histidinium (2<i>R</i>,3<i>R</i>)-tartrate","Acta Crystallographica Section E","2004","60","9","o1476","o1477","10.1107/S160053680401863X","","","0.71073","MoKα","","0.0303","0.0299","","","0.0757","0.0762","","","","","","1.074","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204155","15.524","0.012","12.802","0.01","6.601","0.005","90","","102.56","0.03","90","","1280.5","1.7","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[[diaqua(2,2'-bipyridine-κ^2^N,N')cobalt(II)]-μ-sulfato]","","- C10 H12 Co N2 O6 S -","- C10 H12 Co N2 O6 S -","- C40 H48 Co4 N8 O24 S4 -","4","0.5","CV6350","Li, Xin-Hua; Chi, Xian-Xing","<i>catena</i>-Poly[[diaqua(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')cobalt(II)]-μ-sulfato]","Acta Crystallographica Section E","2004","60","9","m1301","m1302","10.1107/S1600536804019038","","","0.71073","MoKα","","0.028","0.0272","","","0.07","0.0705","","","","","","1.134","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204156","10.0406","0.0015","13.42","0.002","15.04","0.002","90","","90","","90","","2026.6","0.5","273","2","273","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","6-Styryl-pyran-2-one","Dehydrogoniothalamin","","- C13 H10 O2 -","- C13 H10 O2 -","- C104 H80 O16 -","8","1","CV6351","Din, Laily B.; Abdullah, Aryanti; Tan, S. L.; Said, Ikram M.; Yamin, Bohari M.","Dehydrogoniothalamin","Acta Crystallographica Section E","2004","60","9","o1515","o1517","10.1107/S1600536804019087","","","0.71073","MoKα","","0.057","0.044","","","0.113","0.126","","","","","","1.049","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204157","6.0473","0.0006","7.4417","0.0007","22.376","0.003","90","","90","","90","","1006.97","0.19","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-Phenyl-N'-(thiophen-2-ylmethylene)hydrazine","","- C11 H10 N2 S -","- C11 H10 N2 S -","- C44 H40 N8 S4 -","4","1","CV6354","Özçelik, Suzan; Dinçer, Muharrem; Şekerci, Memet; Balaban Ayla; Özdemir Ümmühan","<i>N</i>-Phenyl-<i>N</i>'-(2-thienylmethylene)hydrazine","Acta Crystallographica Section E","2004","60","9","o1552","o1553","10.1107/S1600536804019932","","","0.71073","MoKα","","0.0517","0.0383","","","0.0835","0.0877","","","","","","0.934","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204158","4.9218","0.001","5.7966","0.0012","11.804","0.002","92.41","0.03","94.98","0.03","96.91","0.03","332.59","0.12","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","catena-Poly[[tetraaquacobalt(II)]-μ-benzene-1,4-dioxyacetato-κ^2^O:O']","","- C10 H16 Co O10 -","- C10 H16 Co O10 -","- C10 H16 Co O10 -","1","0.5","CV6355","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui; Zhao, Jing-Gui","<i>catena</i>-Poly[[tetraaquacobalt(II)]-μ-benzene-1,4-dioxyacetato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2004","60","9","m1242","m1244","10.1107/S1600536804019373","","","0.71073","MoKα","","0.04","0.032","","","0.069","0.072","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204159","15.6359","0.0017","12.1299","0.0017","11.5236","0.0014","90","","104.111","0.003","90","","2119.6","0.5","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","","(1R*,4R*,5S*,12S*,13R*)-9-Acetoxycembra-8(E),15(17)-dien-16,4-olide monohydrate","","- C20 H34 O6 -","- C20 H34 O6 -","- C80 H136 O24 -","4","1","CV6356","Cui-Xian Zhang; Cheng-Zhu Liao; Wei-Gang Lu; Long-Mei Zeng","(1<i>R</i>*,4<i>R</i>*,5<i>S</i>*,12<i>S</i>*,13<i>R</i>*)-9-Acetoxycembra-8(<i>E</i>),15(17)-dien-16,4-olide monohydrate","Acta Crystallographica Section E","2004","60","9","o1598","o1600","10.1107/S1600536804020392","","","0.71073","MoKα","","0.0483","0.0393","","","0.1014","0.1109","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204160","8.459","0.002","16.942","0.005","6.6832","0.0018","90","","96.929","0.004","90","","950.8","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 3,5-dinitrosalicylate","","- C8 H6 N2 O7 -","- C8 H6 N2 O7 -","- C32 H24 N8 O28 -","4","1","CV6358","Jin Long-Fei; Xiao Feng-Ping; Wang Cheng-Gang","Methyl 3,5-dinitrosalicylate","Acta Crystallographica Section E","2004","60","9","o1593","o1594","10.1107/S1600536804020331","","","0.71073","MoKα","","0.0643","0.0514","","","0.1256","0.1329","","","","","","1.062","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204161","10.454","0.006","16.192","0.006","7.0777","0.0014","90","","94.47","0.05","90","","1194.4","0.9","213","2","213","2","","","","","","","","5","C 1 c 1","C -2yc","9","","catena-Poly[[tetraaquazinc(II)]-μ-5-sulfosalicylato-κ^2^O:O']","","- C7 H12 O10 S Zn -","- C7 H12 O10 S Zn -","- C28 H48 O40 S4 Zn4 -","4","1","CV6359","Hecht, Elmar","<i>catena</i>-Poly[[tetraaquazinc(II)]-μ-5-sulfosalicylato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2004","60","9","m1286","m1288","10.1107/S1600536804020070","","","0.71073","MoKα","","0.0301","0.03","","","0.0857","0.0858","","","","","","1.088","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204162","11.025","0.007","11.238","0.007","11.666","0.007","90","","105.484","0.01","90","","1392.9","1.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5a,6,11a,12-Tetrahydro-5a,11a-dimethyl-1,4-benzoxazino[3,2-b][1,4]benzoxazine","","- C16 H16 N2 O2 -","- C16 H16 N2 O2 -","- C64 H64 N8 O8 -","4","1","CV6360","Hai-Yan, Zhao; Xiao-Hang, Qiu; Pan-Wen, Shen","5a,6,11<i>a</i>,12-Tetrahydro-5a,11<i>a</i>-dimethyl-1,4-benzoxazino[3,2-<i>b</i>][1,4]benzoxazine","Acta Crystallographica Section E","2004","60","9","o1619","o1621","10.1107/S1600536804020665","","","0.71073","MoKα","","0.105","0.077","","","0.191","0.22","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204163","11.215","0.0006","12.2282","0.0003","11.5439","0.0005","90","","115.753","0.0019","90","","1425.88","0.11","150","1","150","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","3a,4,8,8a-tetrahydro-6α-methylcarbonylmethyl-6β-ethoxycarbornyl-5,7- cyclopropyl-4,8-epoxyisobenzofuran-1,3-dione","5,6-[2α-Acetyl-1β-(ethoxycarbonyl)ethylidene]-1,3,3a,4,5,6,7,7a- octahydro-4,7-epoxyisobenzofuran-1,3-dione","","- C15 H16 O7 -","- C15 H16 O7 -","- C60 H64 O28 -","4","1","CV6362","Lough, Alan J.; Villeneuve, Karine; Tam, William","5,6-[2α-Acetyl-1β-(ethoxycarbonyl)ethylidene]-1,3,3a,4,5,6,7,7a-octahydro-4,7-epoxyisobenzofuran-1,3-dione","Acta Crystallographica Section E","2004","60","9","o1659","o1660","10.1107/S160053680402046X","","","0.71073","MoKα","","0.0683","0.0431","","","0.104","0.1192","","","","","","1.005","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204164","7.8086","0.0012","10.3018","0.0018","10.8659","0.0012","90","","92.528","0.01","90","","873.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","cis-(1RS,3RS)-2-Methoxymethyl-1,3-dithiane 1,3-dioxide","","- C6 H12 O3 S2 -","- C6 H12 O3 S2 -","- C24 H48 O12 S8 -","4","1","CV6364","Gültekin, Zeynep; Bayrak, Hacer; Frey, Wolfgang; Hökelek, Tuncer","<i>cis</i>-(1<i>RS</i>,3<i>RS</i>)-2-Methoxymethyl-1,3-dithiane 1,3-dioxide","Acta Crystallographica Section E","2004","60","9","o1624","o1626","10.1107/S1600536804020811","","","0.71073","MoKα","","0.0606","0.0444","","","0.0975","0.1067","","","","","","1.118","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204165","12.123","0.005","48.809","0.017","6.262","0.002","90","","90","","90","","3705","2","293","2","293","2","","","","","","","","5","F d d 2","F 2 -2d","43","[3-AH-2,6-DBP]2Br2.H2O","3-ammonium-2,6-dibromopyridine bromide hemihydrate","","- C5 H6 Br3 N2 O0.5 -","- C5 H6 Br3 N2 O0.5 -","- C80 H96 Br48 N32 O8 -","16","1","DN6151","Haddad, Salim F.; AlDamen, Murad A.; Al-Far, Rawhi H.","3-Ammonio-2,6-dibromopyridine bromide hemihydrate","Acta Crystallographica Section E","2004","60","9","o1491","o1493","10.1107/S1600536804018793","","","0.7107","MoKα","","0.0483","0.0321","","","0.0746","0.0789","","","","","","0.84","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204166","5.917","0.0002","16.5865","0.0006","9.9576","0.0004","90","","104.128","0.002","90","","947.7","0.06","293","2","293","2","","","","","","","","4","P 1 n 1","P -2yac","7","","","","- C21 H30 N2 O -","- C21 H30 N2 O -","- C42 H60 N4 O2 -","2","1","DN6152","Parrish, Damon A.; Deschamps, Jeffrey R.; Jiang, Faming; Zaveri, Nurulain T.","A novel receptor ligand: 1-(1-cyclooctylpiperidin-4-yl)indolin-2-one","Acta Crystallographica Section E","2004","60","9","o1571","o1572","10.1107/S1600536804016903","","","1.54178","CuKα","","0.0574","0.0479","","","0.1245","0.1347","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204167","22.167","0.002","5.8534","0.0004","14.26","0.0012","90","","105.629","0.003","90","","1781.9","0.3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[dichlorozinc(II)]-μ-N,N'-bis(4-pyridylmethyl)piperazine]","","- C16 H20 Cl2 N4 Zn -","- C16 H20 Cl2 N4 Zn -","- C64 H80 Cl8 N16 Zn4 -","4","0.5","FL6112","Li, Xiao-Ju; Cao, Rong; Li, Xing; Bi, Wen-Hua; Wang, Yan-Qin","<i>catena</i>-Poly[[dichlorozinc(II)]-μ-<i>N</i>,<i>N</i>'-bis(4-pyridylmethyl)piperazine]","Acta Crystallographica Section E","2004","60","9","m1273","m1275","10.1107/S160053680401952X","","","0.71073","MoKα","","","0.0431","","","0.1047","0.1157","","","","","","1.098","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204168","11.3962","0.0012","6.4089","0.0007","12.3267","0.0013","90","","97.786","0.002","90","","892.01","0.16","94","2","94","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,4,8-trinitro-2,4,6,8-tetraazabicyclo[3.3.0]octan-7-one","","- C4 H5 N7 O7 -","- C4 H5 N7 O7 -","- C16 H20 N28 O28 -","4","1","FL6113","Butcher, Ray J.; Evans, Robin; Gilardi, R.","2,4,6-Trinitro-2,4,6,8-tetraazabicyclo[3.3.0]octan-7-one","Acta Crystallographica Section E","2004","60","9","o1543","o1545","10.1107/S160053680401880X","","","0.71073","MoKα","","0.0387","0.0348","","","0.0848","0.0867","","","","","","1.094","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204169","7.2287","0.0014","8.6286","0.0015","9.037","0.0016","97.896","0.005","105.962","0.006","97.698","0.005","528","0.17","120","","120","","","","","","","","","3","P -1","-P 1","2","","1,3-dihydroxy-7-methoxyxanthone","","- C14 H10 O5 -","- C14 H10 O5 -","- C28 H20 O10 -","2","1","FL6116","Radosavljević Evans, Ivana; Howard, Judith A. K.; Šavikin-Fodulović, Katarina; Menković, Nebojša","Isogentisin (1,3-dihydroxy-7-methoxyxanthone)","Acta Crystallographica Section E","2004","60","9","o1557","o1559","10.1107/S1600536804019890","","","0.71073","MoKα","","0.1021","0.0338","","0.1166","0.0764","0.1166","","","","","","0.9605","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204170","9.186","0.006","18.238","0.008","9.614","0.006","90","","100.81","0.08","90","","1582.1","1.6","293","","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(2-ammonio-5-chloropyridine) tetradecachlorohexamolybdate","","- C10 H12 Cl16 Mo6 N4 -","- C10 H12 Cl16 Mo6 N4 -","- C20 H24 Cl32 Mo12 N8 -","2","0.5","HB6059","Flemström, Andreas","Bis(2-ammonio-5-chloropyridine) tetradecachlorohexamolybdate","Acta Crystallographica Section E","2004","60","9","m1303","m1305","10.1107/S160053680401935X","","","0.71073","MoKα","","0.0335","0.0245","","","0.0748","0.0871","","","","","","1.178","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204171","15.1912","0.0013","8.2285","0.001","16.7012","0.0012","90","","104.058","0.012","90","","2025.1","0.4","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Hexakis(1H-imidazole-κN^3^)cobalt(II) bis(dinitrobenzoate) dihydrate","","- C32 H34 Co N16 O14 -","- C32 H34 Co N16 O14 -","- C64 H68 Co2 N32 O28 -","2","0.5","HB6070","Tu-Gen Xu; Duan-Jun Xu","Hexakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)cobalt(II) bis(3,5-dinitrobenzoate) dihydrate","Acta Crystallographica Section E","2004","60","9","m1218","m1219","10.1107/S1600536804018653","","","0.71073","MoKα","","0.046","0.034","","","0.079","0.084","","","","","","1.054","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204172","10.806","0.004","11.777","0.004","19.944","0.007","90","","97.66","0.005","90","","2515.5","1.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis[trans-2-(2-phenylethenyl)pyrazin-4-ium)] tetrachlorozincate","","- C24 H22 Cl4 N4 Zn -","- C24 H22 Cl4 N4 Zn -","- C96 H88 Cl16 N16 Zn4 -","4","0.5","HB6071","Shi, Xue-Fang; Liu, Hui-Min; Zhang, Wen-Qin","Bis[<i>trans</i>-2-(2-phenylethenyl)pyrazin-4-ium] tetrachlorozincate","Acta Crystallographica Section E","2004","60","9","m1208","m1209","10.1107/S1600536804018628","","","0.71073","MoKα","","0.0653","0.0366","","","0.067","0.0736","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204173","14.054","0.004","12.597","0.004","16.424","0.005","90","","92.008","0.006","90","","2905.9","1.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","poly[[tetrakis(N,N'dimethylformamide)pentacopper(I,II)]-tetra-μ~2~-cyano- di-μ~3~-cyano]","","- C18 H28 Cu5 N10 O4 -","- C18 H28 Cu5 N10 O4 -","- C72 H112 Cu20 N40 O16 -","4","0.5","HB6074","Xiao-Jun Zhao; Stuart R Batten; Miao Du","[Cu~4~^I^Cu^II^(CN)~6~(DMF)~4~]~<i>n~</i> (DMF is <i>N</i>,<i>N</i>'-dimethylformamide): redetermination and topological analysis of a mixed-valence copper‒cyanide coordination polymer with a unique six-connected self-penetrating network","Acta Crystallographica Section E","2004","60","9","m1237","m1239","10.1107/S160053680401921X","","","0.71073","MoKα","","0.1028","0.0482","","","0.0789","0.0918","","","","","","0.974","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204174","10.429","0.003","22.125","0.006","19.435","0.006","90","","121.922","0.005","90","","3806.3","1.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1,10-phenanthrolinium aquabis(1,10-phenanthroline)sodium(I) pentacyanonitrosoiron(II) monohydrate","","- C41 H29 Fe N12 Na O3 -","- C41 H29 Fe N12 Na O3 -","- C164 H116 Fe4 N48 Na4 O12 -","4","1","HB6075","Zhang, Baofeng; Xie, Chengzhi; Wang, Xiaoqing; Shen, Guangqiu; Shen, Dezhong","A novel heterometallic Fe^II^‒Na^+^ phase: 1,10-phenanthrolinium aquabis(1,10-phenanthroline)sodium(I) pentacyanonitrosoiron(II) monohydrate","Acta Crystallographica Section E","2004","60","9","m1293","m1295","10.1107/S1600536804019944","","","0.71073","MoKα","","0.1888","0.0634","","","0.1129","0.1485","","","","","","0.934","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204175","25.049","0.006","7.0568","0.0018","21.42","0.005","90","","107.783","0.003","90","","3605.4","1.5","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(1H-benzimidazole-κN^3^)(oxydiacetato-κ^3^O,O',O'')zinc(II)","","- C18 H16 N4 O5 Zn -","- C18 H16 N4 O5 Zn -","- C144 H128 N32 O40 Zn8 -","8","1","HB6076","Lei Cao; Ning Li; Duan-Jun Xu","Bis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)(oxydiacetato-κ^3^<i>O</i>,<i>O</i>',<i>O</i>'')zinc(II)","Acta Crystallographica Section E","2004","60","9","m1248","m1250","10.1107/S1600536804019488","","","0.71073","MoKα","","0.032","0.027","","","0.068","0.07","","","","","","1.035","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204176","4.6318","0.0002","9.8575","0.0005","10.631","0.0006","90","","92.084","0.002","90","","485.07","0.04","185","","185","","","","","","","","","4","P 1 21 1","P 2yb","4","","Methyl 2,4-anhydro-5-azido-5,6-dideoxy-L-altronate","","- C7 H11 N3 O4 -","- C7 H11 N3 O4 -","- C14 H22 N6 O8 -","2","1","HB6077","Watkin, David J.; Johnson, Stephen W.; Jones, John H.; Fleet, George W. J.","Methyl 2,4-anhydro-5-azido-5,6-dideoxy-<small>L</small>-altronate","Acta Crystallographica Section E","2004","60","9","o1609","o1610","10.1107/S1600536804019968","","","0.71073","MoKα","","0.0506","0.0506","","0.0954","0.0954","0.0954","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204177","11.777","0.003","13.574","0.003","14.114","0.003","65.372","0.002","86.194","0.003","81.6","0.003","2029","0.8","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Tetrakis(μ-N-acetyl-N-phenylglycinato)bis[(N-acetyl-N-phenylglycinato)(1,10- phenanthroline-κ^2^N,N')lanthanum(III)] dihydrate","","- C84 H80 La2 N10 O20 -","- C84 H80 La2 N10 O20 -","- C84 H80 La2 N10 O20 -","1","0.5","HB6078","Fu, Ai-Yun; Wang, Da-Qi; Shen, Qing-Jun","Tetrakis(μ-<i>N</i>-acetyl-<i>N</i>-phenylglycinato)bis[(<i>N</i>-acetyl-<i>N</i>-phenylglycinato)(1,10-phenanthroline-κ^2^<i>N,N</i>')lanthanum(III)] dihydrate","Acta Crystallographica Section E","2004","60","9","m1346","m1348","10.1107/S1600536804020793","","","0.71073","MoKα","","0.0325","0.0253","","","0.0632","0.0704","","","","","","1","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2204178","32.2977","0.0007","10.248","0.0003","22.6078","0.0007","90","","117.237","0.001","90","","6653.2","0.3","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","μ-Aqua-bis(μ-2'-carboxybiphenyl-2-carboxylato-κ^2^O:O')bis[bis(2'- carboxybiphenyl-2-carboxylato-κO)(1,10-phenanthroline-κ^2^N,N')cobalt(II)]","","- C80 H54 Co2 N4 O17 -","- C80 H54 Co2 N4 O17 -","- C320 H216 Co8 N16 O68 -","4","0.5","HB6079","Qian Miao; Mao-Lin Hu; Fan Chen","μ-Aqua-bis(μ-2'-carboxybiphenyl-2-carboxylato-κ^2^<i>O</i>:<i>O</i>')bis[bis(2'-carboxybiphenyl-2-carboxylato-κ<i>O</i>)(1,10-phenanthroline-κ^2^<i>N,N</i>')cobalt(II)]","Acta Crystallographica Section E","2004","60","9","m1314","m1316","10.1107/S1600536804020458","","","0.71073","MoKα","","0.1212","0.1169","","","0.2395","0.2468","","","","","","1.427","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204179","11.5641","0.0005","17.8801","0.0003","10.1058","0.0004","90","","90","","90","","2089.55","0.13","295","2","295","2","","","","","","","","5","P n a 21","P 2c -2n","33","","catena-Poly[[bis(1H-benzimidazole-κN^3^)cobalt(II)]-μ-isophthalate-κ^2^O:O']","","- C22 H16 Co N4 O4 -","- C22 H16 Co N4 O4 -","- C88 H64 Co4 N16 O16 -","4","1","HB6081","Jian-Rong Su; Yu Liu; Duan-Jun Xu","<i>catena</i>-Poly[[bis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)cobalt(II)]-μ-isophthalato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2004","60","9","m1298","m1300","10.1107/S1600536804020446","","","0.71073","MoKα","","0.061","0.046","","","0.087","0.091","","","","","","1.112","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204180","11.4722","0.0019","14.271","0.002","14.986","0.002","66.966","0.002","86.448","0.002","79.303","0.002","2218.5","0.6","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis(μ-N-acetyl-N-phenylglycinato-κ^2^O:O')bis[triaqua(1,10-phenanthroline- κ^2^N,N')lanthanum(III)] bis(μ-N-acetyl-N-phenylglycinate) dinitrate dihydrate","","- C88 H88 La2 N14 O26 -","- C88 H88 La2 N14 O26 -","- C88 H88 La2 N14 O26 -","1","0.5","HB6082","Fu, Ai-Yun; Wang, Da-Qi; Shen, Qing-Jun; Zhang, Cui-Lan","Bis(μ-<i>N</i>-acetyl-<i>N</i>-phenylglycinato-κ^2^<i>O</i>:<i>O</i>')bis[triaqua(1,10-phenanthroline-κ^2^<i>N,N</i>')lanthanum(III)] bis(<i>N</i>-acetyl-<i>N</i>-phenylglycinate) dinitrate dihydrate","Acta Crystallographica Section E","2004","60","9","m1337","m1339","10.1107/S1600536804021002","","","0.71073","MoKα","","0.0415","0.0317","","","0.0753","0.0833","","","","","","1.006","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2204181","8.0564","0.0003","20.5089","0.0009","7.8112","0.0003","90","","106.833","0.002","90","","1235.33","0.09","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","ethyl (3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydropurin-1-yl)acetate","","- C11 H14 N4 O4 -","- C11 H14 N4 O4 -","- C44 H56 N16 O16 -","4","1","HG6057","Jin-Chang Ding; Wen Feng; Hua-Yue Wu; Zi-Kai Pan","Ethyl (3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydropurin-1-yl)acetate","Acta Crystallographica Section E","2004","60","9","o1518","o1519","10.1107/S1600536804017659","","","0.71073","MoKα","","0.0537","0.0436","","","0.1038","0.1093","","","","","","1.052","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204182","29.03","0.006","7.055","0.0014","11.916","0.002","90","","112.85","0.03","90","","2249","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Hexaaquanickel(II) bis(p-nitrobenzoate) dihydrate","","- C14 H24 N2 Ni O16 -","- C14 H24 N2 Ni O16 -","- C56 H96 N8 Ni4 O64 -","4","0.5","HG6066","Qu, Yang; Liu, Zhao-Di; Zhu, Hai-Liang; Tan, Min-Yu","Hexaaquanickel(II) bis(<i>p</i>-nitrobenzoate) dihydrate","Acta Crystallographica Section E","2004","60","9","m1306","m1307","10.1107/S1600536804017519","","","0.71073","MoKα","","0.0558","0.0527","","","0.156","0.1598","","","","","","1.083","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204183","6.7094","0.0004","8.8147","0.0006","12.2004","0.0009","72.908","0.006","87.72","0.006","88.718","0.006","689.09","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","9-Ethyl-3-methyl-1,6-dinitrocarbazole","9-Ethyl-3-methyl-1,6-dinitro-9H-carbazole","","- C15 H13 N3 O4 -","- C15 H13 N3 O4 -","- C30 H26 N6 O8 -","2","1","HG6074","Asker, Erol; Masnovi, John","9-Ethyl-3-methyl-1,6-dinitrocarbazole","Acta Crystallographica Section E","2004","60","9","o1613","o1615","10.1107/S1600536804020574","","","0.7093","MoKα","","0.0786","0.0422","","","0.1012","0.116","","","","","","1.018","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204184","9.3305","0.0008","12.407","0.001","12.7422","0.001","90","","90","","90","","1475.1","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-(2-Ethoxyphenyl)-1-ethyl-1H-benzimidazole","","- C17 H18 N2 O -","- C17 H18 N2 O -","- C68 H72 N8 O4 -","4","1","HG6076","Tong, Yi-Ping; Li, Wei","2-(2-Ethoxyphenyl)-1-ethyl-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2004","60","9","o1563","o1565","10.1107/S1600536804019622","","","0.71073","MoKα","","0.0653","0.0499","","","0.1031","0.1097","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204185","6.2342","0.0006","9.4516","0.0008","9.8012","0.0009","104.207","0.007","91.138","0.008","101.849","0.007","546.42","0.09","297","2","297","2","","","","","","","","4","P -1","-P 1","2","","5,6-Dichloro-1-propyl-1H-benzimidazole","","- C10 H10 Cl2 N2 -","- C10 H10 Cl2 N2 -","- C20 H20 Cl4 N4 -","2","1","HG6077","Robert T. Stibrany; Harvey J. Schugar; Joseph A. Potenza","5,6-Dichloro-1-propylbenzimidazole","Acta Crystallographica Section E","2004","60","9","o1603","o1605","10.1107/S1600536804018252","","","0.71073","MoKα","","0.0713","0.064","","","0.1847","0.1947","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204186","7.832","0.001","9.151","0.002","12.201","0.003","92.68","0.04","104.56","0.04","113.45","0.03","765.8","0.4","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","N-(p-Methoxybenzoyl)-N'-(o-methoxyphenyl)thiourea","","- C16 H16 N2 O3 S -","- C16 H16 N2 O3 S -","- C32 H32 N4 O6 S2 -","2","1","HG6078","Ali, Hapipah; Halim, S. Nadiah A.; Khamis, Nur Ashikin; Yusof, M. Sukeri; Yamin, Bohari M.","<i>N</i>-(<i>p</i>-Methoxybenzoyl)-<i>N</i>'-(<i>o</i>-methoxyphenyl)thiourea","Acta Crystallographica Section E","2004","60","9","o1497","o1498","10.1107/S1600536804018823","","","0.71073","MoKα","","0.042","0.039","","","0.103","0.105","","","","","","1.06","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204187","17.5842","0.0017","7.6235","0.0008","17.8892","0.0013","90","","90","","90","","2398.1","0.4","150","","150","","","","","","","","","6","P c a 21","P 2c -2ac","29","","Dichlorobis[1-(2-ethoxyethyl)-1H-benzimidazole-κN^3^]cobalt(II)","","- C22 H28 Cl2 Co N4 O2 -","- C22 H28 Cl2 Co N4 O2 -","- C88 H112 Cl8 Co4 N16 O8 -","4","1","HG6082","Türktekin, Sevim; Akkurt, Mehmet; Orhan, Ersin; Küçükbay, F. Zehra; Küçükbay, Hasan; Büyükgüngör, Orhan","Dichlorobis[1-(2-ethoxyethyl)-1<i>H</i>-benzimidazole-κ<i>N</i>^3^]cobalt(II)","Acta Crystallographica Section E","2004","60","9","m1220","m1222","10.1107/S1600536804018835","","","0.71073","MoKα","","0.0351","0.0303","","","0.0714","0.0729","","","","","","0.98","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204188","7.2444","0.0014","16.089","0.003","18.276","0.004","90","","98.85","0.03","90","","2104.8","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[[aqua(1,10-phenanthroline-κ^2^N,N')copper(II)]-μ-benzene- 1,4-dioxyacetato-κ^3^O,O':O''] monohydrate]","","- C22 H20 Cu N2 O8 -","- C22 H20 Cu N2 O8 -","- C88 H80 Cu4 N8 O32 -","4","1","HG6083","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui; Zhao, Jing-Gui","<i>catena</i>-Poly[[[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)]-μ-benzene-1,4-dioxyacetato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>''] monohydrate]","Acta Crystallographica Section E","2004","60","9","m1231","m1233","10.1107/S1600536804019014","","","0.71073","MoKα","","0.044","0.033","","","0.081","0.085","","","","","","1.04","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204189","5.013","0.001","12.733","0.003","24.096","0.005","90","","90","","90","","1538.1","0.6","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3-Methoxysalicylaldehyde 4-methoxybenzoylhydrazone monohydrate","","- C16 H18 N2 O5 -","- C16 H18 N2 O5 -","- C64 H72 N8 O20 -","4","1","HG6085","Huo, Li-Hua; Gao, Shan; Zhao, Hui; Zhao, Jing-Gui; Zain, Sharifuddin M.; Ng, Seik Weng","3-Methoxysalicylaldehyde 4-methoxybenzoylhydrazone monohydrate","Acta Crystallographica Section E","2004","60","9","o1538","o1540","10.1107/S1600536804019658","","","0.71073","MoKα","","0.051","0.041","","","0.098","0.102","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204190","22.4062","0.0007","22.4062","0.0007","33.854","0.002","90","","90","","120","","14719","1.1","298","2","298","2","","","","","","","","6","R -3 :H","-R 3","148","","[tris(2,3,4,5-tetrachloro-6-(4,8-di-tert-butyl-2,10- dimethyl-6-oxo-12H-5,7-dioxa-6λ^5^-phosphadibenzo[a,d]cycloocten-6- yloxy)phenoxido]aluminium benzene 0.25-solvate","","- C88.5 H91.5 Al Cl12 O15 P3 -","- C88.5 H91.5 Al Cl12 O15 P3 -","- C531 H549 Al6 Cl72 O90 P18 -","6","0.333333","HG6086","Satish Kumar, N.; Vittal, Jagadese J.; Kumara Swamy, K. C.","A hexacoordinated aluminium complex with a new type of seven-membered chelate ring involving a cyclic phosphate ester","Acta Crystallographica Section E","2004","60","9","m1321","m1323","10.1107/S1600536804019592","","","0.71073","MoKα","","0.0581","0.0457","","","0.1349","0.1423","","","","","","1.072","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204191","10.901","0.002","7.789","0.002","20.719","0.004","90","","97.07","0.03","90","","1745.8","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H48 Cu N6 O2 S2 -","- C34 H48 Cu N6 O2 S2 -","- C68 H96 Cu2 N12 O4 S4 -","2","0.5","HG6087","Nie, Yi","<i>trans</i>-Bis{2-[3-(cyclohexylammonio)propyliminomethyl]phenolato}dithiocyanatocopper(II)","Acta Crystallographica Section E","2004","60","9","m1319","m1320","10.1107/S1600536804020136","","","0.71073","MoKα","","0.092","0.0491","","","0.1166","0.1554","","","","","","0.956","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204192","9.2511","0.0012","10.1801","0.0012","12.447","0.002","88.243","0.003","72.656","0.003","70.188","0.003","1049.5","0.3","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","4-Ethoxy-5-(hydroxymethyl)-8-methyl-2,2-diphenyl-1,3-dioxa-7-azonia- 2-borata-1,2,3,4-tetrahydronaphthalene monohydrate","","- C22 H26 B N O5 -","- C22 H26 B N O5 -","- C44 H52 B2 N2 O10 -","2","1","HG6088","Jones, Peter G.; Kliegel, Wolfgang; Barakat, Mohamed","Diphenylboron chelate of a pyridoxal hemiacetal with ethanol","Acta Crystallographica Section E","2004","60","9","o1549","o1551","10.1107/S1600536804019816","","","0.71073","MoKα","","0.0723","0.0472","","","0.1253","0.1373","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204193","8.785","0.0018","9.848","0.002","10.345","0.002","77.9","0.03","79.12","0.03","67.39","0.03","802","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Methyl {2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl}acetate","","- C18 H16 N2 O4 -","- C18 H16 N2 O4 -","- C36 H32 N4 O8 -","2","1","LH6245","Wang, Hai-Bo; Chen, Jia-Hui; Wang, Jin-Tang","Methyl {2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl}acetate","Acta Crystallographica Section E","2004","60","9","o1478","o1480","10.1107/S1600536804018458","","","0.71073","MoKα","","0.0878","0.0558","","","0.1597","0.1861","","","","","","1.166","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204194","9.3056","0.0019","4.84","0.001","11.843","0.002","90","","100.181","0.003","90","","525","0.18","293","2","100","2","","","","","","","","4","P 1 n 1","P -2yac","7","","Dimethyl N,N'-(1,2-phenylene)dicarbamate","","- C10 H12 N2 O4 -","- C10 H12 N2 O4 -","- C20 H24 N4 O8 -","2","1","LH6247","Efrén V. García-Báez; Beatriz A. López-Romero; Francisco J. Martínez-Martínez; Herbert Höpfl; Itzia I. Padilla-Martínez","Dimethyl <i>N,N</i>'-(1,2-phenylene)dicarbamate","Acta Crystallographica Section E","2004","60","9","o1488","o1490","10.1107/S1600536804018690","","","0.71073","MoKα","","0.0316","0.0307","","","0.0804","0.0811","","","","","","1.097","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204195","11.041","0.006","11.729","0.006","11.8","0.007","64.72","0.04","89.47","0.03","84.17","0.02","1373.6","1.4","173","2","173","2","","","","","","","","3","P -1","-P 1","2","Imperatorin","9-(3-methylbut-2-enyloxy)-7H-furo[3,2-g]chromen-7-one","","- C16 H14 O4 -","- C16 H14 O4 -","- C64 H56 O16 -","4","2","LH6250","Atta-ur-Rahman; Zareen, Seema; Choudhary, M. Iqbal; Shaheen, Farzana; Parvez, Masood","Conformations of imperatorin","Acta Crystallographica Section E","2004","60","9","o1460","o1462","10.1107/S1600536804018604","","","0.71073","MoKα","","0.062","0.048","","","0.131","0.142","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204196","9.4273","0.0015","14.479","0.002","9.4762","0.0015","90","","117.662","0.002","90","","1145.6","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2-Phenylisophosphindoline-1,3-dione","2H-2-Phenylisophosphindoline-1,3-dione","","- C14 H9 O2 P -","- C14 H9 O2 P -","- C56 H36 O8 P4 -","4","1","LH6252","Andreas Decken; Erin D. Gill; Frank Bottomley","2-Phenylisophosphindoline-1,3-dione","Acta Crystallographica Section E","2004","60","9","o1456","o1457","10.1107/S1600536804018616","","","0.71073","MoKα","","0.038","0.0322","","","0.0867","0.0908","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204197","10.048","0.002","9.3746","0.0019","19.101","0.004","90","","90.87","0.03","90","","1799","0.6","193.15","","193.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(N,N-dimethylformamide-κO)bis[1-phenyl-3-methyl-4-benzoyl-1H-pyrazol- 5(4H)-onato-κ^2^O,O']nickel(II)","","- C40 H40 N6 Ni O6 -","- C40 H40 N6 Ni O6 -","- C80 H80 N12 Ni2 O12 -","2","0.5","LH6254","Xiao-Ping Shen; Ai-Hua Yuan","Bis(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)bis[1-phenyl-3-methyl-4-benzoyl-1<i>H</i>-pyrazol-5(4<i>H</i>)-onato-κ^2^<i>O</i>,<i>O</i>']nickel(II)","Acta Crystallographica Section E","2004","60","9","m1228","m1230","10.1107/S160053680401877X","","","0.71073","MoKα","","0.0715","0.0596","","","0.1039","0.1083","","","","","","1.098","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204198","8.2827","0.0009","24.48","0.004","9.1094","0.0008","90","","109.588","0.004","90","","1740.1","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(glycolato-κ^2^O,O')(1,10-phenanthroline-κ^2^N,N')zinc(II) dihydrate","","- C16 H18 N2 O8 Zn -","- C16 H18 N2 O8 Zn -","- C64 H72 N8 O32 Zn4 -","4","0.5","LH6255","Shan Gao; Li-Hua Huo; Zhu-Yan Zhang; Hui Zhao; Jing-Gui Zhao","Bis(glycolato-κ^2^<i>O,O</i>')(1,10-phenanthroline-κ^2^<i>N,N</i>')zinc(II) dihydrate","Acta Crystallographica Section E","2004","60","9","m1278","m1280","10.1107/S1600536804019774","","","0.71073","MoKα","","0.056","0.039","","","0.082","0.087","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204199","9.4503","0.0006","16.3882","0.0008","11.477","0.0009","90","","110.502","0.004","90","","1664.9","0.19","295","2","295","2","","","","","","","","3","I 1 a 1","I -2ya","9","naphthimidazole","1H‒napth[2,3-d]imidazole","","- C11 H8 N2 -","- C11 H8 N2 -","- C88 H64 N16 -","8","2","LH6257","Robert T. Stibrany; Harvey J. Schugar; Joseph A. Potenza","Hydrogen bonding in 1<i>H</i>-naphth[2,3-<i>d</i>]imidazole","Acta Crystallographica Section E","2004","60","9","o1648","o1651","10.1107/S1600536804019555","","","0.71073","MoKα","","0.0691","0.0464","","","0.1005","0.1104","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204200","18.1809","0.0004","10.6493","0.0003","6.847","0.0008","90","","90","","90","","1325.67","0.16","90","0.2","90","0.2","","","","","","","","4","P c a 21","P 2c -2ac","29","","4-(Benzo[b]thiophen-3-yl)-1-methylpiperidine-4-carbonitrile","","- C15 H16 N2 S -","- C15 H16 N2 S -","- C60 H64 N8 S4 -","4","1","LH6258","Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.","4-(Benzo[<i>b</i>]thiophen-3-yl)-1-methylpiperidine-4-carbonitrile","Acta Crystallographica Section E","2004","60","9","o1533","o1534","10.1107/S1600536804019543","","","0.71073","MoKα","","0.0698","0.044","","","0.0883","0.0977","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204201","9.502","0.003","11.906","0.003","13.676","0.003","105.712","0.017","108.29","0.02","101.13","0.02","1347.1","0.7","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","4-hydroxy-4-benzylsydno[3,4-a](4H)indole","","- C16 H12 N2 O3 -","- C16 H12 N2 O3 -","- C64 H48 N8 O12 -","4","2","LH6259","Riddle, Gordon B.; Grossie, David A.; Turnbull, Kenneth","The sydnone compound 4-hydroxy-4-benzylsydno[3,4-<i>a</i>]indole","Acta Crystallographica Section E","2004","60","9","o1568","o1570","10.1107/S1600536804020082","","","0.71073","MoKα","","0.055","0.0454","","","0.1367","0.1457","","","","","","1.055","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204202","10.2945","0.0005","12.5071","0.0006","15.911","0.0008","90","","90","","90","","2048.61","0.17","198","2","198","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","μ-Diphenylphosphido-μ-hydrido-bis[carbonyl(η^5^- cyclopentadienyl)iron(II)]","μ-Diphenylphosphido-μ-hydrido-bis[carbonyl(η^5^- cyclopentadienyl)iron(II)]","","- C24 H21 Fe2 O2 P -","- C24 H21 Fe2 O2 P -","- C96 H84 Fe8 O8 P4 -","4","1","LH6260","Andreas Decken; Crystal D. Craig; Frank Bottomley","μ-Diphenylphosphido-μ-hydrido-bis[carbonyl(η^5^-cyclopentadienyl)iron(II)]","Acta Crystallographica Section E","2004","60","9","m1284","m1285","10.1107/S1600536804019919","","","0.71073","MoKα","","0.0179","0.0173","","","0.0448","0.0451","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204203","16.927","0.002","4.5244","0.0005","19.673","0.002","90","","105.828","0.005","90","","1449.5","0.3","120","2","120","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","(E)-{[2-(phenyldiazenyl)phenyl]ethylideneaminooxy}acetic acid","","- C16 H15 N3 O3 -","- C16 H15 N3 O3 -","- C64 H60 N12 O12 -","4","1","LH6263","Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Wardell, James L.","Hydrogen-bonded <i>R</i>~2~^2^(8) dimers in (<i>E</i>)-{[2-(phenyldiazenyl)phenyl]ethylideneaminooxy}acetic acid","Acta Crystallographica Section E","2004","60","9","o1560","o1562","10.1107/S1600536804019877","","","0.71073","MoKα","","0.1866","0.0687","","","0.1444","0.1866","","","","","","0.945","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204204","15.137","0.004","10.787","0.003","15.24","0.004","90","","104.936","0.003","90","","2404.4","1.1","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Triaqua{μ-2-[N,N-bis(carboxylatomethyl)aminomethyl]-6-[N-(carboxylatomethyl)- N-(carboxymethyl)aminomethyl]-4-nitrophenolato}dicopper(II) trihydrate","","- C16 H27 Cu2 N3 O17 -","- C16 H27 Cu2 N3 O17 -","- C64 H108 Cu8 N12 O68 -","4","1","NG6040","Jiang, Xiao-Ming; Meng, Bian-Hong; Zhang, Zhi-Gang","Triaqua{μ-2-[<i>N</i>,<i>N</i>-bis(carboxylatomethyl)aminomethyl]-6-[<i>N</i>-(carboxylatomethyl)-<i>N</i>-(carboxymethyl)aminomethyl]-4-nitrophenolato}dicopper(II) trihydrate","Acta Crystallographica Section E","2004","60","9","m1251","m1253","10.1107/S1600536804019439","","","0.71073","MoKα","","0.0869","0.0659","","","0.1491","0.1623","","","","","","1.002","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204205","11.0788","0.0003","11.9997","0.0003","12.4604","0.0004","99.336","0.001","106.3","0.001","101.556","0.001","1515.09","0.08","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","diaquaocta-μ-α-methylacrylato-di-α-methylacrylatodipyridinediceriumdizinc","","- C50 H64 Ce2 N2 O22 Zn2 -","- C50 H64 Ce2 N2 O22 Zn2 -","- C50 H64 Ce2 N2 O22 Zn2 -","1","0.5","NG6041","Wu, Bin; Guo, Yong-Sheng","A tetranuclear zinc‒cerium complex: diaquaocta-μ-α-methylacrylato-di-α-methylacrylatodipyridinediceriumdizinc","Acta Crystallographica Section E","2004","60","9","m1261","m1263","10.1107/S1600536804019440","","","0.71069","MoKα","","0.0314","0.0241","","","0.0541","0.0564","","","","","","1.037","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204206","15.149","0.003","9.339","0.002","12.227","0.002","90","","106.87","0.03","90","","1655.4","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4a-Hydroxy-2,3,8a-trimethyl-6-oxo-8-phenylperhydroisoquinolinium chloride","","- C18 H26 Cl N O2 -","- C18 H26 Cl N O2 -","- C72 H104 Cl4 N4 O8 -","4","1","OB6389","Kostochka, Mickael L.; Lezina, Valentina P.; Stash, Adam I.; Vatsadze, Sergey Z.; Zyk, Nikolay V.","4a-Hydroxy-2,3,8a-trimethyl-6-oxo-8-phenylperhydroisoquinolinium chloride","Acta Crystallographica Section E","2004","60","9","o1472","o1473","10.1107/S1600536804018999","","","0.71073","MoKα","","0.0448","0.0274","","","0.0769","0.0804","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204207","8.252","0.0011","10.2384","0.0013","11.3422","0.0015","84.979","0.002","84.407","0.002","78.97","0.002","933.8","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Bis(μ-hydrogen 5-sulfosalicylate)bis[aqua(1,10-phenanthroline)lead(II)]","","- C38 H28 N4 O14 Pb2 S2 -","- C38 H28 N4 O14 Pb2 S2 -","- C38 H28 N4 O14 Pb2 S2 -","1","0.5","OB6398","Li, Jin-Feng; Zhao, Ya-Juan; Li, Xin-Hua; Hu, Mao-Lin","Bis(μ-hydrogen 5-sulfosalicylate)bis[aqua(1,10-phenanthroline)lead(II)]","Acta Crystallographica Section E","2004","60","9","m1210","m1212","10.1107/S1600536804018483","","","0.71073","MoKα","","0.0223","0.0206","","","0.0521","0.0528","","","","","","1.053","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204208","7.6756","0.0006","9.2556","0.0007","10.2911","0.0008","66.459","0.001","88.165","0.002","67.361","0.002","612.18","0.08","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","(E)-2,3-Dichloro-1,1,4,4-tetrakis(4-chlorophenyl)but-2-ene","","- C28 H18 Cl6 -","- C28 H18 Cl6 -","- C28 H18 Cl6 -","1","0.5","OB6399","Shimakoshi, Hisashi; Aritome, Isao; Tokunaga, Mami; Hisaeda, Yoshio","(<i>E</i>)-2,3-Dichloro-1,1,4,4-tetrakis(4-chlorophenyl)but-2-ene","Acta Crystallographica Section E","2004","60","9","o1470","o1471","10.1107/S1600536804018537","","","0.71073","MoKα","","0.0426","0.038","","","0.0946","0.0986","","","","","","1.054","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204209","8.528","0.004","16.85","0.009","10.185","0.006","90","","108.697","0.008","90","","1386.3","1.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Di-μ-methoxobis[dipyridinecopper(II)] diperchlorate","","- C22 H26 Cl2 Cu2 N4 O10 -","- C22 H26 Cl2 Cu2 N4 O10 -","- C44 H52 Cl4 Cu4 N8 O20 -","2","0.5","OB6400","Wang, Jing; Tong, Ming-Liang","Di-μ-methoxo-bis[dipyridinecopper(II)] diperchlorate","Acta Crystallographica Section E","2004","60","9","m1223","m1224","10.1107/S1600536804018987","","","0.71073","MoKα","","0.0428","0.0329","","","0.0924","0.0955","","","","","","1.087","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204210","21.211","0.0009","21.211","0.0009","7.894","0.0004","90","","90","","90","","3551.6","0.3","293","2","293","2","","","","","","","","4","P 42/n :2","-P 4bc","86","","1-(3-Mesityl-3-methylcyclobutyl)-2-(pyrrolidin-1-yl)ethan-1-one","","- C20 H29 N O -","- C20 H29 N O -","- C160 H232 N8 O8 -","8","1","OB6401","Dinçer, Muharrem; Özdemir, Namık; Çukurovalı, Alaaddin; Yılmaz, İbrahim; Büyükgüngör, Orhan","1-(3-Mesityl-3-methylcyclobutyl)-2-(pyrrolidin-1-yl)ethan-1-one","Acta Crystallographica Section E","2004","60","9","o1523","o1524","10.1107/S1600536804019002","","","0.71073","MoKα","","0.1224","0.0681","","","0.1789","0.1941","","","","","","1.013","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204211","7.416","0.002","8.858","0.003","23.718","0.008","90","","94.566","0.006","90","","1553.1","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(acetamido)-4,5-dimethyl-N-(2-methylphenyl)thiophene-3-carboxamide","","- C16 H18 N2 O2 S -","- C16 H18 N2 O2 S -","- C64 H72 N8 O8 S4 -","4","1","OB6402","Vasu; Nirmala, K. A.; Chopra, Deepak; Mohan, S.; Saravanan, J.","2-(Acetamido)-4,5-dimethyl-<i>N</i>-(2-methylphenyl)thiophene-3-carboxamide","Acta Crystallographica Section E","2004","60","9","o1554","o1556","10.1107/S1600536804018781","","","0.71073","MoKα","","0.0486","0.042","","","0.1176","0.1226","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204212","10.281","0.009","11.733","0.01","13.974","0.012","95.781","0.011","109.593","0.011","103.043","0.011","1518","2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","heptaaqua-1κ^3^O,2κ^2^O,3κ^2^O-(μ~3~-2,6- bis{[bis(carboxylatomethyl)amino]methyl}-4-chlorophenolato- 1κO;2κ^4^O,O',N,O^1^;3κ^4^O^1^,N',O'',O''')dizinc(II)sodium(I) pentahydrate","","- C16 H38 Cl N2 Na O21 Zn2 -","- C16 H38 Cl N2 Na O21 Zn2 -","- C32 H76 Cl2 N4 Na2 O42 Zn4 -","2","1","OB6403","Gao, Fei; Meng, Bian-Hong; Zhu, Miao-Li","An Na‒O‒Zn‒O‒Zn bridging complex of Cl-HXTA, where Cl-HXTA is 2,6-bis{[bis(carboxylatomethyl)amino]methyl}-4-chlorophenolate","Acta Crystallographica Section E","2004","60","9","m1225","m1227","10.1107/S1600536804018811","","","0.71073","MoKα","","0.139","0.0974","","","0.1811","0.1988","","","","","","1.083","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204213","13.2381","0.0011","7.8171","0.0004","16.5034","0.0014","90","","94.654","0.007","90","","1702.2","0.2","293","2","293","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","Bis[N-(2,6-dimethylphenyl)aminophenylglyoximato-κ^2^N,N']nickel(II) dimethyl sulfoxide solvate","Bis[N-(2,6-dimethylphenyl)aminophenylglyoximato-κ^2^N,N']nickel(II) dimethyl sulfoxide solvate","","- C34 H38 N6 Ni O5 S -","- C34 H38 N6 Ni O5 S -","- C68 H76 N12 Ni2 O10 S2 -","2","0.5","OB6405","Batı, Hümeyra; Zülfikaroğlu, Ayşin; Taş, Murat; Çalışkan, Nezihe; Soylu, Serkan; Andac, Omer; Büyükgüngör, Orhan","Bis[<i>N</i>-(2,6-dimethylphenyl)aminophenylglyoximato-κ^2^<i>N,N</i>']nickel(II) dimethyl sulfoxide solvate","Acta Crystallographica Section E","2004","60","9","m1334","m1336","10.1107/S1600536804020872","","","0.71073","MoKα","","0.0694","0.0366","","","0.0763","0.0844","","","","","","0.912","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204214","8.8184","0.0004","12.5785","0.0005","18.6036","0.0002","90","","90","","90","","2063.55","0.13","296","1","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C23 H32 O3 -","- C23 H32 O3 -","- C92 H128 O12 -","4","1","OB6406","Gu-Ping Tang; Xiu-Rong Hu; Jian-Ming Gu","20-Oxopregna-5,16-dien-3β-yl acetate","Acta Crystallographica Section E","2004","60","9","o1622","o1623","10.1107/S1600536804020240","","","0.7107","MoKα","","","0.054","","","","0.143","","","","","","1.008","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204215","8.577","0.001","11.42","0.002","11.729","0.001","96.28","0.01","102.43","0.01","92","0.01","1113.2","0.3","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","Methyl 2-amino-4-(4-methylphenyl)-5-oxo-5,6-dihydro-4H-pyrano[3,2-c]quinoline- 3-carboxylate dimethylformamide solvate","","- C24 H25 N3 O5 -","- C24 H25 N3 O5 -","- C48 H50 N6 O10 -","2","1","OB6407","Xiangshan Wang; Zhaosen Zeng; Daqing Shi; Xianyong Wei; Zhimin Zong","Methyl 2-amino-4-(4-methylphenyl)-5-oxo-5,6-dihydro-4<i>H</i>-pyrano[3,2-<i>c</i>]quinoline-3-carboxylate dimethylformamide solvate","Acta Crystallographica Section E","2004","60","9","o1606","o1608","10.1107/S1600536804020586","","","0.71073","MoKα","","0.0946","0.0538","","","0.1538","0.1696","","","","","","0.901","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204216","7.056","0.004","18.202","0.009","18.715","0.009","85.002","0.007","83.941","0.007","80.575","0.006","2352","2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis[tetraamminezinc(II)] tetrapicrate trihydrate","","- C24 H38 N20 O31 Zn2 -","- C24 H38 N20 O31 Zn2 -","- C48 H76 N40 O62 Zn4 -","2","1","OB6408","Qu, Yang; Liu, Zhao-Di; Tan, Min-Yu; Zhu, Hai-Liang","Bis[tetraamminezinc(II)] tetrapicrate trihydrate","Acta Crystallographica Section E","2004","60","9","m1343","m1345","10.1107/S1600536804021014","","","0.71073","MoKα","","0.0651","0.0389","","","0.0877","0.0966","","","","","","0.922","","","","has coordinates,has disorder,has Fobs","203555","2020-10-21","18:00:00",""
"2204217","15.289","0.014","10.644","0.01","15.79","0.015","90","","105.212","0.013","90","","2480","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Methyl 2-(acetylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate","","- C12 H15 N O3 S -","- C12 H15 N O3 S -","- C96 H120 N8 O24 S8 -","8","1","OB6409","Vasu; K. A. Nirmala; Deepak Chopra; S. Mohan; J. Saravanan","Methyl 2-(acetylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate","Acta Crystallographica Section E","2004","60","9","o1654","o1655","10.1107/S1600536804020987","","","0.71073","MoKα","","0.0809","0.0606","","","0.1892","0.2082","","","","","","0.912","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204218","3.8184","0.0008","21.219","0.004","8.2107","0.0017","90","","101.172","0.004","90","","652.6","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-Fluorosalicylic Acid","","- C7 H5 F O3 -","- C7 H5 F O3 -","- C28 H20 F4 O12 -","4","1","OB6413","Choudhury, A. R; Guru Row, T. N.","5-Fluorosalicylic acid","Acta Crystallographica Section E","2004","60","9","o1595","o1597","10.1107/S1600536804020343","","","0.71073","MoKα","","0.0621","0.0469","","","0.1039","0.1112","","","","","","1.122","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204219","12.1542","0.001","13.8359","0.001","15.3928","0.0012","90","","90","","90","","2588.5","0.3","218","2","218","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3,4a-dichloro-10a-(3-chloro-6-hydroxy-2,2,6-trimethyl-cyclohexylmethyl)-6,8- dihydroxy-2,2,7-trimethyl-3,4,4a,10a-tetrahydro-2H-benzo[g]chromene-5,10-dione","","- C26 H33 Cl3 O6 -","- C26 H33 Cl3 O6 -","- C104 H132 Cl12 O24 -","4","1","RN6020","Soria-Mercado, Irma E.; Jensen, Paul R.; Fenical, William.; Kassel, Scott; Golen, James","3,4a-Dichloro-10a-(3-chloro-6-hydroxy-2,2,6-trimethylcyclohexylmethyl)-6,8-dihydroxy-2,2,7-trimethyl-3,4,4a,10a-tetrahydro-2<i>H</i>-benzo[<i>g</i>]chromene-5,10-dione","Acta Crystallographica Section E","2004","60","9","o1627","o1629","10.1107/S1600536804020094","","","0.71073","MoKα","","0.0414","0.0376","","","0.0923","0.0948","","","","","","1.037","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204220","7.498","0.001","10.449","0.002","11.861","0.002","110.37","0.01","104.62","0.01","96.57","0.01","821.7","0.3","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","2-Chloro-N-[N-(4-chlorobenzoyl)hydrazinocarbothioyl]benzamide","","- C15 H11 Cl2 N3 O2 S -","- C15 H11 Cl2 N3 O2 S -","- C30 H22 Cl4 N6 O4 S2 -","2","1","RN6021","Ali, Hapipah; Yusof, M. Sukeri; Khamis, Nur Ashikin; Mardi, A. Sahali; Yamin, Bohari M.","2-Chloro-<i>N</i>-[<i>N</i>-(4-chlorobenzoyl)hydrazinocarbothioyl]benzamide","Acta Crystallographica Section E","2004","60","9","o1656","o1658","10.1107/S1600536804020525","","","0.71073","MoKα","","0.045","0.04","","","0.108","0.112","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204221","12.2476","0.0008","6.5706","0.0004","10.6592","0.0008","90","","92.744","0.001","90","","856.81","0.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C4 H15 N2 O4 P -","- C4 H15 N2 O4 P -","- C16 H60 N8 O16 P4 -","4","1","SJ6000","Harrison, William T. A.","Piperizinium hydrogen phosphite monohydrate","Acta Crystallographica Section E","2004","60","9","o1577","o1579","10.1107/S1600536804020185","","","0.71073","MoKα","","0.0557","0.0422","","","0.1228","0.1308","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204222","4.3681","0.0003","19.1969","0.0012","15.027","0.0009","90","","97.57","0.004","90","","1249.09","0.14","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(3-Allyloxy-2-bromophenoxy)but-2-enenitrile","","- C13 H12 Br N O2 -","- C13 H12 Br N O2 -","- C52 H48 Br4 N4 O8 -","4","1","SJ6002","Kirsop, Peter; Storey, John M. D.; Harrison, William T. A.","4-(3-Allyloxy-2-bromophenoxy)but-2-enenitrile","Acta Crystallographica Section E","2004","60","9","o1636","o1638","10.1107/S1600536804020677","","","0.71073","MoKα","","0.0972","0.055","","","0.1179","0.1333","","","","","","1.022","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204223","9.3359","0.0006","14.4051","0.0008","16.3707","0.0011","90","","123.459","0.004","90","","1836.8","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl 1-n-butyl-2-(3,4-dichlorophenyl)-1H-benzimidazole-5-carboxylate","","- C19 H18 Cl2 N2 O2 -","- C19 H18 Cl2 N2 O2 -","- C76 H72 Cl8 N8 O8 -","4","1","SU6109","Burcu Arslan; Canan Kazak; Hacer Karataş; Seçkin Özden","Methyl 1-<i>n</i>-butyl-2-(3,4-dichlorophenyl)-1<i>H</i>-benzimidazole-5-carboxylate","Acta Crystallographica Section E","2004","60","9","o1535","o1537","10.1107/S1600536804019610","","","0.71073","MoKα","","0.07","0.0428","","","0.1085","0.1169","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204224","9.193","0.0018","17.752","0.004","12.779","0.003","90","","103.43","0.03","90","","2028.4","0.8","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,2,5,5-Tetramethyl-1,6-diphenyl-7,8-diselenabicyclo[4.1.1]octane 7,8-dioxide","","- C22 H26 O2 Se2 -","- C22 H26 O2 Se2 -","- C88 H104 O8 Se8 -","4","1","SU6120","Meng-Xin Ding; Bing Ma; Ran Zhu; Hai-Tao Sha; Ji Shao; Xin Sheng","2,2,5,5-Tetramethyl-1,6-diphenyl-7,8-diselenabicyclo[4.1.1]octane 7,8-dioxide","Acta Crystallographica Section E","2004","60","9","o1458","o1459","10.1107/S1600536804018392","","","0.71073","MoKα","","0.0979","0.0578","","","0.1941","0.2348","","","","","","1.144","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204225","8.837","0.0018","15.488","0.003","15.155","0.003","90","","105.87","0.03","90","","1995.2","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N,N'-Bis[2-(methylsulfanyl)phenyl]pyridine-2,6-dicarboxamide","","- C21 H19 N3 O2 S2 -","- C21 H19 N3 O2 S2 -","- C84 H76 N12 O8 S8 -","4","1","SU6122","Liu, Sheng-Gui; You, Xiao-Zeng; Li, Yi-Zhi; Zuo, Jing-Lin","<i>N,N</i>'-Bis[2-(methylsulfanyl)phenyl]pyridine-2,6-dicarboxamide","Acta Crystallographica Section E","2004","60","9","o1527","o1529","10.1107/S1600536804018409","","","0.71073","MoKα","","0.0741","0.0468","","","0.0998","0.1028","","","","","","1.074","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204226","7.5989","0.0017","13.185","0.004","23.38","0.005","90","","91.527","0.012","90","","2341.6","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[tris(ethylenediamine-κ^2^N,N')nickel(II) bis{naphthalene-2,6-disulfonate) dihydrate","","- C16 H32 N6 Ni O7 S2 -","- C16 H32 N6 Ni O7 S2 -","- C64 H128 N24 Ni4 O28 S8 -","4","1","SU6128","Li-Hua Huo; Shan Gao; Zhen-Zhong Lu; Shi-Xiao Xu; Hui Zhao","Tris(ethylenediamine-κ^2^<i>N,N</i>')nickel(II) naphthalene-2,6-disulfonate monohydrate","Acta Crystallographica Section E","2004","60","9","m1205","m1207","10.1107/S1600536804018471","","","0.71073","MoKα","","0.0706","0.056","","","0.1478","0.1587","","","","","","1.056","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204227","7.5982","0.0009","8.5208","0.0011","11.6213","0.0014","101.059","0.01","96.146","0.009","113.501","0.009","662.94","0.16","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-(3-Methoxyphenylsulfanyl)phthalonitrile","","- C15 H10 N2 O S -","- C15 H10 N2 O S -","- C30 H20 N4 O2 S2 -","2","1","SU6129","Erdem, Talip Kaya; Atalay, Şehriman; Akdemir, Nesuhi; Ağar, Erbil; Özil ,Musa","4-(3-Methoxyphenylsulfanyl)phthalonitrile","Acta Crystallographica Section E","2004","60","9","o1481","o1482","10.1107/S1600536804018495","","","0.71073","MoKα","","0.0869","0.0572","","","0.1444","0.1593","","","","","","0.997","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204228","15.297","0.002","8.8543","0.0014","7.2805","0.0008","90","","92.321","0.01","90","","985.3","0.2","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","adenosinium 3,5-dinitrosalicylate","adenosinium 3,5-dinitrosalicylate","","- C17 H17 N7 O11 -","- C17 H17 N7 O11 -","- C34 H34 N14 O22 -","2","1","SU6130","Graham Smith; Urs D. Wermuth; Peter C. Healy","Adenosinium 3,5-dinitrosalicylate","Acta Crystallographica Section E","2004","60","9","o1573","o1576","10.1107/S1600536804019920","","","0.71069","MoKα","","0.0587","0.0365","","","0.0931","0.1216","","","","","","0.88","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204229","10.2453","0.0017","15.388","0.003","12.359","0.002","90","","100.189","0.003","90","","1917.7","0.6","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis{2'-[1-(2-hydroxy-5-chlorophenyl)ethylidine]benzohydrazido- κ^2^O,N^2'^}bis(pyridine-κN)zinc(II)","","- C40 H34 Cl2 N6 O4 Zn -","- C40 H34 Cl2 N6 O4 Zn -","- C80 H68 Cl4 N12 O8 Zn2 -","2","0.5","SU6131","Hapipah Ali; Khamis, Nur Ashikin; Bohari. M.Yamin","Bis{2'-[1-(2-hydroxy-5-chlorophenyl)ethylidene]benzohydrazido-κ^2^<i>O</i>,<i>N</i>^2'^}bis(pyridine-κ<i>N</i>)zinc(II)","Acta Crystallographica Section E","2004","60","9","m1311","m1313","10.1107/S1600536804020501","","","0.71073","MoKα","","0.0667","0.0535","","","0.126","0.1344","","","","","","1.083","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204230","19.1402","0.0009","5.4608","0.0002","16.8888","0.0007","90","","90","","90","","1765.23","0.13","105","","105","","","","","","","","","5","P c a 21","P 2c -2ac","29","","tris(3-nitrophenyl)phosphine oxide","","- C18 H12 N3 O7 P -","- C18 H12 N3 O7 P -","- C72 H48 N12 O28 P4 -","4","1","SU6134","Jean-Noël, Gregory; Fronczek, Frank R.; Isovitsch, Ralph","Tris(3-nitrophenyl)phosphine oxide","Acta Crystallographica Section E","2004","60","9","o1646","o1647","10.1107/S1600536804020732","","","0.71073","MoKα","","0.072","0.044","","","0.079","0.087","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204231","8.9496","0.0006","15.1684","0.0012","24.86","0.002","107.509","0.002","91.601","0.002","100.455","0.002","3152.7","0.4","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","μ-Oxo-bis[(protoporphyrin IX dimethyl ester)iron(III)]","","- C72 H72 Fe2 N8 O9 -","- C72 H72 Fe2 N8 O9 -","- C144 H144 Fe4 N16 O18 -","2","1","TK6178","Cheng, Lin; Lee, Jonghyuk; Powell, Douglas R.; Richter-Addo, George B.","μ-Oxo-bis[(protoporphyrin IX dimethyl ester)iron(III)]","Acta Crystallographica Section E","2004","60","9","m1340","m1342","10.1107/S1600536804020951","","","0.71073","MoKα","","0.114","0.067","","","0.186","0.216","","","","","","1.05","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2204232","15.639","0.003","10.152","0.002","19.996","0.004","90","","92.23","0.03","90","","3172.3","1.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Aqua(benzene-1,4-dioxyacetate)bis(2,2-bipyridine)cobalt(II) tetrahydrate","","- C30 H34 Co N4 O11 -","- C30 H34 Co N4 O11 -","- C120 H136 Co4 N16 O44 -","4","1","TK6179","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui","Aqua(benzene-1,4-dioxyacetate)bis(2,2-bipyridine)cobalt(II) tetrahydrate","Acta Crystallographica Section E","2004","60","9","m1202","m1204","10.1107/S160053680401846X","","","0.71073","MoKα","","0.097","0.051","","","0.085","0.097","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204233","7.884","0.0001","10.5648","0.0001","24.6438","0.0004","90","","90","","90","","2052.65","0.05","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","O^2^,O^3^:O^4^,O^5^-Bis(phenylboranediyl)-β-D-fructopyranose acetone solvate","","- C21 H24 B2 O7 -","- C21 H24 B2 O7 -","- C84 H96 B8 O28 -","4","1","TK6180","Draffin, Scott P.; Duggan, Peter J.; Fallon, Gary D.","<i>O</i>^2^,<i>O</i>^3^:<i>O</i>^4^,<i>O</i>^5^-Bis(phenylboranediyl)-β-<small>D</small>-fructopyranose acetone solvate","Acta Crystallographica Section E","2004","60","9","o1520","o1522","10.1107/S1600536804019245","","","0.71073","MoKα","","0.06","0.037","","","0.078","0.084","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204234","6.828","0.002","7.197","0.003","7.384","0.003","70.22","0.01","74.28","0.01","65.7","0.01","307.5","0.2","174","2","174","2","","","","","","","","4","P -1","-P 1","2","","m-Cyanophenol","","- C7 H5 N O -","- C7 H5 N O -","- C14 H10 N2 O2 -","2","1","TK6181","Britton, Doyle","<i>m</i>-Cyanophenol","Acta Crystallographica Section E","2004","60","9","o1513","o1514","10.1107/S1600536804019257","","","0.71073","MoKα","","0.041","0.036","","","0.103","0.107","","","","","","1.12","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204235","8.4219","0.0013","9.962","0.0012","12.4307","0.0015","90","","90.916","0.011","90","","1042.8","0.2","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl 2-amino-5-isopropyl-1,3-thiazole-4-carboxylate","","- C8 H12 N2 O2 S -","- C8 H12 N2 O2 S -","- C32 H48 N8 O8 S4 -","4","1","TK6182","Kennedy, Alan R.; Khalaf, Abedawn I.; Suckling, Colin J.; Waigh, Roger D.","Methyl 2-amino-5-isopropyl-1,3-thiazole-4-carboxylate","Acta Crystallographica Section E","2004","60","9","o1510","o1512","10.1107/S1600536804019282","","","0.71069","MoKα","","0.098","0.041","","","0.106","0.125","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204236","9.6708","0.0002","17.0961","0.0003","10.3028","0.0002","90","","109.665","0.001","90","","1604.04","0.05","220","2","220","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","triphenylsilyl azide","azidotriphenylsilane","","- C18 H15 N3 Si -","- C18 H15 N3 Si -","- C72 H60 N12 Si4 -","4","1","TK6184","Wharf, Ivor; Bélanger-Gariépy, Francine","Azidotriphenylsilane: a new determination","Acta Crystallographica Section E","2004","60","9","o1643","o1645","10.1107/S1600536804020112","","","1.54178","CuKα","","0.044","0.039","","","0.117","0.121","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204237","10.2","0.0008","15.254","0.001","22.986","0.002","90","","90.508","0.006","90","","3576.3","0.5","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","26,28-Bis(benzyloxy)-25,27-dihydroxy-5,17-dinitrocalix[4]arene","","- C43 H38 N2 O9 -","- C42 H34 N2 O8 -","- C168 H136 N8 O32 -","4","1","TK6185","Bolte, Michael; Sakhaii, Peyman","26,28-Bis(benzyloxy)-25,27-dihydroxy-5,17-dinitrocalix[4]arene methanol solvate","Acta Crystallographica Section E","2004","60","9","o1639","o1640","10.1107/S1600536804020860","","","0.71073","MoKα","","0.088","0.057","","","0.139","0.153","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204238","14.635","0.007","12.476","0.005","15.314","0.007","90","","115.726","0.005","90","","2519","2","113.2","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H23 Cl2 N5 O5 Zn -","- C23 H23 Cl2 N5 O5 Zn -","- C92 H92 Cl8 N20 O20 Zn4 -","4","1","WK6023","Kojima, Takahiko; Weber, David M.; Choma, Christin T.","{<i>N</i>-[Bis(2-pyridyl)methyl]-<i>N,N</i>-bis(2-pyridyl)methylamine-κ^5^<i>N</i>}chlorozinc(II) perchlorate monohydrate","Acta Crystallographica Section E","2004","60","9","m1291","m1292","10.1107/S1600536804019889","","","0.7107","MoKα","","","0.056","","","","0.163","","","","","","1.512","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204239","7.0467","0.0005","17.6802","0.0013","11.2725","0.0007","90","","104.355","0.005","90","","1360.56","0.17","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-Benzyl-4-phenyl-2,4-dihydro-1,2,4-triazole-3-thione","","- C15 H13 N3 S -","- C15 H13 N3 S -","- C60 H52 N12 S4 -","4","1","WK6024","Mehmet Akkurt; Sema Öztürk; Süleyman Servi; Ahmet Cansız; Memet Şekerci; Canan Kazak","5-Benzyl-4-phenyl-2,4-dihydro-1,2,4-triazole-3-thione","Acta Crystallographica Section E","2004","60","9","o1507","o1509","10.1107/S1600536804019099","","","0.71073","MoKα","","0.063","0.039","","","0.09","0.096","","","","","","0.89","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204240","9.5227","0.0007","10.2195","0.0007","17.5587","0.0012","73.238","0.004","75.348","0.004","87.593","0.004","1582.1","0.2","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H8 Cl5 O2 P -","- C13 H8 Cl5 O2 P -","- C52 H32 Cl20 O8 P4 -","4","2","WK6025","Pinkus, A. G.; Klausmeyer, Kevin K.; Feazell, Rodney P.; Meng, Liliy Y. C.","α,α,4-Trichloro-α-phenyl-<i>o</i>-tolyl dichlorophosphinate","Acta Crystallographica Section E","2004","60","9","o1486","o1487","10.1107/S1600536804018719","","","0.71073","MoKα","","0.031","0.025","","","0.068","0.071","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204241","12.451","0.004","18.447","0.006","12.676","0.005","90","","99.72","0.008","90","","2869.7","1.7","137","2","137","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Di(bistrimethylsilylcyclopentadienyl)vanadium","Bis[η^5^-1,3-bis(trimethylsilyl)cyclopentadienyl]vanadium(II)","","- C22 H42 Si4 V -","- C22 H42 Si4 V -","- C88 H168 Si16 V4 -","4","0.5","WK6028","Chadwick D. Sofield; Marc D. Walter; Richard A. Andersen","Bis[η^5^-1,3-bis(trimethylsilyl)cyclopentadienyl]vanadium(II)","Acta Crystallographica Section E","2004","60","9","m1296","m1297","10.1107/S1600536804020276","","","0.71069","MoKα","","0.071","0.048","","","0.127","0.134","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204242","6.3987","0.0007","6.6899","0.0007","17.2975","0.0019","90","","90","","90","","740.45","0.14","153","2","153","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Rubidium lead phosphorus tetrasulfide","","- P Pb Rb S4 -","- P Pb Rb S4 -","- P4 Pb4 Rb4 S16 -","4","1","WM6026","Yao, Jiyong; Ibers, James A.","RbPbPS~4~","Acta Crystallographica Section E","2004","60","9","i108","i110","10.1107/S1600536804018513","","","0.71073","MoKα","","0.0215","0.02","","","0.0486","0.0491","","","","","","1.388","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204243","16.374","0.002","4.2382","0.0005","18.78","0.002","90","","90","","90","","1303.3","0.3","153","2","153","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Dicesium dibismuth zinc pentaselenide","","- Bi2 Cs2 Se5 Zn -","- Bi2 Cs2 Se5 Zn -","- Bi8 Cs8 Se20 Zn4 -","4","0.5","WM6027","Yao, Jiyong; Ibers, James A.","Cs~2~Bi~2~ZnSe~5~","Acta Crystallographica Section E","2004","60","9","i111","i113","10.1107/S1600536804018501","","","0.71073","MoKα","","0.0283","0.0253","","","0.0645","0.0658","","","","","","1.149","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204244","9.7342","0.0005","9.7342","0.0005","24.4754","0.0014","90","","90","","120","","2008.45","0.19","293","2","293","2","","","","","","","","4","R 3 c :H","R 3 -2""c","161","Potassium tetratin(II) tris(orthophosphate)","Potassium tetratin(II) tris(orthophosphate)","","- K O12 P3 Sn4 -","- K O12 P3 Sn4 -","- K6 O72 P18 Sn24 -","6","0.333333","WM6028","Deng, Jin-Feng; Kang, You-Jun; Mi, Jin-Xiao; Li, Man-Rong; Zhao, Jing-Tai; Mao, Shao-Yu","KSn~4~(PO~4~)~3~","Acta Crystallographica Section E","2004","60","9","i116","i117","10.1107/S160053680401966X","","","0.71073","MoKα","","0.0172","0.0168","","","0.0404","0.0406","","","","","","1.246","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204245","7.474","0.001","10.545","0.001","8.568","0.001","90","","100.223","0.009","90","","664.55","0.14","288","2","288","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(E)-2-(4-Chlorobenzylidene)cyclooctanone","","- C15 H17 Cl O -","- C15 H17 Cl O -","- C30 H34 Cl2 O2 -","2","1","WN6265","Shen-Lin Huang; Yu-Lin Zhu; Yuan-Jiang Pan","(<i>E</i>)-2-(4-Chlorobenzylidene)cyclooctanone","Acta Crystallographica Section E","2004","60","9","o1504","o1506","10.1107/S1600536804017994","","","0.71073","MoKα","","0.0508","0.0356","","","0.0755","0.079","","","","","","0.962","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204246","10.4802","0.0007","7.1166","0.001","14.6924","0.00014","90","","90","","90","","1095.81","0.17","298","2","298","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","(E)-4,4,4-Trichloro-1-phenylbut-2-en-1-one","","- C10 H7 Cl3 O -","- C10 H7 Cl3 O -","- C40 H28 Cl12 O4 -","4","0.5","WN6272","Zhang, Xing-Guo; Zhong, Ping; Hu, Mao-Lin; Wang, Dan-Yan; Lin, Dan","(<i>E</i>)-4,4,4-Trichloro-1-phenylbut-2-en-1-one","Acta Crystallographica Section E","2004","60","9","o1465","o1466","10.1107/S1600536804018549","","","0.71073","MoKα","","0.0861","0.0788","","","0.2209","0.2277","","","","","","1.079","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204247","9.939","0.003","9.988","0.003","11.546","0.004","80.848","0.005","86.55","0.006","62.444","0.005","1003.1","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-(4-methylphenyl)-1-phenyl-3-(p-tolylsulfonylamino)propan-1-one","","- C23 H23 N O3 S -","- C23 H23 N O3 S -","- C46 H46 N2 O6 S2 -","2","1","WW6257","Yu, Zhifang; Zhao, Bing; Gu, Xiuyan; Liu, Yi","3-(<i>p</i>-Tolyl)-1-phenyl-3-(<i>p</i>-tolylsulfonylamino)propan-1-one","Acta Crystallographica Section E","2004","60","9","o1474","o1475","10.1107/S1600536804018343","","","0.71073","MoKα","","0.098","0.0581","","","0.1412","0.1648","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204248","7.188","0.002","17.363","0.005","8.297","0.002","90","","93.267","0.005","90","","1033.8","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-Ethoxy-5-(1-hydroxyethyl)-1-methylpyrrolidin-2-one","","- C9 H17 N O3 -","- C9 H17 N O3 -","- C36 H68 N4 O12 -","4","1","WW6258","Ma, Guo-Chun; Liu, Hui-Min; Zhang, Wen-Qin","5-Ethoxy-5-(1-hydroxyethyl)-1-methylpyrrolidin-2-one","Acta Crystallographica Section E","2004","60","9","o1541","o1542","10.1107/S1600536804019026","","","0.71073","MoKα","","0.0932","0.0539","","","0.1145","0.13","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204249","12.356","0.004","7.309","0.002","6.508","0.002","90","","120.796","0.005","90","","504.9","0.3","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","catena-Poly[[dimethanolcobalt(II)]-di-μ-1,5-dicyanamido]","","- C6 H8 Co N6 O2 -","- C6 H8 Co N6 O2 -","- C12 H16 Co2 N12 O4 -","2","0.25","WW6261","Zhou, Ai-Ju; Zheng, Ling-Ling; Tong, Ming-Liang","<i>catena</i>-Poly[[dimethanolcobalt(II)]-di-μ-1,5-dicyanamido]","Acta Crystallographica Section E","2004","60","9","m1254","m1255","10.1107/S1600536804019452","","","0.71073","MoKα","","0.0279","0.0275","","","0.0744","0.0747","","","","","","1.198","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204250","8.583","0.0002","18.5242","0.0004","9.3889","0.0002","90","","93.359","0.001","90","","1490.21","0.06","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-tert-Butyl-2-(N,N-dimethylaminocarbonylthio)isophthalaldehyde","","- C15 H19 N O3 S -","- C15 H19 N O3 S -","- C60 H76 N4 O12 S4 -","4","1","WW6265","McKenzie, Christine, J.; Bond, Andrew D.","5-<i>tert</i>-Butyl-2-(<i>N</i>,<i>N</i>-dimethylaminocarbonylthio)isophthalaldehyde","Acta Crystallographica Section E","2004","60","9","o1525","o1526","10.1107/S1600536804019233","","","0.71073","MoKα","","0.0514","0.0372","","","0.1045","0.1122","","","","","","1.071","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204251","6.906","0.007","12.538","0.013","9.099","0.009","90","","91.012","0.017","90","","787.7","1.4","293","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-amino-7-chloro-1,8-naphthyridine","","- C8 H6 Cl N3 -","- C8 H6 Cl N3 -","- C32 H24 Cl4 N12 -","4","1","WW6272","Yudong, Shen; Haiqiang, Wu; Xianzhang, Bu; Lianquan, Gu","2-Amino-7-chloro-1,8-naphthyridine","Acta Crystallographica Section E","2004","60","9","o1641","o1642","10.1107/S1600536804020884","","","0.71073","MoKα","","0.0417","0.0357","","","0.1026","0.1081","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204252","11.3309","0.0003","9.8033","0.0002","17.7075","0.0003","90","","106.487","0.001","90","","1886.08","0.07","102","2","102","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 Br P -","- C22 H24 Br P -","- C88 H96 Br4 P4 -","4","1","WW6273","Czerwinski, Edmund W.","Isobutyltriphenylphosphonium bromide","Acta Crystallographica Section E","2004","60","9","o1601","o1602","10.1107/S1600536804020483","","","1.5418","CuKα","","0.046","0.0392","","","","0.112","","","","","","1.133","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204253","12.6009","0.0017","20.845","0.003","12.6417","0.0017","90","","90.418","0.003","90","","3320.5","0.8","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","{4-Chloro-2'-[1-(5-chloro-2-oxidophenyl)ethylidene- κ^3^O,N^2'^,O']benzhydrazido}tris(pyridine-κN)nickel(II) pyridine solvate","","- C35 H30 Cl2 N6 Ni O2 -","- C35 H30 Cl2 N6 Ni O2 -","- C140 H120 Cl8 N24 Ni4 O8 -","4","1","YA6210","Ali, Hapipah; Khamis, Nur Ashikin; Basirun, W. Jefri; Yamin, Bohari M.","{4-Chloro-2'-[1-(5-chloro-2-oxidophenyl)ethylidene-κ^3^<i>O,N</i>^2'^,<i>O</i>']benzhydrazido}tris(pyridine-κ<i>N</i>)nickel(II) pyridine solvate","Acta Crystallographica Section E","2004","60","9","m1351","m1352","10.1107/S1600536804020756","","","0.71073","MoKα","","0.095","0.061","","","0.127","0.141","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204255","11.3605","0.0016","11.2772","0.0015","13.5039","0.0019","90","","91.269","0.003","90","","1729.6","0.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Dichloro[3,3'-bis(ethoxycarbonyl)-2,2'-bipyridyl-κ^2^N,N']copper(II)","","- C16 H16 Cl2 Cu N2 O4 -","- C16 H16 Cl2 Cu N2 O4 -","- C64 H64 Cl8 Cu4 N8 O16 -","4","0.5","AC6111","Wu, Ben-Lai; Zhou, You-Fu; Han, Lei; Hong, Mao-Chun","Dichloro[3,3'-bis(ethoxycarbonyl)-2,2'-bipyridyl-κ^2^<i>N,N</i>']copper(II)","Acta Crystallographica Section E","2004","60","10","m1365","m1366","10.1107/S1600536804021257","","","0.71073","MoKα","","0.0919","0.0683","","","0.1266","0.1379","","","","","","1.234","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2204256","11.9264","0.0013","9.2297","0.001","7.6075","0.0008","90","","105.381","0.002","90","","807.42","0.15","153","2","153","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","tetramethyl terphenyl","3,3',5,5'-tetramethylterphenyl","","- C22 H22 -","- C22 H22 -","- C44 H44 -","2","0.5","AC6115","Xu, Jiyang; Côté, Adrien P.; Chen, Banglin","3,3',5,5'-Tetramethylterphenyl","Acta Crystallographica Section E","2004","60","10","o1697","o1698","10.1107/S1600536804021282","","","0.71073","MoKα","","0.0527","0.0469","","","0.1657","0.1766","","","","","","0.743","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204257","10.009","0.002","10.519","0.003","13.311","0.001","106.822","0.013","99.037","0.013","100.245","0.019","1287.3","0.5","293","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C33 H29 N S -","- C33 H29 N S -","- C66 H58 N2 S2 -","2","1","AC6116","Brito, Ivań; Vargas, Danitza; Leoń, Yasna; Caŕdenas, Alejandro; Loṕez-Rodriǵuez, Matiás; Wittke, Oscar","<i>N,N</i>-Dibenzyltriphenylmethanesulfenamide","Acta Crystallographica Section E","2004","60","10","o1668","o1670","10.1107/S1600536804021427","","","1.5418","CuKα","","","0.0426","","","","0.1223","","","","","","1.068","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204258","12.566","0.014","10.235","0.011","4.279","0.004","90","","104.92","0.04","90","","531.8","1","296.1","","","","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C12 H8 Ag Cl N2 -","- C12 H8 Ag Cl N2 -","- C24 H16 Ag2 Cl2 N4 -","2","0.5","AC6117","Odoko, Mamiko; Wang, Yue; Okabe, Nobuo","<i>catena</i>-Poly[[(1,10-phenanthroline-κ^2^<i>N,N</i>')silver(I)]-μ-chloro]","Acta Crystallographica Section E","2004","60","10","m1522","m1524","10.1107/S1600536804023724","","","0.7107","MoKα","","","0.036","","","","0.066","","","","","","0.887","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204259","11.602","0.003","6.2657","0.0012","10.898","0.002","90","","106.85","0.02","90","","758.2","0.3","298","","298","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C14 H13 N3 O6 -","- C14 H13 N3 O6 -","- C28 H26 N6 O12 -","2","1","AC6119","Ohba, Shigeru; Ito, Yoshikatsu; Arimoto, Satoru","Benzylammonium 3,5-dinitrobenzoate","Acta Crystallographica Section E","2004","60","10","o1833","o1834","10.1107/S1600536804022962","","","0.71073","MoKα","","","0.0403","","","","0.1061","","","","","","1.083","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204260","14.546","0.003","15.065","0.004","6.93","0.002","90","","90","","90","","1518.6","0.7","298","","298","","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C14 H15 N3 O9 -","- C14 H15 N3 O9 -","- C56 H60 N12 O36 -","4","1","AC6120","Ohba, Shigeru; Ito, Yoshikatsu; Arimoto, Satoru","3,4-Dihydroxybenzylammonium 3,5-dinitrobenzoate monohydrate","Acta Crystallographica Section E","2004","60","10","o1835","o1836","10.1107/S1600536804022974","","","0.71073","MoKα","","","0.0334","","","","0.0896","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204261","8.2811","0.0014","13.071","0.002","25.204","0.004","85.82","0.01","87.96","0.01","82.54","0.01","2696.9","0.8","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","Bis(tetradecylammonium) 7-hydroxy-8-phenyldiazenyl-7,8-dihydronaphthalene-1,3-disulfonate 1.8-hydrate","","- C50 H89.6 N4 O8.8 S2 -","- C50 H89.606 N4 O8.803 S2 -","- C100 H179.212 N8 O17.606 S4 -","2","1","BT6497","Faul, Charl F. J.; Antonietti, Markus; Massa, Werner","Bis[trimethyl(tetradecyl)ammonium] 7-hydroxy-8-phenyldiazenyl-7,8-dihydronaphthalene-1,3-disulfonate 1.8-hydrate: ionic self-assembly","Acta Crystallographica Section E","2004","60","10","o1769","o1772","10.1107/S1600536804020380","","","0.71073","MoKα","","0.195","0.0524","","","0.0557","0.0754","","","","","","0.745","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2204262","12.6936","0.0019","17.023","0.003","16.809","0.003","90","","102.843","0.003","90","","3541.3","1","220","2","220","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(η^8^-Cyclooctenyl)(m-terphenyl)lutetium-μ-chloro-[tris(tetra- hydrofuran)lithium(I)]","","- C38 H45 Cl Li Lu O3 -","- C38 H45 Cl Li Lu O3 -","- C152 H180 Cl4 Li4 Lu4 O12 -","4","1","BT6499","Rabe, Gerd W.; Zhang-Preße, Mei; Riederer, Florian A.; Incarvito, Christopher D.; Golen, James A.; Rheingold, Arnold L.","(η^8^-Cyclooctatetraenyl)(<i>m</i>-terphenyl)lutetium-μ-chloro-[tris(tetrahydrofuran)lithium(I)]","Acta Crystallographica Section E","2004","60","10","m1389","m1390","10.1107/S1600536804021439","","","0.71073","MoKα","","0.044","0.0296","","","0.0697","0.077","","","","","","1.021","","","","has coordinates,has disorder,has Fobs","194388","2020-10-21","18:00:00",""
"2204263","5.036","0.002","18.915","0.002","6.152","0.001","90","","96.21","0.02","90","","582.6","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","catena-(bis(υ~2~-L-asparaginato-N,O,O')copper(II)","","","- C8 H14 Cu N4 O6 -","- C8 H14 Cu N4 O6 -","- C16 H28 Cu2 N8 O12 -","2","1","BT6505","Vencato, Ivo; Lariucci, Carlito; Ferreira, Katiuscia D.; Santana, Ricardo C.; Carvalho, Jesiel F.","Redetermination of bis(<small>L</small>-asparaginato)copper(II)","Acta Crystallographica Section E","2004","60","10","m1428","m1430","10.1107/S1600536804022202","","","1.5418","CuKα","","0.034","0.034","","","0.092","0.092","","","","","","1.23","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204264","6.673","0.0011","7.5834","0.0013","7.6157","0.0013","105.401","0.003","93.134","0.003","115.089","0.002","330.26","0.1","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","5,5-dihydroxybarbituric acid monohydrate","","- C4 H6 N2 O6 -","- C4 H6 N2 O6 -","- C8 H12 N4 O12 -","2","1","BT6506","Thomas C. Lewis; Derek A. Tocher","5,5-Dihydroxybarbituric acid monohydrate (alloxan dihydrate)","Acta Crystallographica Section E","2004","60","10","o1689","o1690","10.1107/S1600536804021555","","","0.71073","MoKα","","0.0545","0.0427","","","0.096","0.1021","","","","","","1.072","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204265","9.4614","0.0008","12.2095","0.001","7.2973","0.0006","90","","91.465","0.001","90","","842.7","0.12","150","2","150","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","5,5-dihydroxybarbituric acid trihydrate","","- C4 H10 N2 O8 -","- C4 H10 N2 O8 -","- C16 H40 N8 O32 -","4","0.5","BT6507","Thomas C. Lewis; Derek A. Tocher","Redetermination of 5,5-dihydroxybarbituric acid trihydrate (alloxan tetrahydrate)","Acta Crystallographica Section E","2004","60","10","o1748","o1750","10.1107/S1600536804022019","","","0.71073","MoKα","","0.0286","0.0283","","","0.0771","0.0775","","","","","","1.116","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204266","4.7934","0.0009","23.634","0.004","9.34","0.001","90","","104.48","0.03","90","","1024.5","0.3","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","catena-Poly[zinc(II)-μ-1,4-phenylenedioxydiacetato-κ^2^O:O']","","- C10 H8 O6 Zn -","- C10 H8 O6 Zn -","- C40 H32 O24 Zn4 -","4","1","BT6509","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","Poly[zinc(II)-μ~4~-1,4-phenylenedioxydiacetato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2004","60","10","m1370","m1371","10.1107/S1600536804021336","","","0.71073","MoKα","","0.044","0.035","","","0.085","0.088","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204267","12.011","0.0001","12.011","0.0001","14.4768","0.0003","90","","90","","90","","2088.48","0.05","213","2","213","2","","","","","","","","5","P -4 21 c","P -4 2n","114","","Bis(μ-N-methylethylamido)bis[tert-butylchloroaluminium]","","- C14 H34 Al2 Cl2 N2 -","- C14 H34 Al2 Cl2 N2 -","- C56 H136 Al8 Cl8 N8 -","4","0.5","BT6510","Hecht, Elmar","Bis(μ-<i>N</i>-methylethylamido)bis[<i>tert</i>-butylchloroaluminium]","Acta Crystallographica Section E","2004","60","10","m1387","m1388","10.1107/S1600536804021622","","","0.71073","MoKα","","0.0873","0.0597","","","0.1086","0.1236","","","","","","1.17","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204268","11.654","0.002","7.8702","0.0006","10.855","0.002","90","","93.42","0.01","90","","993.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Piperazinium dichromate(VI)","Piperazinium dichromate(VI)","","- C4 H12 Cr2 N2 O7 -","- C4 H12 Cr2 N2 O7 -","- C16 H48 Cr8 N8 O28 -","4","1","BT6511","Srinivasan, Bikshandarkoil R.; Naik, Ashish R.; Näther, Christian; Bensch, Wolfgang","Piperazinium dichromate(VI)","Acta Crystallographica Section E","2004","60","10","m1384","m1386","10.1107/S1600536804021543","","","0.71073","MoKα","","0.0368","0.0263","","","0.0742","0.0778","","","","","","1.07","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204269","10.789","0.003","15.42","0.004","11.742","0.003","90","","90.555","0.004","90","","1953.4","0.9","295","2","295","2","","","","","","","","5","C 1 c 1","C -2yc","9","","Bis(N,N-dimethylformamide)-1,2,4,5-benzenedicarboxylatodicobalt(II)","","- C16 H16 Co2 N2 O10 -","- C16 H16 Co2 N2 O10 -","- C64 H64 Co8 N8 O40 -","4","1","BT6512","Fu, Yun-Long; Ren, Jia-Lin; Ng, Seik Weng","Octahedral and tetrahedral coordination for cobalt(II) in polymeric (μ~8~-benzene-1,2,4,5-tetracarboxylato)bis(<i>N</i>,<i>N</i>-dimethylformamide)dicobalt","Acta Crystallographica Section E","2004","60","10","m1400","m1402","10.1107/S1600536804021944","","","0.71073","MoKα","","0.0719","0.0548","","","0.1223","0.1488","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204270","16.603","0.003","16.565","0.003","17.483","0.004","90","","90","","90","","4808.3","1.7","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3,4-Dibenzoyl-2,5-dimethylpyrrole-N-(4-methoxy)benzamide","","- C28 H24 N2 O4 -","- C28 H24 N2 O4 -","- C224 H192 N16 O32 -","8","1","BT6513","Gao, Shan; Huo, Li- Hua; Zhao, Hui; Ng, Seik Weng","<i>N</i>-(3,4-Dibenzoyl-2,5-dimethylpyrrol-1-yl)-4-methoxybenzamide","Acta Crystallographica Section E","2004","60","10","o1733","o1735","10.1107/S1600536804021956","","","0.71073","MoKα","","0.1217","0.0618","","","0.1362","0.1667","","","","","","1.013","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204271","10.568","0.002","5.988","0.001","8.844","0.002","90","","91.55","0.03","90","","559.45","0.19","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Diglycine cobalt dichloride dihydrate","","","- C4 H14 Cl2 Co N2 O6 -","- C4 H14 Cl2 Co N2 O6 -","- C8 H28 Cl4 Co2 N4 O12 -","2","0.5","BT6514","Katharina Stenzel; Michel Fleck","Poly[[[diaquacobalt(II)]-di-μ-glycine] dichloride]","Acta Crystallographica Section E","2004","60","10","m1470","m1472","10.1107/S1600536804022573","","","0.71073","MoKα","","0.0244","0.0219","","","0.0561","0.0579","","","","","","1.076","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204272","13.1473","0.0003","7.8193","0.0012","17.4268","0.0006","90","","102.086","0.002","90","","1751.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4'-(2-Chlorophenyl)-2,3-dihydro-1'-methyl-3'-nitrospiro[1H-indole-3,2'- pyrrolidin]-2-one","","- C18 H16 Cl N3 O3 -","- C18 H16 Cl N3 O3 -","- C72 H64 Cl4 N12 O12 -","4","1","BT6518","N. Sampath; M. N. Ponnuswamy; M. Poornachandran; R. Raghunathan","4'-(2-Chlorophenyl)-2,3-dihydro-1'-methyl-3'-nitrospiro[1<i>H</i>-indole-3,2'-pyrrolidin]-2-one","Acta Crystallographica Section E","2004","60","10","o1862","o1864","10.1107/S1600536804023529","","","0.71073","MoKα","","0.1596","0.0566","","","0.1358","0.1658","","","","","","1.009","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204273","11.52","0.003","10.42","0.003","16.011","0.005","90","","111.084","0.005","90","","1793.3","0.9","218","2","218","2","","","","","","","","6","P 1 21 1","P 2yb","4","","(m-terphenyl)(η^8^-cyclooctatetraenyl)yttrium(μ-chloro)lithium tris(tetra-hydrofuran)","","- C38 H45 Cl Li O3 Y -","- C38 H45 Cl Li O3 Y -","- C76 H90 Cl2 Li2 O6 Y2 -","2","1","BT6520","Rabe, Gerd W.; Zhang-Preße, Mei; Riederer, Florian A.; Incarvito, Christopher D.; Golen, James A.; Rheingold, Arnold L.","(η^8^-Cyclooctatetraenyl)(<i>m</i>-terphenyl)yttrium-μ-chloro-[tris(tetrahydrofuran)lithium(I)]","Acta Crystallographica Section E","2004","60","10","m1442","m1443","10.1107/S1600536804022524","","","0.71073","MoKα","","0.06","0.0381","","","0.0665","0.0699","","","","","","0.854","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204274","13.064","0.007","7.1007","0.0017","14.863","0.008","90","","92.96","0.03","90","","1376.9","1.1","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","anilinium picrate: polymorph 2","anilinium 2,4,6-trinitrophenate","","- C12 H10 N4 O7 -","- C12 H10 N4 O7 -","- C48 H40 N16 O28 -","4","1","BT6521","Graham Smith; Urs D. Wermuth; Peter C. Healy","A second crystal polymorph of anilinium picrate","Acta Crystallographica Section E","2004","60","10","o1800","o1803","10.1107/S1600536804022603","","","0.71069","MoKα","","0.168","0.0531","","","0.1494","0.2091","","","","","","0.921","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204275","19.258","0.001","7.2459","0.0004","8.8593","0.0005","90","","90","","90","","1236.24","0.12","295","2","295","2","","","","","","","","5","I m m a","-I 2b 2","74","","poly[cobalt(II)-μ~2~-N,N-dimethylformamide-κ^2^O:O-μ~4~-terephthalato- κ^4^O:O':O'':O''']","","- C11 H11 Co N O5 -","- C11 H11 Co N O5 -","- C44 H44 Co4 N4 O20 -","4","0.25","BT6522","Fu, Yun-Long; Ren, Jia-Lin; Ng, Seik Weng","The 1:1 adduct of cobalt(II) terephthalate with <i>N,N</i>-dimethylformamide","Acta Crystallographica Section E","2004","60","10","m1507","m1509","10.1107/S1600536804023384","","","0.71073","MoKα","","0.0322","0.0318","","","0.0927","0.0933","","","","","","1.039","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204276","25.022","0.001","9.534","0.0005","17.923","0.001","90","","130.417","0.001","90","","3255.3","0.3","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","bis(N,N-dimethylformamide)tri-μ~5~,μ~5~,μ~4~-terephathalato-dimanganese","","- C30 H26 Mn3 N2 O14 -","- C30 H26 Mn3 N2 O14 -","- C120 H104 Mn12 N8 O56 -","4","0.5","BT6523","Fu, Yun-Long; Ren, Jia-Lin; Qiao, Hai-Ping; Ng, Seik Weng","The 1:2/3adduct of manganese(II) terephthalate with <i>N,N</i>-dimethylformamide","Acta Crystallographica Section E","2004","60","10","m1510","m1512","10.1107/S1600536804023396","","","0.71073","MoKα","","0.0508","0.0413","","","0.1038","0.1092","","","","","","1.027","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204277","8.1464","0.0005","23.5768","0.0014","15.2385","0.0009","90","","96.626","0.002","90","","2907.2","0.3","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(dibenzo-18-crown-6)[phenyl(2-pyridyl)amido]rubidium(I)","","- C31 H33 N2 O6 Rb -","- C31 H33 N2 O6 Rb -","- C124 H132 N8 O24 Rb4 -","4","1","BT6524","Clegg, William; Liddle, Stephen T.","(Dibenzo-18-crown-6)(2-phenylamidopyridine)rubidium(I)","Acta Crystallographica Section E","2004","60","10","m1492","m1494","10.1107/S1600536804023359","","","0.71073","MoKα","","0.0386","0.0274","","","0.0602","0.0616","","","","","","0.92","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204278","26.95","0.002","10.312","0.0009","22.866","0.0019","90","","117.607","0.002","90","","5631.2","0.8","160","2","160","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(Dibenzo-18-crown-6)(2-phenylamidopyridine)potassium(I)","","- C31 H33 K N2 O6 -","- C31 H33 K N2 O6 -","- C248 H264 K8 N16 O48 -","8","1","BT6525","Clegg, William; Liddle, Stephen T.","(Dibenzo-18-crown-6)(2-phenylamidopyridine)potassium(I)","Acta Crystallographica Section E","2004","60","10","m1495","m1497","10.1107/S1600536804023360","","","0.71073","MoKα","","0.0798","0.0433","","","0.1","0.1102","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204279","18.5787","0.001","9.4933","0.0015","17.3172","0.0015","90","","93.112","0.006","90","","3049.8","0.6","298","","298","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(benzyltrimethylammonium) tetrachloronickel(II) N-methylpyrrolidin-2-one solvate","","- C25 H41 Cl4 N3 Ni O -","- C25 H41 Cl4 N3 Ni O -","- C100 H164 Cl16 N12 Ni4 O4 -","4","1","BT6526","Kooijman, Huub; Keegstra, Menno A.; Brandsma, Lambert; Spek, Anthony L.","Bis(benzyltrimethylammonium) tetrachloronickelate(II) <i>N</i>-methylpyrrolidin-2-one solvate","Acta Crystallographica Section E","2004","60","10","m1513","m1515","10.1107/S1600536804023487","","","0.71073","MoKα","","0.1897","0.0687","","","0.1431","0.1822","","","","","","0.99","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204280","20.0567","0.0011","8.2412","0.0005","23.8154","","90","","91.263","0.001","90","","3935.5","0.3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","N-[(1S,2S,3R)-3-(tert-Butyldiphenylsiloxy)-2-bromo-1-phenyl-4- (phenylsulfinyl)butyl]benzenesulfonamide","","- C39 H42 Br N O4 S2 Si -","- C39 H42 Br N O4 S2 Si -","- C156 H168 Br4 N4 O16 S8 Si4 -","4","1","BT6527","K. Ravikumar; G. Y. S. K. Swamy; Sadagopan Raghavan; Ch. Naveen Kumar","<i>N</i>-[(1<i>S</i>,2<i>S</i>,3<i>R</i>)-2-Bromo-3-(<i>tert</i>-butyldiphenylsiloxy)-1-phenyl-4-(phenylsulfinyl)butyl]benzenesulfonamide","Acta Crystallographica Section E","2004","60","10","o1880","o1882","10.1107/S1600536804023694","","","0.71073","MoKα","","0.1146","0.0543","","","0.1091","0.1302","","","","","","0.953","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204281","15.8792","0.0018","10.4601","0.0011","10.4395","0.0015","90","","106.856","0.01","90","","1659.5","0.4","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4-Bis(3,5-di-tert-butyl-2-hydroxybenzylideneaminomethyl)benzene","","- C38 H52 N2 O2 -","- C38 H52 N2 O2 -","- C76 H104 N4 O4 -","2","0.5","BT6528","Tooke, Duncan M.; Song, Yufei; van Albada, Gerard A.; Reedijk, Jan; Spek, Anthony L.","1,4-Bis(3,5-di-<i>tert</i>-butyl-2-hydroxybenzylideneaminomethyl)benzene","Acta Crystallographica Section E","2004","60","10","o1907","o1908","10.1107/S1600536804023633","","","0.71073","MoKα","","0.0799","0.0468","","","0.1019","0.1149","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204282","8.267","0.0002","8.8246","0.0002","21.4946","0.0006","90","","92.213","0.0008","90","","1566.93","0.07","110","2","110","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","venlafaxine","1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexanol","","- C17 H27 N O2 -","- C17 H27 N O2 -","- C68 H108 N4 O8 -","4","1","BT6529","Limor Tessler; Israel Goldberg","Venlafaxine, an antidepressant drug","Acta Crystallographica Section E","2004","60","10","o1868","o1869","10.1107/S1600536804023815","","","0.71073","MoKα","","0.063","0.0439","","","0.1091","0.1207","","","","","","1.032","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204283","11.5582","0.001","12.6032","0.001","17.605","0.002","69.96","0.03","86.7","0.04","74.8","0.03","2323.5","0.7","150","","150","","","","","","","","","7","P -1","-P 1","2","","","","- C54 H47 D12 N2 O3 P Pt -","- C54 H47 D12 N2 O3 P Pt -","- C108 H94 D24 N4 O6 P2 Pt2 -","2","1","BV6000","Kooijman, Huub; Sprengers, Jeroen W.; Elsevier, Cornelis J.; Spek, Anthony L.","(1,3-Dimesityldihydroimidazol-2-ylidene)(2-peroxidopropan-2-olato-κ^2^<i>O,O</i>')(triphenylphosphine-κ<i>P</i>)platinum(II) benzene-<i>d</i>~6~ disolvate","Acta Crystallographica Section E","2004","60","10","m1456","m1458","10.1107/S1600536804022937","","","0.71073","MoKα","","0.0204","0.0177","","","0.0405","0.0413","","","","","","1.066","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204284","13.485","0.003","15.107","0.003","6.515","0.0013","90","","90","","90","","1327.2","0.5","293","2","293","2","","","","","","","","4","P n a m","-P 2c 2n","62","","","","- C11 H14 N4 O6 -","- C11 H14 N4 O6 -","- C44 H56 N16 O24 -","4","0.5","CF6364","Moghimi, S. Abolghasem; Sharif, Mahboubeh A.; Aghabozorg, Hossein","Creatininium dipicolinate monohydrate","Acta Crystallographica Section E","2004","60","10","o1790","o1792","10.1107/S1600536804022482","","","0.71073","MoKα","","0.1152","0.0483","","","0.1357","0.1624","","","","","","1.03","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2204285","11.1","0.002","7.994","0.002","13.895","0.002","90","","93","0.02","90","","1231.3","0.4","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","(2S,3R,4R,5S)-3,4-O-isopropylidene-2-methyl-6,9-diazo-1-oxaspiro -[4.5]-decane-7,10-dione","","- C11 H13 N2 O5 -","- C11 H13 N2 O5 -","- C44 H52 N8 O20 -","4","2","CF6370","David J. Watkin; Matthias Müller; Yves Blèriot; Michela I. Simone; George W. J. Fleet","(2<i>S</i>,3<i>R</i>,4<i>R</i>,5<i>S</i>)-3,4-<i>O</i>-Isopropylidene-2-methyl-1-oxa-6,9-diazaspiro[4.5]decane-7,10-dione","Acta Crystallographica Section E","2004","60","10","o1820","o1822","10.1107/S1600536804022494","","","0.71069","MoKα","","0.0733","0.0733","","0.1392","0.1392","0.1392","","","","","","1.0722","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204286","10.46","0.01","17.79","0.02","12.04","0.01","90","","109.25","0.04","90","","2115","4","296.1","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C48 H36 Cu2 N4 O12 -","- C48 H36 Cu2 N4 O12 -","- C96 H72 Cu4 N8 O24 -","2","0.5","CF6371","Wang, Yue; Okabe, Nobuo","Di-μ-salicylato-κ^4^<i>O</i>:<i>O</i>'-bis[(2,2'-bipyridine-κ^2^<i>N,N</i>')copper(II)] bis(salicylic acid)","Acta Crystallographica Section E","2004","60","10","m1434","m1436","10.1107/S1600536804022615","","","0.7107","MoKα","","","0.044","","","","0.131","","","","","","0.854","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204287","22.8724","0.0005","17.0573","0.0004","11.6326","0.0003","90","","90","","90","","4538.36","0.19","120","2","120","2","","","","","","","","3","A b a 2","A 2 -2ab","41","Neophyltriphenylstannane","(2-Methyl-2-phenylpropyl)triphenylstannane","","- C28 H28 Sn -","- C28 H28 Sn -","- C224 H224 Sn8 -","8","","CF6377","Howie, R. Alan; Wardell, James L.","(2-Methyl-2-phenylpropyl)triphenylstannane","Acta Crystallographica Section E","2004","60","10","m1536","m1538","10.1107/S160053680402330X","","","0.71073","MoKα","","0.0298","0.0271","","","0.066","0.0672","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204288","7.8813","0.0006","16.355","0.001","17.228","0.001","117.131","0.001","95.273","0.001","93.091","0.001","1956.4","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Dichloro(4'-phenyl-2,2':6',2""-terpyridine-κ^3^N)zinc(II) hydrate","","- C21 H17 Cl2 N3 O Zn -","- C21 H17 Cl2 N3 O Zn -","- C84 H68 Cl8 N12 O4 Zn4 -","4","2","CI6424","Tu, Qi-Dong; Li, Dan; Wu, Tao; Yin, Ye-Gao; Ng, Seik Weng","Dichloro(4'-phenyl-2,2':6',2''-terpyridine-κ^3^<i>N</i>)zinc(II) monohydrate","Acta Crystallographica Section E","2004","60","10","m1403","m1404","10.1107/S1600536804021853","","","0.71073","MoKα","","0.108","0.062","","","0.147","0.181","","","","","","1.03","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204289","10.233","0.005","10.233","0.005","44.494","0.005","90","","90","","120","","4035","3","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","Bis(DL-methioninium) sulfate","Bis(DL-methioninium) sulfate","","- C10 H24 N2 O8 S3 -","- C10 H24 N2 O8 S3 -","- C90 H216 N18 O72 S27 -","9","0.5","CI6427","S. Ramaswamy; B. Sridhar; V. Ramakrishnan; R. K. Rajaram","Bis(<small>DL</small>-methioninium) sulfate","Acta Crystallographica Section E","2004","60","10","o1691","o1693","10.1107/S1600536804021324","","","0.71069","MoKα","","0.0719","0.0608","","","0.1685","0.178","","","","","","1.134","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2204290","7.9391","0.0016","8.7838","0.0018","11.611","0.002","71.05","0.03","87.16","0.03","89.42","0.03","764.9","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","(2Z)-2-(Hydroximino)-3-methoxy-3-phenyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin- 4-ium perchlorate","","- C13 H13 Cl N4 O6 -","- C13 H13 Cl N4 O6 -","- C26 H26 Cl2 N8 O12 -","2","1","CI6431","Anaflous, Abderahmane; Benchat, Nour-Eddine; Ben-Hadda, Taibi; El Bali, Brahim; Bolte, Michael","(2<i>Z</i>)-2-(<i>H</i>ydroximino)-3-methoxy-3-phenyl-2,3-dihydro-1<i>H</i>-imidazo[1,2-<i>a</i>]pyrimidin-4-ium perchlorate","Acta Crystallographica Section E","2004","60","10","o1719","o1721","10.1107/S1600536804020549","","","0.71073","MoKα","","0.0571","0.0452","","","0.1226","0.1281","","","","","","1.062","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204291","9.7428","0.0002","17.0689","0.0003","10.363","0.0002","90","","110.449","0.001","90","","1614.76","0.05","220","2","220","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","triphenylgermanium azide","azidotriphenylgermane","","- C18 H15 Ge N3 -","- C18 H15 Ge N3 -","- C72 H60 Ge4 N12 -","4","1","CI6432","Wharf, Ivor; Bélanger-Gariépy, Francine","Azidotriphenylgermane","Acta Crystallographica Section E","2004","60","10","m1362","m1364","10.1107/S1600536804021221","","","1.54178","CuKα","","0.0343","0.0327","","","0.0994","0.1014","","","","","","1.054","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204292","10.64","0.002","14.884","0.002","13.604","0.002","90","","91.15","0.01","90","","2154","0.6","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-(4-Hydroxy-3-methyoxyphenyl)-3,3,6,6,10-pentamethyl-1,2,3,4,5,6,7,8,9,10- decahydroacridine-1,8-dione","","- C25 H31 N O4 -","- C25 H31 N O4 -","- C100 H124 N4 O16 -","4","1","CI6434","Tu, Shu-Jiang; Zhang, Xiao-Jing; Zhu, Song-Lei","9-(4-Hydroxy-3-methyoxyphenyl)-3,3,6,6,10-pentamethyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione","Acta Crystallographica Section E","2004","60","10","o1870","o1872","10.1107/S1600536804023621","","","0.71073","MoKα","","0.0747","0.0422","","","0.0995","0.1081","","","","","","0.911","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204293","11.237","0.0013","18.256","0.002","10.4779","0.0012","90","","93.532","0.002","90","","2145.4","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis(p-methoxyphenyl)-2,2'-(m-phenylenedioxy)diacetamide","","- C24 H24 N2 O6 -","- C24 H24 N2 O6 -","- C96 H96 N8 O24 -","4","1","CI6436","Yong-Hong Wen; Shu-Sheng Zhang; Juan Liang; Xue-Mei Li","<i>N,N</i>'-Bis(<i>p</i>-methoxyphenyl)-2,2'-(<i>m</i>-phenylenedioxy)diacetamide","Acta Crystallographica Section E","2004","60","10","o1702","o1703","10.1107/S1600536804021440","","","0.71073","MoKα","","0.0907","0.0488","","","0.1028","0.1201","","","","","","1.004","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204294","9.3027","0.0015","9.952","0.002","12.474","0.003","83.82","0.02","78.925","0.017","76.881","0.015","1101.3","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-acetato-κ^4^O:O'-tetracarbonylbis(pyridyl-2-yl-κN- amine)diruthenium(I)(Ru—Ru)","","- C18 H18 N4 O8 Ru2 -","- C18 H18 N4 O8 Ru2 -","- C36 H36 N8 O16 Ru4 -","2","1","CI6437","Reto Dorta; Georg Süss-Fink; Helen Stoeckli-Evans","Di-μ-acetato-κ^4^<i>O</i>:<i>O</i>'-tetracarbonylbis(pyridyl-2-yl-κ<i>N</i>-amine)diruthenium(I)(<i>Ru</i>—<i>Ru</i>)","Acta Crystallographica Section E","2004","60","10","m1397","m1399","10.1107/S160053680402166X","","","0.71073","MoKα","","0.0307","0.0252","","","0.0547","0.0581","","","","","","1.117","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204295","6.804","0.005","10.531","0.004","17.278","0.005","88.96","0.05","79.24","0.03","73.51","0.02","1165.4","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","{3-[4-(N,N-Dimethylamino)phenyl]-1-(4-methylphenyl)- 3-(phenylsulfanyl)propylidene}semicarbazide","","- C25 H28 N4 O S -","- C25 H28 N4 O S -","- C50 H56 N8 O2 S2 -","2","1","CI6438","Sivaperuman Saravanan; Shanmugam Muthusubramanian","{3-[4-(<i>N,N</i>-Dimethylamino)phenyl]-1-(4-methylphenyl)-3-(phenylsulfanyl)propylidene}semicarbazide","Acta Crystallographica Section E","2004","60","10","o1895","o1897","10.1107/S160053680402375X","","","0.71069","MoKα","","0.0553","0.0356","","","0.0915","0.1009","","","","","","1.025","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204296","9.156","0.006","7.233","0.005","11.516","0.007","90","","97.494","0.009","90","","756.1","0.9","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N,N'-Bis(4-nitrobenzylidene)ethane-1,2-diamine","","- C16 H14 N4 O4 -","- C16 H14 N4 O4 -","- C32 H28 N8 O8 -","2","0.5","CI6439","Sun, Yu-Xi; You, Zhong-Lu; Zhu, Hai-Liang","<i>N</i>,<i>N</i>'-Bis(4-nitrobenzylidene)ethane-1,2-diamine","Acta Crystallographica Section E","2004","60","10","o1707","o1708","10.1107/S1600536804021671","","","0.71073","MoKα","","0.1171","0.048","","","0.1205","0.1331","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204297","7.0847","0.0011","8.4733","0.0013","10.2291","0.0015","98.128","0.003","96.913","0.003","99.785","0.003","592.45","0.16","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","5-Fluorouracil 1,4-dioxane (4/1)","","- C20 H20 F4 N8 O10 -","- C20 H20 F4 N8 O10 -","- C20 H20 F4 N8 O10 -","1","0.5","CI6440","Hulme, Ashley T.; Tocher, Derek A.","5-Fluorouracil‒1,4-dioxane (4/1)","Acta Crystallographica Section E","2004","60","10","o1781","o1782","10.1107/S1600536804022251","","","0.71073","MoKα","","0.0723","0.0521","","","0.1053","0.1142","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204298","14.7361","0.0018","5.8693","0.0007","16.397","0.002","90","","100.524","0.002","90","","1394.3","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-Fluorouracil Dimethylformamide (2/1)","","- C11 H13 F2 N5 O5 -","- C11 H13 F2 N5 O5 -","- C44 H52 F8 N20 O20 -","4","1","CI6441","Hulme, Ashley T.; Tocher, Derek A.","5-Fluorouracil‒dimethylformamide (2/1)","Acta Crystallographica Section E","2004","60","10","o1783","o1785","10.1107/S1600536804022263","","","0.71073","MoKα","","0.0615","0.0485","","","0.1024","0.1081","","","","","","1.095","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204299","9.8831","0.001","10.8128","0.0011","8.6842","0.0009","90","","107.397","0.002","90","","885.58","0.16","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","5-Fluorouracil Dimethylsulfoxide (1/1)","","- C6 H9 F N2 O3 S -","- C6 H9 F N2 O3 S -","- C24 H36 F4 N8 O12 S4 -","4","1","CI6442","Hulme, Ashley T.; Tocher, Derek A.","5-Fluorouracil‒dimethyl sulfoxide (1/1)","Acta Crystallographica Section E","2004","60","10","o1786","o1787","10.1107/S1600536804022275","","","0.71073","MoKα","","0.041","0.0363","","","0.0869","0.0899","","","","","","1.068","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204300","12.72","0.004","9.81","0.003","21.71","0.007","90","","90","","90","","2709","1.5","298","2","298","2","","","","","","","","6","C m c a","-C 2ac 2","64","","Bis(2-aminopyridine-κN^1^)silver(I) perchlorate","","- C10 H12 Ag Cl N4 O4 -","- C10 H12 Ag Cl N4 O4 -","- C80 H96 Ag8 Cl8 N32 O32 -","8","","CI6443","Deng, Bing; Liu, Zhao-Di; Liu, Xiu-Ying; Tan, Min-Yu; Zhu, Hai-Liang","Bis(2-aminopyridine-κ<i>N</i>^1^)silver(I) perchlorate","Acta Crystallographica Section E","2004","60","10","m1444","m1446","10.1107/S1600536804022780","","","0.71073","MoKα","","0.0761","0.0552","","","0.147","0.174","","","","","","1.103","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2204301","7.604","0.003","12.868","0.005","15.732","0.006","90","","93.765","0.007","90","","1536","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ethyl 5-(3,5-dimethyl-1H-pyrazol-1-ylsulfonyl)-1-methyl-1H-pyrazole- 4-carboxylate","","- C12 H16 N4 O4 S -","- C12 H16 N4 O4 S -","- C48 H64 N16 O16 S4 -","4","1","CI6444","Xiao-Mao Zou; Huan-Le Shi; Li-Min Yu; Hua-Zheng Yang; Jiang Pei; Pei Liu","Ethyl 5-(3,5-dimethyl-1<i>H</i>-pyrazol-1-ylsulfonyl)-1-methyl-1<i>H</i>-pyrazole-4-carboxylate","Acta Crystallographica Section E","2004","60","10","o1812","o1813","10.1107/S1600536804022792","","","0.71073","MoKα","","0.0976","0.05","","","0.1064","0.1238","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204302","10.738","0.008","10.608","0.008","11.623","0.008","90","","111.442","0.012","90","","1232.3","1.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(1-Cyano-1,2-dimethylpropyl)-5-methylisoxazole-4-carboxamide","","- C11 H15 N3 O2 -","- C11 H15 N3 O2 -","- C44 H60 N12 O8 -","4","1","CI6445","Bin Zhong; Xiao-Li Mu; Zheng-Ming Li; Hai-Bin Song","<i>N</i>-(1-Cyano-1,2-dimethylpropyl)-5-methylisoxazole-4-carboxamide","Acta Crystallographica Section E","2004","60","10","o1797","o1799","10.1107/S1600536804022743","","","0.71073","MoKα","","0.0948","0.056","","","0.1265","0.1444","","","","","","1.023","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204303","7.4152","0.0019","24.532","0.006","8.739","0.002","90","","113.576","0.004","90","","1457","0.6","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(4-Fluoro-2-hydroxyphenyl)ethanone 4-nitrobenzoylhydrazone","","- C15 H12 F N3 O4 -","- C15 H12 F N3 O4 -","- C60 H48 F4 N12 O16 -","4","1","CI6446","Ali, Hapipah.; Khamis, Nur Ashikin; Yamin, Bohari M.","1-(4-Fluoro-2-hydroxyphenyl)ethanone 4-nitrobenzoylhydrazone","Acta Crystallographica Section E","2004","60","10","o1873","o1874","10.1107/S1600536804023657","","","0.71073","MoKα","","0.0808","0.0674","","","0.1613","0.1699","","","","","","1.145","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204304","22.6083","0.0017","6.2232","0.0005","20.0394","0.0015","90","","90","","90","","2819.5","0.4","293","2","293","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","Bis(hydrogen 5-nitroisophthalato)(1,10-phenanthroline)lead(II) monohydrate","","- C28 H18 N4 O13 Pb -","- C28 H18 N4 O13 Pb -","- C112 H72 N16 O52 Pb4 -","4","0.5","CI6449","Hong-Ping Xiao; Ji-Xin Yuan","Bis(hydrogen 5-nitroisophthalato)(1,10-phenanthroline)lead(II) monohydrate","Acta Crystallographica Section E","2004","60","10","m1501","m1503","10.1107/S1600536804023189","","","0.71073","MoKα","","0.0295","0.021","","","0.051","0.0539","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204305","6.731","0.003","6.882","0.003","11.508","0.005","88.62","0.006","89.988","0.005","88.106","0.006","532.6","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","N-(p-Nitrophenyl)-N'-acteyl-ethylenediamine","N-[2-(4-Nitrophenylamino)ethyl]acetamide","","- C10 H13 N3 O3 -","- C10 H13 N3 O3 -","- C20 H26 N6 O6 -","2","1","CI6451","Wang, Zhi-Jun; Li, Dong-Hong; Huang, Shu-Ping; Yang, Bin-Sheng","<i>N</i>-[2-(4-Nitrophenylamino)ethyl]acetamide","Acta Crystallographica Section E","2004","60","10","o1875","o1876","10.1107/S1600536804023372","","","0.71073","MoKα","","0.0893","0.0587","","","0.1316","0.147","","","","","","1.018","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204306","5.7387","0.0005","23.842","0.003","10.3045","0.0009","90","","104.655","0.007","90","","1364","0.2","296","","296","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-Benzyl-3-(2-hydroxyphenyl)-1H-1,2,4-triazole-5(4H)-thione","","- C15 H13 N3 O S -","- C15 H13 N3 O S -","- C60 H52 N12 O4 S4 -","4","1","CI6452","Dege, Necmi; Çetin, Ahmet; Cansız, Ahmet; Şekerci, Memet; Cavit, Kazaz; Dinçer, Muharrem; Büyükgüngör, Orhan","4-Benzyl-3-(2-hydroxyphenyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2004","60","10","o1883","o1885","10.1107/S1600536804023682","","","0.71073","MoKα","","0.0667","0.0435","","","0.1014","0.1087","","","","","","0.87","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204307","7.63122","0.00017","13.6673","0.0003","15.8058","0.0005","84.385","0.002","87.4653","0.0019","75.7135","0.0013","1589.52","0.07","295","","295","","","","","","","","","5","P -1","-P 1","2","","N-[2-(4-hydroxy-2-oxo-2,3-dihydro-1,3-benzothiazol-7-yl)ethyl]- 3-[2-(2-naphthalen-1-ylethoxy)ethylsulfonyl]propylaminium benzoate","","- C33 H36 N2 O7 S2 -","- C33 H36 N2 O7 S2 -","- C66 H72 N4 O14 S4 -","2","1","CV6353","Johnston, Andrea; Florence, Alastair J.; Shankland, Kenneth; Markvardsen, Anders; Shankland, Norman; Steele, Gerald; Cosgrove, Stephen D.","Powder study of <i>N</i>-[2-(4-hydroxy-2-oxo-2,3-dihydro-1,3-benzothiazol-7-yl)ethyl]-3-[2-(2-naphthalen-1-ylethoxy)ethylsulfonyl]propylaminium benzoate","Acta Crystallographica Section E","2004","60","10","o1751","o1753","10.1107/S1600536804021105","","","1.54056","CuKα~1~","","","","","","","","","","1.6","","","","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2204308","7.29","0.002","22.131","0.007","9.513","0.003","90","","90.115","0.005","90","","1534.8","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3,3-Dimethyl-7-phenyl-2-oxa-1,4-dithia-5,6,8,9-tetraaza-3H-cyclopenta[f]azulene 1,1-dioxide","","- C14 H12 N4 O3 S2 -","- C14 H12 N4 O3 S2 -","- C56 H48 N16 O12 S8 -","4","1","CV6357","Li Tian; Lun-Zu Liu","3,3-Dimethyl-7-phenyl-2-oxa-1,4-dithia-5,6,8,9-tetraaza-3<i>H</i>-cyclopenta[<i>f</i>]azulene 1,1-dioxide","Acta Crystallographica Section E","2004","60","10","o1826","o1827","10.1107/S1600536804021385","","","0.71073","MoKα","","0.0892","0.0557","","","0.1183","0.1323","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204309","11.22","0.002","12.26","0.003","17.762","0.004","71.06","0.03","86.35","0.03","85.19","0.03","2301.1","1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Methyl 3-dimethylamino-2-{2-[2-(dimethylamino)-1-(3-phenyl-1,2,4-oxadiazol-5- yl)vinyloxy]phenyl}acrylate","","- C24 H26 N4 O4 -","- C24 H26 N4 O4 -","- C96 H104 N16 O16 -","4","2","CV6361","Wang, Hai-Bo; Chen, Jia-Hui; Wang, Jin-Tang","Methyl 3-dimethylamino-2-{2-[2-(dimethylamino)-1-(3-phenyl-1,2,4-oxadiazol-5-yl)vinyloxy]phenyl}acrylate","Acta Crystallographica Section E","2004","60","10","o1709","o1711","10.1107/S1600536804021610","","","0.71073","MoKα","","0.1466","0.073","","","0.218","0.2585","","","","","","1.116","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204310","11.3384","0.0013","13.6971","0.0009","16.4806","0.0011","104.434","0.001","99.374","0.001","100.11","0.001","2382.2","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","bis(2,2'-bipyridine)hexakis-μ-methacrylato-nitratocerium(III)dizinc(II)","","- C44 H46 Ce N5 O15 Zn2 -","- C44 H46 Ce N5 O15 Zn2 -","- C88 H92 Ce2 N10 O30 Zn4 -","2","1","CV6363","Wu, Bin; Guo, Yongsheng","A trinuclear zinc‒cerium complex: [CeZn~2~{CH~2~C(CH~3~)COO}~6~(NO~3~)(2,2'-bipyridine)~2~]","Acta Crystallographica Section E","2004","60","10","m1356","m1358","10.1107/S1600536804020690","","","0.71069","MoKα","","0.0315","0.0237","","","0.0508","0.0532","","","","","","1.063","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204311","9.4057","0.0019","13.593","0.002","14.982","0.003","90","","91.367","0.016","90","","1914.9","0.6","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetra-n-butylammonium hexafluorophosphate","","- C16 H36 F6 N P -","- C16 H36 F6 N P -","- C64 H144 F24 N4 P4 -","4","1","CV6366","Schödel, Frauke; Lerner, Hans-Wolfram; Bolte, Michael","Tetra-<i>n</i>-butylammonium hexafluorophosphate","Acta Crystallographica Section E","2004","60","10","o1680","o1681","10.1107/S1600536804021300","","","0.71073","MoKα","","0.1072","0.057","","","0.1402","0.1594","","","","","","0.911","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204312","10.69","0.0008","11.7225","0.0008","20.2272","0.0013","90.196","0.002","101.945","0.002","103.992","0.002","2402.5","0.3","164","2","164","2","","","","","","","","4","P -1","-P 1","2","","μ~2~-Oxo-di[bis(η^5^-1,3-di(tert-butyl)cyclopentadienyl)titanium(III)]","","- C52 H84 O Ti2 -","- C52 H84 O Ti2 -","- C104 H168 O2 Ti4 -","2","1","CV6367","Sofield, Chadwick D.; Walter, Marc D.; Andersen, Richard A.","μ~2~-Oxo-bis[bis(η^5^-1,3-di-<i>tert</i>-butylcyclopentadienyl)titanium(III)]","Acta Crystallographica Section E","2004","60","10","m1417","m1419","10.1107/S1600536804021968","","","0.71073","MoKα","","0.1072","0.0646","","","0.1613","0.1743","","","","","","0.993","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204313","12.7018","0.0012","7.3602","0.0007","17.3967","0.0017","90","","92.612","0.002","90","","1624.7","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(3-Hydroxypropyl)-6-(4-methylphenyl)-7H-1,2,4-triazolo [3,4-b][1,3,4]thiadiazine dihydrate","","- C14 H20 N4 O3 S -","- C14 H20 N4 O3 S -","- C56 H80 N16 O12 S4 -","4","1","CV6368","Zou, Kai-Huang; Cai, Xiao-Qing; Chen, Jiu-Xi; Zhang, Li-Xue; Zhang, An-Jiang; Hu, Mao-Lin","3-(3-Hydroxypropyl)-6-(4-methylphenyl)-7H-1,2,4-triazolo- [3,4-b][1,3,4]thiadiazine dihydrate","Acta Crystallographica, Section E","2004","60","10","m1736","m1738","10.1107/S160053680402197X","","","0.71073","MoKα","","0.097","0.0715","","","0.1453","0.157","","","","","","1.146","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204314","7.416","0.003","14.319","0.006","18.883","0.007","101.449","0.009","93","0.01","104.107","0.008","1895.3","1.3","150.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C72 H60 Ag2 F12 N8 O12 S4 -","- C72 H60 Ag2 F12 N8 O12 S4 -","- C72 H60 Ag2 F12 N8 O12 S4 -","1","0.5","CV6369","Liu, Shu Qin; Konaka, Hisashi; Kuroda-Sowa, Takayoshi; Maekawa, Masahiko; Suenaga, Yusaku; Ning, Gui Ling; Munakata, Megumu","<i>catena</i>-Poly[[[diacetonitrilesilver(I)]-μ-2,11-dithia[3.3]paracyclophane-κ^2^<i>S</i>:<i>S</i>'] tetrafluoroterephthalate tetrafluoroterephthalic acid acetonitrile tetrasolvate]","Acta Crystallographica Section E","2004","60","10","m1504","m1506","10.1107/S160053680402238X","","","0.7107","MoKα","","","0.0329","","","","0.0728","","","","","","1.028","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2204315","8.31","0.001","15.132","0.001","15.414","0.001","90","","90.79","0.01","90","","1938.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","ZD4054 Form 1","N-(3-Methoxy-5-methylpyrazin-2-yl)-2-[4-(1,3,4-oxadiazol-2- yl)phenyl]pyridine-3-sulfonamide","","- C19 H16 N6 O4 S -","- C19 H16 N6 O4 S -","- C76 H64 N24 O16 S4 -","4","1","CV6370","Stensland, Birgitta; Roberts, Ron J.","<i>N</i>-(3-Methoxy-5-methylpyrazin-2-yl)-2-[4-(1,3,4-oxadiazol-2-yl)phenyl]pyridine-3-sulfonamide (ZD4054 Form 1)","Acta Crystallographica Section E","2004","60","10","o1817","o1819","10.1107/S1600536804022822","","","0.71073","MoKα","","0.0989","0.0467","","","0.1066","0.1267","","","","","","0.973","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204316","8.8789","0.0009","12.689","0.0013","19.506","0.002","90","","90","","90","","2197.6","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Benzaldehyde 1-(2,3,4-tri-O-acetyl-β-D-xylopyranosyl)thiosemicarbazone","","- C19 H23 N3 O7 S -","- C19 H23 N3 O7 S -","- C76 H92 N12 O28 S4 -","4","1","CV6371","Bo Yang; Shu-Sheng Zhang; Yan-Fang Wang; Xue-Mei Li; Kui Jiao; M. Kassim; Yamin, Bohari M.","Benzaldehyde 1-(2,3,4-tri-<i>O</i>-acetyl-β-<small>D</small>-xylopyranosyl)thiosemicarbazone","Acta Crystallographica Section E","2004","60","10","o1902","o1904","10.1107/S1600536804023542","","","0.71073","MoKα","","0.057","0.0521","","","0.1125","0.1149","","","","","","1.199","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204317","9.846","0.002","10.41","0.002","12.253","0.003","79.99","0.04","85.74","0.04","62.49","0.03","1096.9","0.5","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","(5-Bromo-2-oxidoacetophenone 4-chlorobenzoylhydrazido)(triethylamine)nickel(II)","","- C21 H25 Br Cl N3 Ni O2 -","- C21 H25 Br Cl N3 Ni O2 -","- C42 H50 Br2 Cl2 N6 Ni2 O4 -","2","1","CV6372","Ali, Hapipah; Khamis, Nur Ashikin; Yamin, Bohari M.","(5-Bromo-2-oxidoacetophenone 4-chlorobenzoylhydrazido)(triethylamine)nickel(II)","Acta Crystallographica Section E","2004","60","10","m1525","m1526","10.1107/S1600536804023554","","","0.71073","MoKα","","0.0342","0.0287","","","0.0788","0.0825","","","","","","1.049","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204318","17.985","0.003","9.529","0.003","13.154","0.004","90","","99.63","0.02","90","","2222.6","1","297","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C30 H24 O2 -","- C30 H24 O2 -","- C120 H96 O8 -","4","1","CV6373","Ohba, Shigeru; Yohei, Yamamoto; Tanaka, Koichi","(2<i>RS</i>,3<i>RS</i>,1'<i>SR</i>,2'<i>SR</i>,3'<i>RS</i>)-2-(2',3'-Dihydro-1'-hydroxy-3'-phenyl-1<i>H</i>-inden-2'-yl)-2,3-dihydro-3-phenylinden-1-one: isomer (I)","Acta Crystallographica Section E","2004","60","10","o1793","o1794","10.1107/S1600536804022457","","","0.71073","MoKα","","","0.0543","","","","0.1668","","","","","","1.006","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204319","14.883","0.004","11.29","0.005","13.418","0.004","90","","100.52","0.02","90","","2216.7","1.3","300","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C30 H24 O2 -","- C30 H24 O2 -","- C120 H96 O8 -","4","1","CV6374","Ohba, Shigeru; Yohei, Yamamoto; Tanaka, Koichi","(2<i>SR</i>,3<i>RS</i>,1'<i>SR</i>,2'<i>SR</i>,3'<i>RS</i>)-2-(2',3'-Dihydro-1'-hydroxy-3'-phenyl-1<i>H</i>-inden-2'-yl)-2,3-dihydro-3-phenylinden-1-one: isomer (II)","Acta Crystallographica Section E","2004","60","10","o1795","o1796","10.1107/S1600536804022445","","","0.71073","MoKα","","","0.0572","","","","0.1697","","","","","","0.922","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204320","12.378","0.001","14.77","0.001","13.3291","0.0007","90","","99.073","0.004","90","","2406.4","0.3","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","(Acetato-κO)[butane-2,3-dione monooxime benzoylhydrazonato-κ^3^O,N^2^,O']bis(pyridine-κN)nickel(II)","","- C23 H25 N5 Ni O4 -","- C23 H25 N5 Ni O4 -","- C92 H100 N20 Ni4 O16 -","4","1","CV6375","Huo, Li-Hua; Lu, Zhen-Zhong; Gao, Shan; Zhao, Hui","(Acetato-κ<i>O</i>)[butane-2,3-dione monooxime benzoylhydrazonato-κ^3^<i>O</i>,<i>N</i>^2^,<i>O</i>']bis(pyridine-κ<i>N</i>)nickel(II)","Acta Crystallographica Section E","2004","60","10","m1450","m1452","10.1107/S1600536804022767","","","0.71073","MoKα","","0.049","0.038","","","0.083","0.087","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204321","7.2751","0.001","10.4797","0.0014","12.7575","0.0017","97.482","0.002","92.284","0.002","101.475","0.002","942.9","0.2","293","2","298","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-5-hydroxyisophthalato-bis[aqua(1,10-phenanthroline)copper(II)] trihydrate","","- C40 H34 Cu2 N4 O15 -","- C40 H34 Cu2 N4 O15 -","- C40 H34 Cu2 N4 O15 -","1","0.5","CV6376","Hong-Ping Xiao; Qian Shi; Ming-De Ye","Di-μ-5-hydroxyisophthalato-bis[aqua(1,10-phenanthroline)copper(II)] trihydrate","Acta Crystallographica Section E","2004","60","10","m1498","m1500","10.1107/S1600536804023190","","","0.71073","MoKα","","0.0845","0.0838","","","0.172","0.1724","","","","","","1.336","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204322","10.5099","0.0013","12.1597","0.0014","12.5348","0.0014","72.798","0.003","84.99","0.002","77.968","0.003","1496.1","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Chlorobis(1,10-phenanthroline)copper(II) 5-nitroisophthalate(1-) dihydrate","","- C32 H24 Cl Cu N5 O8 -","- C32 H24 Cl Cu N5 O8 -","- C64 H48 Cl2 Cu2 N10 O16 -","2","1","CV6377","Ming-De Ye; Hong-Ping Xiao; Mao-Lin Hu","Chlorobis(1,10-phenanthroline)copper(II) 5-nitroisophthalate(1‒) dihydrate","Acta Crystallographica Section E","2004","60","10","m1516","m1518","10.1107/S1600536804023608","","","0.71073","MoKα","","0.1737","0.1028","","","0.1716","0.2036","","","","","","1.082","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204323","5.6745","0.0003","8.1082","0.0003","12.8399","0.0006","76.7284","0.0015","88.139","0.002","86.3319","0.0013","573.71","0.05","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis(1H-imidazole-κN^3^)bis(nitrobenzoato-κO)manganese(II)","","- C20 H20 Mn N6 O10 -","- C20 H20 Mn N6 O10 -","- C20 H20 Mn N6 O10 -","1","0.5","CV6378","Tu-Gen Xu; Duan-Jun Xu","Diaquabis(1<i>H</i>-imidazole-κ<i>N</i>^3^)bis(nitrobenzoato-κ<i>O</i>)manganese(II)","Acta Crystallographica Section E","2004","60","10","m1462","m1464","10.1107/S1600536804022998","","","0.71073","MoKα","","0.033","0.031","","","0.08","0.082","","","","","","1.096","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204324","7.244","0.007","8.014","0.008","13.654","0.013","91.218","0.015","101.586","0.015","108.01","0.014","735.5","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-(2,6-Difluorobenzoyl)-3-(4-trifluoromethylphenyl)urea","","- C15 H9 F5 N2 O2 -","- C15 H9 F5 N2 O2 -","- C30 H18 F10 N4 O4 -","2","1","CV6379","Chen, Li; Song, Hai-Bin; Wang, Qing-Min; Huang, Run-Qiu; Shang, Jian; Mao, Chun-Hui","1-(2,6-Difluorobenzoyl)-3-[4-(trifluoromethyl)phenyl]urea","Acta Crystallographica Section E","2004","60","10","o1865","o1867","10.1107/S1600536804023207","","","0.71073","MoKα","","0.1367","0.0537","","","0.1155","0.1437","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204325","9.574","0.002","10.778","0.006","17.461","0.005","90","","90","","90","","1801.8","1.2","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","","9-Dicyanomethylene-4,5-dinitrofluorene-2,7-disulfonamide","","- C16 H8 N6 O8 S2 -","- C16 H8 N6 O8 S2 -","- C64 H32 N24 O32 S8 -","4","1","CV6380","Batsanov, Andrei S.; Perepichka, Igor F.","9-Dicyanomethylene-4,5-dinitrofluorene-2,7-disulfonamide","Acta Crystallographica Section E","2004","60","10","o1892","o1894","10.1107/S160053680402361X","","","1.54178","CuKα","","0.0493","0.0414","","","0.1012","0.1056","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204326","10.416","0.0005","11.4284","0.0006","14.0585","0.001","75.322","0.004","81.118","0.004","64.06","0.004","1453.96","0.16","130","2","130","2","","","","","","","","5","P -1","-P 1","2","","(2,2'-bipyridyl)-diaqua-tris(nitrato-O,O')-praseodymium(III) bipyridyl 1.5 solvate","","- C50 H48 N16 O22 Pr2 -","- C50 H48 N16 O22 Pr2 -","- C50 H48 N16 O22 Pr2 -","1","0.5","DN6155","Charushnikova, Iraida A.; Den Auwer, Christophe","Diaqua(2,2'-bipyridyl)tris(nitrato-κ^2^<i>O,O</i>')praseodymium(III) 2,2'-bipyridyl sesquisolvate","Acta Crystallographica Section E","2004","60","10","m1420","m1421","10.1107/S1600536804021920","","","0.71073","MoKα","","0.0419","0.0375","","","0.0819","0.0845","","","","","","1.078","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2204327","6.325","0.0019","15.945","0.005","11.995","0.004","90","","90.645","0.005","90","","1209.6","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[N,N'-dimethylethylenediamine(salicylaldehyde)]oxovanadium(V)","{2-[2-(N,N'-dimethylamino)ethyliminomethyl]phenolato- κ^3^N,N',O}dioxovanadium(V)","","- C11 H15 N2 O3 V -","- C11 H15 N2 O3 V -","- C44 H60 N8 O12 V4 -","4","1","DN6156","Ming-Jin, Xie; Shi Ping, Yan; Dai Zheng, Liao; Zong Hui, Jian; Peng, Chen","{2-[2-(<i>N</i>,<i>N</i>'-Dimethylamino)ethyliminomethyl]phenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>}dioxovanadium(V)","Acta Crystallographica Section E","2004","60","10","m1382","m1383","10.1107/S1600536804019324","","","0.71073","MoKα","","0.0461","0.0339","","","0.0908","0.0978","","","","","","1.054","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204328","9.325","0.003","12.312","0.004","12.829","0.004","78.464","0.005","72.067","0.006","85.072","0.006","1372.6","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","[N,N'-bis(4-hydroxysalicylidene)-o-phenylenediamine]oxovanadium(IV) bis(dimethyl sulfoxide) dihydrate","","- C24 H30 N2 O9 S2 V -","- C24 H30 N2 O9 S2 V -","- C48 H60 N4 O18 S4 V2 -","2","1","DN6157","Xie, Ming-Jin; Yan, Shi-Ping; Liao, Dai-Zheng; Jian, Zhong-Hui; Chen, Peng","A new Schiff base oxovanadium (IV) complex: [<i>N</i>,<i>N</i>'-bis(4-hydroxysalicylidene)-<i>o</i>-phenylenediamine]oxovanadium(IV) bis(dimethyl sulfoxide) dihydrate","Acta Crystallographica Section E","2004","60","10","m1530","m1532","10.1107/S160053680402210X","","","0.71073","MoKα","","0.1314","0.0608","","","0.1138","0.1364","","","","","","1.001","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204329","13.248","0.003","8.5327","0.0017","19.858","0.004","90","","90","","90","","2244.8","0.8","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Tetrakis(μ-acetato-κ~2~O:O')bis[(3-hydroxypyridine-κN)copper]","","- C18 H22 Cu2 N2 O10 -","- C18 H22 Cu2 N2 O10 -","- C72 H88 Cu8 N8 O40 -","4","0.5","DN6158","Gao, Shan; Zhang, Xian-Fa; Huo, Li-Hua; Zhao, Hui","Tetr-μ-acetato-κ^8^<i>O</i>:<i>O</i>'-bis[(3-hydroxypyridine-κ<i>N</i>)copper(II)]","Acta Crystallographica Section E","2004","60","10","m1405","m1407","10.1107/S1600536804021993","","","0.71073","MoKα","","0.0694","0.0431","","","0.0871","0.0952","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204330","4.9243","0.001","5.7865","0.0012","11.843","0.002","92.21","0.03","95.08","0.03","96.86","0.03","333.32","0.12","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","catena-Poly[tetraaquazinc(II)-μ-benzene-1,4-dioxyacetato-κ^2^O,O']","","- C10 H16 O10 Zn -","- C10 H16 O10 Zn -","- C10 H16 O10 Zn -","1","0.5","DN6159","Liu, Ji-Wei; Gao, Shan; Huo, Li-Hua; Zhao, Hui; Zhao, Jing-Gui","<i>catena</i>-Poly[tetraaquazinc(II)-μ-benzene-1,4-dioxyacetato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2004","60","10","m1408","m1410","10.1107/S1600536804022007","","","0.71073","MoKα","","0.035","0.034","","","0.09","0.09","","","","","","1.018","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204331","15.701","0.003","7.611","0.0015","18.606","0.004","90","","90","","90","","2223.4","0.8","293","2","293","2","","","","","","","","6","P c c a","-P 2a 2ac","54","","Dichlorotetrakis(3-hydroxypyridine-κN)nickel(II)","","- C20 H20 Cl2 N4 Ni O4 -","- C20 H20 Cl2 N4 Ni O4 -","- C80 H80 Cl8 N16 Ni4 O16 -","4","0.5","ER6000","Zhang, Xian-Fa; Gao, Shan; Huo, Li-Hua; Lu, Zhen-Zhong; Zhao, Hui","Dichlorotetrakis(3-hydroxypyridine-κ<i>N</i>)nickel(II)","Acta Crystallographica Section E","2004","60","10","m1367","m1369","10.1107/S1600536804021245","","","0.71073","MoKα","","0.0683","0.0474","","","0.0978","0.1052","","","","","","1.084","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204332","9.1633","0.0018","11.836","0.002","13.911","0.003","90","","98.4","0.03","90","","1492.6","0.5","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(4-Chlorophenyl)-4,4-bis(methylsulfanyl)-1,3-butadiene-1,1-dicarbonitrile","","- C14 H11 Cl N2 S2 -","- C14 H11 Cl N2 S2 -","- C56 H44 Cl4 N8 S8 -","4","1","ER6001","Homrighausen, Craig L.; Krause Bauer, Jeanette A.","2-(4-Chlorophenyl)-4,4-bis(methylsulfanyl)-1,3-butadiene-1,1-dicarbonitrile","Acta Crystallographica Section E","2004","60","10","o1828","o1829","10.1107/S1600536804022986","","","0.71073","MoKα","","0.078","0.043","","","0.088","0.102","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204333","5.3822","0.0004","23.221","0.002","16.579","0.002","90","","94.695","0.007","90","","2065.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","DL-valine DL-valinium picrate","DL-valine DL-valinium picrate","","- C16 H25 N5 O11 -","- C16 H25 N5 O11 -","- C64 H100 N20 O44 -","4","1","FL6114","K. Anitha; S. Annavenus; B. Sridhar; R. K. Rajaram","<small>DL</small>-Valine <small>DL</small>-valinium picrate","Acta Crystallographica Section E","2004","60","10","o1722","o1724","10.1107/S1600536804021877","","","0.71073","MoKα","","0.1219","0.0584","","","0.1492","0.1811","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204334","6.6151","0.0008","10.3964","0.0012","13.9546","0.0017","90","","90","","90","","959.7","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(+)-(1S,2S,3S,4R,5R)-1-Ammonio-5-hydroxymethylcyclohexane-2,3,4-triol chloride","","- C7 H16 Cl N O4 -","- C7 H16 Cl N O4 -","- C28 H64 Cl4 N4 O16 -","4","1","FL6115","Hongjie Chang; Jiarong Zhu; Xiaolong Feng; Huaidong Xu","(+)-(1<i>S</i>,2<i>S</i>,3<i>S</i>,4<i>R</i>,5<i>R</i>)-1-Ammonio-5-hydroxymethylcyclohexane-2,3,4-triol chloride","Acta Crystallographica Section E","2004","60","10","o1712","o1714","10.1107/S1600536804020902","","","0.71073","MoKα","","0.0488","0.0471","","","0.1236","0.1242","","","","","","1.308","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204335","4.9207","0.0005","10.5041","0.001","20.357","0.002","90","","100.293","0.008","90","","1035.27","0.18","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Bromo-1-(1-hydroxynaphthalene-2-yl)ethanone","","- C12 H9 Br O2 -","- C12 H9 Br O2 -","- C48 H36 Br4 O8 -","4","1","FL6117","Yavuz Köysal; Şamil Işık; Arzu Karakurt; Sevim Dalkara","2-Bromo-1-(1-hydroxynaphthalen-2-yl)ethanone","Acta Crystallographica Section E","2004","60","10","o1730","o1732","10.1107/S1600536804021889","","","0.71073","MoKα","","0.1372","0.0515","","","0.1182","0.1351","","","","","","0.866","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204336","12.547","0.002","14.366","0.002","9.353","0.002","90","","100.18","0.03","90","","1659.3","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Diphenyl-p-methoxybenzamidine","","- C20 H18 N2 O -","- C20 H18 N2 O -","- C80 H72 N8 O4 -","4","1","FL6118","Bortoluzzi, Adailton J.; Echevarria, Aurea; Rodrigues-Santos, Claudio E.","4-Methoxy-<i>N</i>,<i>N</i>'-diphenylbenzamidine","Acta Crystallographica Section E","2004","60","10","o1837","o1839","10.1107/S1600536804021890","","","0.71073","MoKα","","0.1086","0.0433","","","0.1053","0.1256","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204337","6.6874","0.0002","16.5431","0.0005","16.7931","0.0005","90","","97.363","0.001","90","","1842.51","0.1","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H24 N4 O3 S -","- C18 H24 N4 O3 S -","- C72 H96 N16 O12 S4 -","4","1","GH6000","Fettinger, James C.; Wu, Anxin; Isaacs, Lyle","A DMSO-capped dimeric glycoluril derivative","Acta Crystallographica Section E","2004","60","10","o1814","o1816","10.1107/S1600536804022834","","","0.71073","MoKα","","0.0483","0.0412","","","0.1169","0.1228","","","","","","1.108","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204338","12.873","0.011","6.777","0.006","27.28","0.02","90","","94.393","0.012","90","","2373","3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Pentaaquaoxovanadium(IV) bis(sulfosalicylate) dihydrate","","- C14 H24 O20 S2 V -","- C14 H24 O20 S2 V -","- C56 H96 O80 S8 V4 -","4","1","HB6072","Lianzhi Li; Tao Xu; Daqi Wang; Meiju Niu","Pentaaquaoxovanadium(IV) bis(sulfonatosalicylic acid) dihydrate","Acta Crystallographica Section E","2004","60","10","m1374","m1375","10.1107/S1600536804021294","","","0.71073","MoKα","","0.0559","0.0331","","","0.0653","0.0717","","","","","","0.901","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204339","14.594","0.003","7.889","0.002","19.811","0.004","90","","102.64","0.008","90","","2225.6","0.9","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[2,6-Bis(1H-benzimidazol-2-yl)pyridine]dichlorozinc(II) N,N-dimethylformamide solvate","","- C22 H20 Cl2 N6 O Zn -","- C22 H20 Cl2 N6 O Zn -","- C88 H80 Cl8 N24 O4 Zn4 -","4","1","HB6080","Chen, Tsun-Ren","[2,6-Bis(1<i>H</i>-benzimidazol-2-yl)pyridine]dichlorozinc(II) <i>N</i>,<i>N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2004","60","10","m1544","m1546","10.1107/S1600536804024079","","","0.71073","MoKα","","0.0857","0.0497","","","0.1109","0.1257","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204340","13.261","0.003","21.51","0.004","13.978","0.003","90","","95.3","0.03","90","","3970.1","1.5","293","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C45 H41 Cl2 N P2 Pd -","- C45 H41 Cl2 N P2 Pd -","- C180 H164 Cl8 N4 P8 Pd4 -","4","1","HB6085","Pretorius, Marié; Williams, D. Bradley G.; Roodt, Andreas; Muller, Alfred","Dichloro({<i>N</i>-[2-(diphenylphosphino-κ<i>P</i>)benzyl]benzylamino}diphenylphosphine-κ<i>P</i>)palladium(II) toluene solvate","Acta Crystallographica Section E","2004","60","10","m1439","m1441","10.1107/S1600536804022214","","","0.71073","MoKα","","","0.041","","","","0.088","","","","","","0.982","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204341","13.1456","0.0004","17.1448","0.0006","13.3802","0.0006","90","","101.07","0.002","90","","2959.5","0.19","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","Bis(tetrabutyldiphenoxydistannoxane)","di-μ-(phenoxy)-1:2κ^2^O;-3:4κ^2^O-diphenoxy-1κO,4κO-octabutyl-1κ^2^C, 2κ^2^C,3κ^2^C,4κ^2^C-di-μ~3~-oxo-1:2:3κ^3^O;2:3:4κ^2^O-tetratin(IV)","","- C56 H92 O6 Sn4 -","- C56 H92 O6 Sn4 -","- C112 H184 O12 Sn8 -","2","1","HB6086","Beckmann, Jens; Dakternieks, Dainis; Duthie, Andrew; Jurkschat, Klaus; Schürmann, Markus","Octabutyl-1κ^2^<i>C</i>,2κ^2^<i>C</i>,3κ^2^<i>C</i>,4κ^2^<i>C</i>-di-μ~3~-oxo-1:2:3κ^3^<i>O</i>;2:3:4κ^2^<i>O</i>-di-μ~2~-phenoxy-1:2κ^2^<i>O</i>;3:4κ^2^<i>O</i>-diphenoxy-1κ<i>O</i>,4κ<i>O</i>-tetratin(IV)","Acta Crystallographica Section E","2004","60","10","m1437","m1438","10.1107/S1600536804022585","","","0.71073","MoKα","","0.0387","0.0255","","","0.043","0.0443","","","","","","0.871","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204342","17.259","0.006","7.249","0.003","8.03","0.003","90","","114.002","0.005","90","","917.8","0.6","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","catena-Poly[[bis(1H-1,2,3-benzotriazole\-kN^3^)cobalt(II)]-di-μ-dicyanamido- κ^4^N^1^:N^3^]","","- C16 H10 Co N12 -","- C16 H10 Co N12 -","- C32 H20 Co2 N24 -","2","0.25","HB6087","Jun Luo; Bao-Shu Liu; Xi-Geng Zhou; Lin-Hong Weng; Yan-Rong Li; Rui-Fang Cai","<i>catena</i>-Poly[[bis(1<i>H</i>-1,2,3-benzotriazole-κ<i>N</i>^3^)cobalt(II)]-di-μ-dicyanamido-κ^4^<i>N</i>^1^:<i>N</i>^3^]","Acta Crystallographica Section E","2004","60","10","m1391","m1393","10.1107/S1600536804021683","","","0.71073","MoKα","","0.0783","0.0543","","","0.1005","0.1092","","","","","","1.099","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204343","8.0562","0.0018","8.2506","0.0018","14.253","0.003","96.313","0.003","91.631","0.003","103.402","0.003","914.6","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","catena-poly[bis[cobalt(II)-2,5-bis(4-pyridyl) -1,3,4-thiadiazole](tetravanadate)(hexahydrate)]","","- C12 H14 Co N4 O9 S V2 -","- C12 H14 Co N4 O9 S V2 -","- C24 H28 Co2 N8 O18 S2 V4 -","2","1","HB6090","Zhang, Xian-Ming","<i>catena</i>-Poly[[bis[triaqua[2,5-bis(4-pyridyl)-1,3,4-thiadiazole]cobalt(II)]]-μ~4~-tetravanadato]","Acta Crystallographica Section E","2004","60","10","m1411","m1413","10.1107/S1600536804022111","","","0.71073","MoKα","","0.0458","0.0389","","","0.0903","0.0942","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204344","7.1804","0.0009","9.8372","0.0012","12.6069","0.0015","81.478","0.002","86.528","0.002","89.76","0.002","879.03","0.19","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Aqua(2,2'-diamino-4,4'-bi-1,3-thiazole)(oxydiacetato-κ^3^O,O',O'')cadmium(II) trihydrate","","- C10 H18 Cd N4 O9 S2 -","- C10 H18 Cd N4 O9 S2 -","- C20 H36 Cd2 N8 O18 S4 -","2","1","HB6091","Bing-Xin Liu; Yi-Guang Tian; Duan-Jun Xu","Aqua(2,2'-diamino-4,4'-bi-1,3-thiazole)(oxydiacetato-κ^3^<i>O,O</i>',<i>O</i>'')cadmium(II) trihydrate","Acta Crystallographica Section E","2004","60","10","m1453","m1455","10.1107/S1600536804022809","","","0.71073","MoKα","","0.035","0.031","","","0.069","0.071","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204345","5.2986","0.0007","7.4809","0.001","10.4575","0.0015","69.184","0.01","81.385","0.011","75.485","0.011","374.25","0.09","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H22 O6 Zn -","- C12 H22 O6 Zn -","- C12 H22 O6 Zn -","1","0.5","HB6092","Lerner, Hans-Wolfram; Bolte, Michael","Bis(acetylacetonato)dimethanolzinc(II)","Acta Crystallographica Section E","2004","60","10","m1468","m1469","10.1107/S1600536804022378","","","0.71073","MoKα","","0.0255","0.0248","","","0.0684","0.0688","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204346","7.5958","0.0003","13.433","0.0003","18.588","0.0004","90","","94.973","0.003","90","","1889.48","0.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Benzoylacetone (4-methoxybenzoyl)hydrazonato-κ^3^O,N^2^,O']dichloroiron(III)","","- C18 H17 Cl2 Fe N2 O3 -","- C18 H17 Cl2 Fe N2 O3 -","- C72 H68 Cl8 Fe4 N8 O12 -","4","1","HB6093","Gao, Shan; Zhang, Xian-Fa; Huo, Li-Hua; Zhao, Hui","[Benzoylacetone (4-methoxybenzoyl)hydrazonato-κ^3^<i>O,N</i>^2^,<i>O</i>']dichloroiron(III)","Acta Crystallographica Section E","2004","60","10","m1447","m1449","10.1107/S1600536804022755","","","0.71073","MoKα","","0.0582","0.0417","","","0.0935","0.0995","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204347","3.9732","0.0005","3.9732","0.0005","15.028","0.003","90","","90","","120","","205.45","0.05","293","2","293","2","","","","","","","","3","R -3 m :H","-R 3 2""","166","","β-Strontium cyanamide","","- C N2 Sr -","- C N2 Sr -","- C3 N6 Sr3 -","3","0.0833333","HB6095","Liao, Wuping; Dronskowski, Richard","β-Strontium carbodiimide","Acta Crystallographica Section E","2004","60","10","i124","i126","10.1107/S1600536804023244","","","0.71073","MoKα","","0.0174","0.0174","","","0.0408","0.0408","","","","","","1.068","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204348","8.181","0.008","8.747","0.004","8.921","0.007","80.35","0.01","74.64","0.01","73.48","0.01","587.2","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[silver(I)-μ-4,4'-bipyridine-κ^2^N:N'] perchlorate]","","- C10 H8 Ag Cl N2 O4 -","- C10 H8 Ag Cl N2 O4 -","- C20 H16 Ag2 Cl2 N4 O8 -","2","1","HB6096","Wang, Li-Shi; Zhang, Jin-Feng; Yang, Shi-Ping","<i>catena</i>-Poly[[silver(I)-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] perchlorate]","Acta Crystallographica Section E","2004","60","10","m1484","m1486","10.1107/S1600536804023141","","","0.71073","MoKα","","0.0573","0.0452","","","0.1237","0.133","","","","","","1.074","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204349","12.396","0.007","13.022","0.007","15.148","0.008","90","","107.478","0.01","90","","2332","2","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetrapyridinedithiocyanatozinc(II)","","- C22 H20 N6 S2 Zn -","- C22 H20 N6 S2 Zn -","- C88 H80 N24 S8 Zn4 -","4","0.5","HB6098","Wu, Chuan-Bao","Tetrapyridinedithiocyanatozinc(II)","Acta Crystallographica Section E","2004","60","10","m1490","m1491","10.1107/S1600536804023153","","","0.71073","MoKα","","0.0781","0.0608","","","0.1705","0.181","","","","","","1.086","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204350","7.673","0.006","12.887","0.001","11.598","0.001","90","","91.28","0.02","90","","1146.5","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","azo-enaminone","4-(E)-amino-3-[(E)-2-chlorophenylazo]-3-penten-2-one","","- C11 H12 Cl N3 O -","- C11 H12 Cl N3 O -","- C44 H48 Cl4 N12 O4 -","4","1","HG6079","Vencato, Ivo; Cunha, Silvio; Rocha, Valeria; Rocha, Zenis Novais da; Lariucci, Carlito","The azo‒enaminone 4-(<i>E</i>)-amino-3-[(<i>E</i>)-2-chlorophenyldiazenyl]pent-3-en-2-one","Acta Crystallographica Section E","2004","60","10","o1704","o1706","10.1107/S1600536804020124","","","1.5418","CuKα","","0.0692","0.0605","","","0.174","0.185","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204351","13.9733","0.0013","12.2519","0.0013","15.0884","0.0014","90","","94.558","0.002","90","","2575","0.4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4,4'-Bipyridinium bis(2-caboxybenzenesulfonate) dihydrate","","- C24 H24 N2 O12 S2 -","- C24 H24 N2 O12 S2 -","- C96 H96 N8 O48 S8 -","4","0.5","HG6080","Xin-Hua Li; Zu-Guang Li; Yu-Qing Zhu","4,4'-Bipyridinium bis(2-carboxybenzenesulfonate) dihydrate","Acta Crystallographica Section E","2004","60","10","o1666","o1667","10.1107/S1600536804021051","","","0.71073","MoKα","","0.0486","0.0465","","","0.1193","0.1211","","","","","","1.096","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204352","9.7364","0.0005","6.3254","0.0003","14.2606","0.0008","90","","94.864","0.001","90","","875.1","0.08","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tert-Butylammonium dihydrogenarsenate","","- C4 H14 As N O4 -","- C4 H14 As N O4 -","- C16 H56 As4 N4 O16 -","4","1","HG6081","Wilkinson, Hazel S.; Harrison, William T. A.","<i>tert</i>-Butylammonium dihydrogenarsenate","Acta Crystallographica Section E","2004","60","10","m1359","m1361","10.1107/S1600536804020963","","","0.71073","MoKα","","0.0608","0.0236","","","0.0558","0.0635","","","","","","0.88","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204353","19.674","0.002","9.6968","0.0008","9.8462","0.0009","90","","92.589","0.005","90","","1876.5","0.3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N,N'-bis(tert-butoxycarbonyl)cystamine","","- C14 H28 N2 O4 S2 -","- C14 H28 N2 O4 S2 -","- C56 H112 N8 O16 S8 -","4","0.5","IS6000","Bolte, Michael; Sakhaii, Peyman","<i>N,N</i>'-bis(<i>tert</i>-butoxycarbonyl)cystamine","Acta Crystallographica Section E","2004","60","10","o1682","o1683","10.1107/S1600536804021348","","","0.71073","MoKα","","0.1095","0.0456","","","0.077","0.0927","","","","","","1.017","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204354","7.068","0.001","13.4916","0.0018","8.8412","0.0012","90","","100.459","0.003","90","","829.1","0.2","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-nitrobenzenesulfonamide","","- C6 H6 N2 O4 S -","- C6 H6 N2 O4 S -","- C24 H24 N8 O16 S4 -","4","1","IS6001","Zhou, Tianyan; Zhang, Qiang; Chen, Guoshu; Zhou, Zhongyuan","Redetermination of 4-nitrobenzenesulfonamide","Acta Crystallographica Section E","2004","60","10","o1767","o1768","10.1107/S1600536804022081","","","0.71073","MoKα","","0.056","0.0402","","","0.1019","0.1118","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204355","8.312","0.001","11.696","0.002","11.705","0.001","97.42","0.01","101.634","0.009","93.01","0.01","1101.6","0.3","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","methyl 2-amino-4-(4-nitrophenyl)-5,6-dihydro-4H-pyrano [3,2-c] quinoline-5-one-3-carboxylate dimethylformamide solvate","","- C23 H22 N4 O7 -","- C23 H22 N4 O7 -","- C46 H44 N8 O14 -","2","1","IS6003","Xiang-Shan Wang; Zhao-Sen Zeng; Da-Qing Shi; Hong Chen; Xian-Yong Wei; Zhi-Min Zong","Methyl 2-amino-4-(4-nitrophenyl)-5-oxo-5,6-dihydro-4<i>H</i>-pyrano[3,2-<i>c</i>]quinoline-3-carboxylate dimethylformamide solvate","Acta Crystallographica Section E","2004","60","10","o1745","o1747","10.1107/S1600536804022093","","","0.71073","MoKα","","0.1041","0.0649","","","0.1882","0.2088","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204356","7.091","0.001","9.906","0.001","10.262","0.001","117.552","0.002","102.567","0.002","97.488","0.002","601.15","0.12","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","1-(2-Bromo-1,1-dimethoxyethyl)-4-nitrobenzene","","- C10 H12 Br N O4 -","- C10 H12 Br N O4 -","- C20 H24 Br2 N2 O8 -","2","1","KP6000","Shen, Yu-Dong; Wu, Hai-Qiang; Bu, Xian-Zhang; Gu, Lian-Quan; Ng, Seik Weng","1-(2-Bromo-1,1-dimethoxyethyl)-4-nitrobenzene","Acta Crystallographica Section E","2004","60","10","o1778","o1780","10.1107/S160053680402241X","","","0.71073","MoKα","","0.041","0.033","","","0.083","0.088","","","","","","1.02","","","","has coordinates,has Fobs","255781","2020-10-21","18:00:00",""
"2204357","9.828","0.001","6.849","0.001","17.634","0.001","90","","96.36","0.01","90","","1179.7","0.2","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Methyl 2,3,4-tri-O-pivaloyl-β-D-xylopyranoside","","- C21 H36 O8 -","- C21 H36 O8 -","- C42 H72 O16 -","2","1","KP6001","Prugovečki, Biserka; Matković-Čalogović, Dubravka; Petrović, Vesna; Tomić, Srđanka","Methyl 2,3,4-tri-<i>O</i>-pivaloyl-β-<small>D</small>-xylopyranoside","Acta Crystallographica Section E","2004","60","10","o1840","o1841","10.1107/S1600536804022925","","","0.71069","MoKα","","0.0406","0.039","","","0.0933","0.0944","","","","","","1.143","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204358","9.815","0.002","6.372","0.001","9.919","0.002","90","","102.753","0.004","90","","605","0.2","295","2","295","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","catena-Poly[bis[oxo(1,10-phenanthroline)vanadium(IV)]-di-μ-hydrogenphosphato]","","- C24 H18 N4 O10 P2 V2 -","- C24 H18 N4 O10 P2 V2 -","- C24 H18 N4 O10 P2 V2 -","1","0.25","KP6002","Fu, Yun-Long; Ren, Jia-Lin; Ng, Seik Weng","<i>catena</i>-Poly[[oxo(1,10-phenanthroline)vanadium(IV)]-di-μ-hydrogenphosphato]","Acta Crystallographica Section E","2004","60","10","m1542","m1543","10.1107/S1600536804023931","","","0.71073","MoKα","","0.1203","0.0637","","","0.1497","0.2241","","","","","","1.094","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204359","11.7423","0.0004","12.4902","0.0006","13.8929","0.0004","95.577","0.003","91.221","0.0008","90.524","0.002","2027.35","0.13","295","1","","","","","","","","","","5","P -1","-P 1","2","","","","- C21 H13 Cl4 N O2 -","- C21 H13 Cl4 N O2 -","- C84 H52 Cl16 N4 O8 -","4","2","LH6261","Xiu-Rong Hu; Jian-Ming Gu","<i>N</i>-[3-Phenyl-1-(2,3,5,6-tetrachloro-4-hydroxyphenoxy)prop-2-enylidene]aniline","Acta Crystallographica Section E","2004","60","10","o1773","o1774","10.1107/S1600536804022354","","","0.7107","MoKα","","0.0497","0.0396","","","0.1049","0.1168","","","","","","1.102","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204360","8.7884","0.0015","13.765","0.003","10.2773","0.0012","90","","114.741","0.012","90","","1129.1","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[N,N'-ethylenediamide-bis(2-aminoethyl)]bis(imidazole) dicopper(II) diperchlorate","[N,N'-ethylenediamide-bis(2-aminoethyl)]bis(imidazole) dicopper(II) diperchlorate","","- C12 H20 Cl2 Cu2 N8 O10 -","- C12 H20 Cl2 Cu2 N8 O10 -","- C24 H40 Cl4 Cu4 N16 O20 -","2","0.5","LH6262","Li, Yan-Ping; Yang, Pin; Huang, Zi-Xiang; Xie, Fu-Xin","[μ-<i>N,N</i>'-Bis(2-aminoethyl)ethanediamido(2‒)-κ^6^<i>N</i>,<i>N</i>',<i>O</i>:<i>O</i>',<i>N</i>'',<i>N</i>''']bis[(1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II)] diperchlorate","Acta Crystallographica Section E","2004","60","10","m1425","m1427","10.1107/S160053680402183X","","","0.71073","MoKα","","0.0309","0.0293","","","0.0755","0.0766","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204361","9.35","0.003","10.454","0.003","18.902","0.007","90","","103.764","0.014","90","","1794.5","1","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","catena-Poly[[trimethyltin(IV)]-μ-2-phenyl-3-(4-chlorophenyl)propenoato- κ^2^O:O']","catena-Poly[[trimethyltin(IV)]-μ-2-phenyl-3-(4-chlorophenyl)propenoato- κ^2^O:O']","","- C18 H19 Cl O2 Sn -","- C18 H19 Cl O2 Sn -","- C72 H76 Cl4 O8 Sn4 -","4","1","LH6264","Sadiq-ur-Rehman; Ali, Saqib; Mazhar, Muhammad; Parvez, Masood","<i>catena</i>-Poly[[trimethyltin(IV)]-μ-3-(4-chlorophenyl)-2-phenylpropenoato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2004","60","10","m1394","m1396","10.1107/S1600536804021774","","","0.71073","MoKα","","0.057","0.034","","","0.07","0.079","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204362","5.227","0.001","11.709","0.002","9.799","0.002","90","","101.63","0.03","90","","587.4","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaqua-trans-bis(pyridazine-3-carboxylato-κ^2^O,N)zinc(II)","","- C10 H10 N4 O6 Zn -","- C10 H10 N4 O6 Zn -","- C20 H20 N8 O12 Zn2 -","2","0.5","LH6265","Gryz, Michał; Starosta, Wojciech; Leciejewicz, Janusz","Diaqua-<i>trans</i>-bis(pyridazine-3-carboxylato-κ^2^<i>O,N</i>)zinc(II)","Acta Crystallographica Section E","2004","60","10","m1481","m1483","10.1107/S1600536804023025","","","0.71073","MoKα","","0.0433","0.0415","","","0.1118","0.1135","","","","","","1.076","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204363","22.105","0.003","10.7547","0.0013","17.074","0.002","90","","127.879","0.004","90","","3203.8","0.7","195","2","195","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","5-tert-butylpyrazole","","- C7 H12 N2 -","- C7 H12 N2 -","- C112 H192 N32 -","16","2","LH6270","Zhang, Fan; Wagner, Matthias; Bats, Jan W.","High-temperature phase of 5-<i>tert</i>-butylpyrazole","Acta Crystallographica Section E","2004","60","10","o1804","o1806","10.1107/S160053680402269X","","","0.71073","MoKα","","0.1776","0.0601","","","0.1198","0.1507","","","","","","1.055","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204364","9.292","0.001","9.449","0.001","10.973","0.001","94.99","0.01","98.14","0.02","102.84","0.01","922.85","0.18","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 3-amino-1-(4-chlorophenyl)-1H-benzo[f]chromene-2-carboxylate","","- C22 H18 Cl N O3 -","- C22 H18 Cl N O3 -","- C44 H36 Cl2 N2 O6 -","2","1","LH6271","Daqing Shi; Xiangshan Wang; Qiya Zhuang","Ethyl 3-amino-1-(4-chlorophenyl)-1<i>H</i>-benzo[<i>f</i>]chromene-2-carboxylate","Acta Crystallographica Section E","2004","60","10","o1807","o1809","10.1107/S1600536804022706","","","0.71073","MoKα","","0.0571","0.0393","","","0.1008","0.1073","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204365","10.3002","0.0001","11.7916","0.0002","17.5843","0.0002","90","","101.27","0.0009","90","","2094.53","0.05","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","lorastan","2-butyl-4-chloro-1-[2'-(2H-tetrazol-5-yl)-1,1'-biphenyl-4-ylmethyl]-1H- imidazole-5-methanol","","- C22 H23 Cl N6 O -","- C22 H23 Cl N6 O -","- C88 H92 Cl4 N24 O4 -","4","1","LH6272","Limor Tessler; Israel Goldberg","Losartan, an antihypertensive drug","Acta Crystallographica Section E","2004","60","10","o1830","o1832","10.1107/S1600536804022949","","","0.71073","MoKα","","0.052","0.0406","","","0.1008","0.1088","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204366","12.423","0.002","7.843","0.001","12.871","0.002","90","","109.44","0.02","90","","1182.6","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H11 Cl3 N2 O -","- C7 H11 Cl3 N2 O -","- C28 H44 Cl12 N8 O4 -","4","1","LH6273","Stumpf, Silvia; Wagner, Matthias; Bolte, Michael","4-Hydroxymethyl-3,5-dimethyl-1<i>H</i>-pyrazole chloroform solvate","Acta Crystallographica Section E","2004","60","10","o1754","o1755","10.1107/S1600536804022317","","","0.71073","MoKα","","0.1609","0.0763","","","0.169","0.2104","","","","","","1.017","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204367","5.283","0.002","15.937","0.004","4.6205","0.0018","90","","108.78","0.03","90","","368.3","0.2","173","2","173","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","trans-2,5,7,10-tetraazabicyclo[4.4.0]decane","","- C6 H14 N4 -","- C6 H14 N4 -","- C12 H28 N8 -","2","0.25","LH6274","Sänger, Inge; Lerner, Hans-Wolfram; Bolte, Michael","Redetermination of <i>trans</i>-2,5,7,10-tetraazabicyclo[4.4.0]decane","Acta Crystallographica Section E","2004","60","10","o1847","o1848","10.1107/S1600536804022688","","","0.71073","MoKα","","0.0572","0.0499","","","0.1387","0.1444","","","","","","0.994","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204368","12.971","0.002","13.429","0.003","15.088","0.003","92.49","0.011","96.82","0.011","118.531","0.008","2277.5","0.8","173","2","173","2","","","","","","","","4","P -1","-P 1","2","dimeric distannoxane","bis[μ~2~-3-(4-methoxyphenyl)-2-phenyl-2-propenoato]bis[3-(4-methoxyphenyl)- 2-phenyl-2-propenoato]di-μ~3~oxo-tetrakis[dibutyltin(IV)]","","- C96 H124 O14 Sn4 -","- C96.024 H124 O14 Sn4 -","- C96.024 H124 O14 Sn4 -","1","0.5","LH6275","Parvez, Masood; Sadiq-ur-Rehman; Shahid, Khadija; Ali, Saqib; Mazhar, Muhammad","Tetrabutylbis[3-(4-methoxyphenyl)-2-phenyl-2-propenoato]distannoxane dimer","Acta Crystallographica Section E","2004","60","10","m1465","m1467","10.1107/S1600536804022950","","","0.71073","MoKα","","0.1","0.046","","","0.082","0.097","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204369","9.4976","0.0009","12.5798","0.0016","12.622","0.003","66.096","0.013","84.511","0.013","70.047","0.009","1294.3","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(tetraphenylphosphonium) bis(tetraselenomolybdato)palladate(II)","","- C48 H40 Mo2 P2 Pd Se8 -","- C48 H40 Mo2 P2 Pd Se8 -","- C48 H40 Mo2 P2 Pd Se8 -","1","0.5","LH6276","Shiffler, Zachary J.; Baldwin, Steven M.; Keane, Joseph M.; Belz, Brian L.; Barr, Matthew L.; Slavin III, Edward R.; Kastner, Margaret E.; Mahler, Charles H.","Bis(tetraphenylphosphonium) bis(tetraselenomolybdato)palladate(II)","Acta Crystallographica Section E","2004","60","10","m1539","m1541","10.1107/S1600536804023104","","","0.71073","MoKα","","0.0831","0.053","","","0.1347","0.152","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204370","7.041","0.001","7.2791","0.001","8.0673","0.0011","116.563","0.002","107.909","0.002","98.437","0.003","331.7","0.08","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Poly[[trans-dibromocopper(II)]-di-μ-3-pyridinecarbonitrile-κ^2^N^1^:N^3^]","","- C12 H8 Br2 Cu N4 -","- C12 H8 Br2 Cu N4 -","- C12 H8 Br2 Cu N4 -","1","0.5","LH6277","Xin-Hua Li; Hua-Yue Wu; Jin-Guo Hu","Poly[[<i>trans</i>-dibromocopper(II)]-di-μ-3-pyridinecarbonitrile-κ^4^<i>N</i>^1^:<i>N</i>^3^]","Acta Crystallographica Section E","2004","60","10","m1533","m1535","10.1107/S1600536804023578","","","0.71073","MoKα","","0.029","0.0275","","","0.0785","0.0795","","","","","","1.099","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204371","9.2068","0.0005","9.7961","0.0005","10.1375","0.0006","94.732","0.004","112.57","0.005","102.194","0.004","811.57","0.09","293","","293","2","","","","","","","","3","P -1","-P 1","2","","2-benzoyloxy-5-methylbenzophenone","","- C21 H16 O3 -","- C21 H16 O3 -","- C42 H32 O6 -","2","1","LH6278","Sieroń, Lesław; Shashikanth, S.; Yathirajan, H. S.; Venu, T. D.; Nagaraj, B.; Nagaraja, P.; Khanum, S. A.","2-Benzoyloxy-5-methylbenzophenone","Acta Crystallographica Section E","2004","60","10","o1889","o1891","10.1107/S1600536804023463","","","0.71073","MoKα","","0.0357","0.0324","","","0.0849","0.088","","","","","","1.046","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204372","15.96","0.002","4.8404","0.0004","20.313","0.003","90","","110.58","0.04","90","","1469.1","0.5","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Hydroxypyridinium 3-(carboxymethoxy)phenoxyacetate","","- C15 H15 N O7 -","- C15 H15 N O7 -","- C60 H60 N4 O28 -","4","1","NC6000","Gao, Shan; Liu, Ji-Wei; Huo, Li- Hua; Zhao, Hui; Ng, Seik Weng","3-Hydroxypyridinium 3-(carboxymethoxy)phenoxyacetate","Acta Crystallographica Section E","2004","60","10","o1854","o1855","10.1107/S1600536804023219","","","0.71073","MoKα","","0.108","0.057","","","0.113","0.129","","","","","","1.02","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204373","12.638","0.002","14.039","0.003","12.102","0.002","90","","94.6","0.01","90","","2140.3","0.7","288","2","288","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3,3,6,6-Tetramethyl-N-hydroxy-9-(4-fluorophenyl)-1,2,3,4,5,6,7,8,9,10- decahydroacridine-1,8-dione monohydrate","","- C23 H28 F N O4 -","- C23 H28 F N O4 -","- C92 H112 F4 N4 O16 -","4","1","OB6404","Shujiang Tu; Fang Fang; Songlei Zhu","9-(4-Fluorophenyl)-<i>N</i>-hydroxy-3,3,6,6-tetramethyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione monohydrate","Acta Crystallographica Section E","2004","60","10","o1677","o1679","10.1107/S1600536804021361","","","0.71073","MoKα","","0.0746","0.0398","","","0.0932","0.102","","","","","","0.906","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204374","8.3801","0.0019","9.543","0.002","16.348","0.004","90","","90","","90","","1307.4","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","gem-chloronitroso-cyclododecane","1,1-chloronitroso-cyclododecane","","- C12 H22 Cl N O -","- C12 H22 Cl N O -","- C48 H88 Cl4 N4 O4 -","4","1","OB6412","C.R. Girija.; Noor Shahina Begum; Abdul Karim, H.A.M; Gopalpur Nagendrappa.","<i>gem</i>-Chloronitrosocyclododecane, (CH~2~)~<i>n~{‒</i>1}CNOCl, with <i>n</i> = 12","Acta Crystallographica Section E","2004","60","10","o1764","o1766","10.1107/S1600536804022068","","","0.71073","MoKα","","0.0776","0.0539","","","0.14","0.1548","","","","","","0.948","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2204375","12.6005","0.0002","14.097","0.0002","18.3091","0.0003","83.206","0.001","75.675","0.001","70.433","0.001","2966.9","0.08","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","Tris(tetraethylammonium) tris(μ-4-pyridinemethanolato)bis[tricarbonyltungsten(0)] acetonitrile trisolvate","","- C54 H87 N9 O9 W2 -","- C54 H87 N9 O9 W2 -","- C108 H174 N18 O18 W4 -","2","1","OB6415","Klausmeyer, Kevin K.; Adrian, Rafael A.","Tris(tetraethylammonium) tris(μ-4-pyridinemethanolato)bis[tricarbonyltungsten(0)] acetonitrile trisolvate","Acta Crystallographica Section E","2004","60","10","m1414","m1416","10.1107/S1600536804021063","","","0.71073","MoKα","","0.0238","0.0178","","","0.041","0.0422","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204376","8.422","0.002","10.585","0.003","12.866","0.003","79.879","0.004","76.281","0.004","79.042","0.004","1083.6","0.5","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","5-Benzyl-8-(E)-benzylidene-6,7,7a,10a-tetrahydro-5H-cis- cyclopenta[5,6]pyrano[3,3-c]quinolin-6-one","","- C29 H23 N O2 -","- C29 H23 N O2 -","- C58 H46 N2 O4 -","2","1","OB6416","S.Aravindan; N.Sampath; M.N.Ponnuswamy; N.Kalaivasan; R.Raghunathan; M.Nethaji","5-Benzyl-8-(<i>E</i>)-benzylidene-6,7,7a,10a-tetrahydro-5<i>H</i>-<i>cis</i>-cyclopenta[5,6]pyrano[3,3-<i>c</i>]quinolin-6-one","Acta Crystallographica Section E","2004","60","10","o1699","o1701","10.1107/S160053680402135X","","","0.71073","MoKα","","0.0846","0.0586","","","0.121","0.132","","","","","","1.118","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204377","4.7557","0.0006","5.5781","0.0013","40.93","0.004","92.452","0.012","92.094","0.009","102.365","0.013","1058.5","0.3","296","1","","","","","","","","","","3","P -1","-P 1","2","","","","- C19 H40 S2 -","- C19 H40 S2 -","- C38 H80 S4 -","2","1","RN6022","Naotake Nakamura; Hirotaka Shimizu; Yoshihiro Ogawa","Nonadecane-1,19-dithiol","Acta Crystallographica Section E","2004","60","10","o1684","o1686","10.1107/S1600536804021312","","","1.5418","CuKα","","","0.061","","","","0.127","","","","","","1.003","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204378","15.5021","0.0019","6.6902","0.0008","22.676","0.003","90","","90","","90","","2351.8","0.5","298","2","298","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","7a,8,9,10-Tetrahydrobenzo[f]cyclopenta[b]chromen-10-one","","- C16 H12 O2 -","- C16 H12 O2 -","- C128 H96 O16 -","8","1","RN6023","Huo, Fangjun; Yin, Caixia; Yang, Pin","7a,8,9,10-Tetrahydrobenzo[<i>f</i>]cyclopenta[<i>b</i>]chromen-10-one","Acta Crystallographica Section E","2004","60","10","o1671","o1673","10.1107/S1600536804021403","","","0.71073","MoKα","","0.0466","0.0369","","","0.0918","0.0983","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204379","25.84","0.008","7.0633","0.001","17.107","0.005","90","","108.79","0.03","90","","2955.9","1.4","298","","298","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15 H13 Cl2 N O4 -","- C15 H13 Cl2 N O4 -","- C120 H104 Cl16 N8 O32 -","8","1","RZ6000","Hiroyuki Ishida","1,2,3,4-Tetrahydroquinolinium hydrogen chloranilate","Acta Crystallographica Section E","2004","60","10","o1674","o1676","10.1107/S1600536804021531","","","0.71073","MoKα","","0.067","0.042","","","0.11","0.121","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204380","9.4403","0.0019","3.739","0.0007","19.737","0.004","90","","101.67","0.03","90","","682.3","0.2","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Zoxazolamine","2-Amino-5-chloro-1,3-benzoxazole","","- C7 H5 Cl N2 O -","- C7 H5 Cl N2 O -","- C28 H20 Cl4 N8 O4 -","4","1","RZ6001","Daniel E. Lynch","2-Amino-5-chloro-1,3-benzoxazole","Acta Crystallographica Section E","2004","60","10","o1715","o1716","10.1107/S1600536804021786","","","0.71073","MoKα","","0.0334","0.0294","","","0.0808","0.0838","","","","","","1.064","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204381","11.434","0.004","7.82","0.003","27.782","0.01","90","","95.306","0.006","90","","2473.5","1.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-{2-Methoxy-5-[3,4-dimethyl-5-(3,4,5-trimethoxyphenyl)thiophen-2- yl]phenyl}morpholine","","- C26 H31 N O5 S -","- C26 H31 N O5 S -","- C104 H124 N4 O20 S4 -","4","1","RZ6002","Shi, Jixian; Hu, Qingping; Lei, Yingjie; Reiner, John","4-{5-[3,4-Dimethyl-5-(3,4,5-trimethoxyphenyl)thiophen-2-yl]-2-methoxyphenyl}morpholine","Acta Crystallographica Section E","2004","60","10","o1810","o1811","10.1107/S1600536804022810","","","0.71073","MoKα","","0.0934","0.0504","","","0.1043","0.1191","","","","","","1.011","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204382","8.216","0.001","11.695","0.002","12.204","0.002","77.44","0.01","89","0.01","78.4","0.01","1120.8","0.3","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","Methyl 2-amino-4-(3-nitrophenyl)-5-oxo-5,6-dihydro-4H-pyrano[3,2-c]quinoline- 3-carboxylate dimethylformamide solvate","","- C23 H22 N4 O7 -","- C23 H22 N4 O7 -","- C46 H44 N8 O14 -","2","1","SJ6003","Xiang-Shan Wang; Zhao-Sen Zeng; Da-Qing Shi; Xian-Yong Wei; Zhi-Min Zong","Methyl 2-amino-4-(3-nitrophenyl)-5-oxo-5,6-dihydro-4<i>H</i>-pyrano[3,2-<i>c</i>]quinoline-3-carboxylate dimethylformamide solvate","Acta Crystallographica Section E","2004","60","10","o1877","o1879","10.1107/S160053680402358X","","","0.71073","MoKα","","0.0714","0.041","","","0.099","0.1076","","","","","","0.902","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204383","9.25","0.003","10.701","0.003","12.135","0.004","74.918","0.004","89.738","0.004","85.213","0.004","1155.6","0.6","163","2","163","2","","","","","","","","4","P -1","-P 1","2","6-Amino-5,5-diisopropyl-5H-pyrimidine-2,4-dione hemihydrate","6-Amino-5,5-diisopropyl-5H-pyrimidine-2,4-dione hemihydrate","","- C10 H18 N3 O2.5 -","- C10 H18 N3 O2.5 -","- C40 H72 N12 O10 -","4","2","SJ6004","Lewis, William; McKeown, Robert H.; Robinson, Ward T.","6-Amino-5,5-diisopropyl-5<i>H</i>-pyrimidine-2,4-dione hemihydrate","Acta Crystallographica Section E","2004","60","10","o1739","o1741","10.1107/S1600536804022056","","","0.71073","MoKα","","0.0404","0.035","","","0.0938","0.0977","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204384","10.527","0.002","7.0943","0.0014","13.007","0.003","90","","113.83","0.03","90","","888.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetraaquabis[(2-oxo-4H-pyridin-1-yl)acetate]cobalt(II)","","- C14 H20 Co N2 O10 -","- C14 H20 Co N2 O10 -","- C28 H40 Co2 N4 O20 -","2","0.5","SJ6005","Shan Gao; Zhu-Yan Zhang; Li-Hua Huo; Hui Zhao; Jing-Gui Zhao","Tetraaquabis[(2-oxo-1,2-dihydropyridin-1-yl)acetato-κ<i>O</i>^2^]cobalt(II)","Acta Crystallographica Section E","2004","60","10","m1422","m1424","10.1107/S1600536804022196","","","0.71073","MoKα","","0.047","0.039","","","0.096","0.1","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204385","9.046","0.002","14.626","0.003","17.588","0.004","104.4","0.02","100.2","0.02","92.47","0.02","2209","0.9","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","catena-poly[[[aquabis(pyridine-κN)copper(II)]-μ-1,3-phenylenedioxydiacetato- κ^2^-O:O'] dihydrate]‒catena-poly[[[bis(pyridine-κN)copper(II)]- μ-1,3-phenylenedioxydiacetato-κ^2^-O:O'] trihydrate] (1.5/0.5)","","- C40 H48 Cu2 N4 O18 -","- C40 H48 Cu1.999 N4 O18 -","- C80 H96 Cu3.998 N8 O36 -","2","1","SJ6006","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","<i>catena</i>-Poly[[[aquadipyridinecopper(II)]-μ-1,3-phenylenedioxydiacetato-κ^2^<i>O</i>:<i>O</i>'] dihydrate]","Acta Crystallographica Section E","2004","60","10","m1475","m1477","10.1107/S1600536804023037","","","0.71073","MoKα","","0.1137","0.0583","","","0.1159","0.1352","","","","","","1.012","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204386","10.6019","0.0003","18.0331","0.0005","18.3529","0.0005","91.372","0.001","93.985","0.001","105.418","0.001","3371.06","0.16","113","2","113","2","","","","","","","","7","P -1","-P 1","2","","Bis[1,3-bis(diphenylphosphino)propane-κ^2^P,P']silver(I) hemi[cyclopentyldiphenylbis(trifluoroacetato-κO)stannate(IV)] hemi[triphenylbis(trifluoroacetato)stannate(IV)]","","- C75.5 H69 Ag F6 O4 P4 Sn -","- C75.5 H69 Ag F6 O4 P4 Sn -","- C151 H138 Ag2 F12 O8 P8 Sn2 -","2","1","SJ6007","Teo, Yin Yin; Lo, Kong Mun; Ng, Seik Weng","Bis[1,3-bis(diphenylphosphino)propane-κ^2^<i>P,P</i>']silver(I) hemi[cyclopentyldiphenylbis(trifluoroacetato-κ<i>O</i>)stannate(IV)] hemi[triphenylbis(trifluoroacetato-κ<i>O</i>)stannate(IV)]","Acta Crystallographica Section E","2004","60","10","m1478","m1480","10.1107/S1600536804023049","","","0.71073","MoKα","","0.0661","0.0474","","","0.1199","0.1333","","","","","","1.015","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2204387","6.9316","0.0009","9.1453","0.0011","9.3055","0.0011","87.093","0.002","77.229","0.002","87.885","0.002","574.36","0.12","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis(1H-imidazole-4,5-dicarboxylato-κN^3^)cobalt(II) N,N-dimethylformamide disolvate","","- C16 H24 Co N6 O12 -","- C16 H24 Co N6 O12 -","- C16 H24 Co N6 O12 -","1","0.5","SJ6008","Hong-Ping Xiao; Xin-Hua Li; Qian Shi","Diaquabis(1<i>H</i>-imidazole-4,5-dicarboxylato-κ<i>N</i>^3^)cobalt(II) <i>N,N</i>-dimethylformamide disolvate","Acta Crystallographica Section E","2004","60","10","m1519","m1521","10.1107/S1600536804023311","","","0.71073","MoKα","","0.0659","0.0511","","","0.1081","0.1147","","","","","","1.025","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204388","6.392","0.003","9.081","0.004","11.099","0.005","113.793","0.006","95.328","0.007","99.931","0.006","571.2","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","3-(4-Fluorobenzyl)-2-thioxo-3,4,5,6-tetrahydropyrimidin-4(1H)-one","","- C11 H11 F N2 O S -","- C11 H11 F N2 O S -","- C22 H22 F2 N4 O2 S2 -","2","1","SJ6011","Chang-Sheng Yao; Hai-Bin Song; You-Quan Zhu; Ying Gao; Fang-Zhong Hu; Xiao-Mao Zou; Hua-Zheng Yang","3-(4-Fluorobenzyl)-2-thioxo-3,4,5,6-tetrahydropyrimidin-4(1<i>H</i>)-one","Acta Crystallographica Section E","2004","60","10","o1909","o1910","10.1107/S160053680402402X","","","0.71073","MoKα","","0.0393","0.0323","","","0.0893","0.0957","","","","","","1.066","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204389","13.572","0.004","10.37","0.003","19.435","0.006","90","","108.899","0.005","90","","2587.9","1.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","9-Anthracenemethylpropylamine diphenylphosphoride monohydrate","","- C30 H32 N O3 P -","- C30 H32 N O3 P -","- C120 H128 N4 O12 P4 -","4","1","SU6136","Liu, Qing-Xiang; Song, Hai-Bin; Li, Zheng-Ming","<i>N</i>-(9-Anthrylmethyl)propylaminium diphenylphosphinate monohydrate","Acta Crystallographica Section E","2004","60","10","o1759","o1761","10.1107/S1600536804022160","","","0.71073","MoKα","","0.1864","0.1027","","","0.2573","0.3165","","","","","","1.017","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204390","20.694","0.007","12.031","0.004","23.694","0.008","90","","90","","90","","5899","3","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C37 H38 N2 -","- C37 H38 N2 -","- C296 H304 N16 -","8","1","SU6137","Liu, Qing-Xiang; Song, Hai-Bin","Bis[<i>N</i>-(9-anthrylmethyl)propylamino]methane","Acta Crystallographica Section E","2004","60","10","o1762","o1763","10.1107/S1600536804022172","","","0.71073","MoKα","","0.2116","0.0612","","","0.1328","0.1984","","","","","","0.985","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204391","6.613","0.002","11.858","0.004","13.936","0.005","90","","94.216","0.004","90","","1089.9","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Di(ethylendiamine-κ2N,N^'^)(thiosulfato-κS) copper(II)","","- C4 H16 Cu N4 O3 S2 -","- C4 H16 Cu N4 O3 S2 -","- C16 H64 Cu4 N16 O12 S8 -","4","1","SU6138","Fu, Ai-Yun; Wang, Da-Qi; Wang, Fu-Ming","Bis(ethylenediamine-κ^2^<i>N,N</i>')(thiosulfato-κ<i>S</i>)copper(II)","Acta Crystallographica Section E","2004","60","10","m1527","m1529","10.1107/S1600536804022184","","","0.71073","MoKα","","0.0534","0.0382","","","0.0919","0.0993","","","","","","0.934","","","","has coordinates,has Fobs","194596","2020-10-21","18:00:00",""
"2204392","17.049","0.004","4.154","0.009","19.13","0.004","90","","102.695","0.004","90","","1322","3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,6-Dimethyl-4-(4-methoxyphenyldiazenyl)phenol","","- C15 H16 N2 O2 -","- C15 H16 N2 O2 -","- C60 H64 N8 O8 -","4","1","SU6139","Kocaokutgen, Hasan; Gür, Mahmut; Soylu, M. Serkan; Lörnnecke, Peter","4-(4-Methoxyphenyldiazenyl)-2,6-dimethylphenol","Acta Crystallographica Section E","2004","60","10","o1756","o1758","10.1107/S1600536804022147","","","0.71073","MoKα","","0.0719","0.0514","","","0.1204","0.1309","","","","","","1.105","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204393","7.128","0.003","13.46","0.003","19.731","0.005","90","","90","","90","","1893.1","0.8","293","2","293","2","","","","","","","","4","I b c a","-I 2b 2c","73","","","","- C8 H8 N2 O7 -","- C8 H8 N2 O7 -","- C64 H64 N16 O56 -","8","0.5","SU6140","Sun, Yu-Xi; Nie, Yi","Ammonium 2,6-dicarboxyl-4-nitrophenol","Acta Crystallographica, Section E","2004","60","10","m1742","m1744","10.1107/S1600536804022135","","","0.71073","MoKα","","0.0636","0.0587","","","0.1909","0.197","","","","","","1.119","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2204394","7.165","0.001","8.215","0.002","11.316","0.002","101.36","0.03","101.31","0.03","92.57","0.03","637.9","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","hexane-1,6-diammonium dipicrate dihydrate","","- C18 H26 N8 O16 -","- C18 H26 N8 O16 -","- C18 H26 N8 O16 -","1","0.5","SU6142","Zhi-Dong Lin; Jin-Yu Lu","Hexane-1,6-diammonium dipicrate dihydrate","Acta Crystallographica Section E","2004","60","10","o1886","o1888","10.1107/S1600536804023918","","","0.71073","MoKα","","0.0524","0.0395","","","0.1058","0.1203","","","","","","0.911","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204395","11.255","0.002","14.108","0.003","14.576","0.003","90","","103.37","0.03","90","","2251.7","0.8","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Benzimidazolium hydrogen bis(3-carboxyphenoxyacetate)","","- C25 H22 N2 O10 -","- C25 H22 N2 O10 -","- C100 H88 N8 O40 -","4","0.5","SU6143","Gao, Shan; Huo, Li-Hua; Gu, Chang-Sheng; Zhao, Hui; Ng, Seik Weng","Benzimidazolium hydrogen bis(3-carboxyphenoxyacetate)","Acta Crystallographica Section E","2004","60","10","o1856","o1858","10.1107/S1600536804023281","","","0.71073","MoKα","","0.0837","0.0687","","","0.1886","0.1962","","","","","","1.182","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204396","14.385","0.002","14.605","0.002","14.655","0.002","86.95","0.03","67.22","0.03","70.38","0.03","2663.5","1.1","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Bis[(acetato-κO)bis(2,2'-bipyridine-κ^2^N,N')copper(II)] 4-carboxyphenoxyacetate hexahydrate","","- C53 H56 Cu2 N8 O15 -","- C53 H56 Cu2 N8 O15 -","- C106 H112 Cu4 N16 O30 -","2","1","SU6144","Gao, Shan; Huo, Li-Hua; Gu, Chang-Sheng; Zhao, Hui; Ng, Seik Weng","Bis[(acetato-κ<i>O</i>)bis(2,2'-bipyridine-κ^2^<i>N,N</i>')copper(II)] 4-carboxyphenoxyacetate hexahydrate","Acta Crystallographica Section E","2004","60","10","m1487","m1489","10.1107/S160053680402327X","","","0.71073","MoKα","","0.0934","0.0464","","","0.0935","0.1063","","","","","","0.979","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204397","11.0498","0.0004","11.0498","0.0004","16.0416","0.0011","90","","90","","120","","1696.24","0.15","293","2","293","2","","","","","","","","6","R 3 :H","R 3","146","","","","- C12 H24 Cl2 N6 S3 Zn -","- C12 H24 Cl2 N6 S3 Zn -","- C36 H72 Cl6 N18 S9 Zn3 -","3","0.333333","TK6186","Hai Qing Sun; Wen Tao Yu; Duo Rong Yuan; Xin Qing Wang; Gang, Xue","Tris(allylthiourea-κ<i>S</i>)chlorozinc(II) chloride","Acta Crystallographica Section E","2004","60","10","m1431","m1433","10.1107/S1600536804022512","","","0.71073","MoKα","","0.05","0.037","","","0.086","0.093","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204398","9.791","0.002","9.858","0.001","12.274","0.002","69.12","0.01","75.74","0.01","89.54","0.01","1068.6","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","hydroxylethylammonium enrofloxacinate","2-hydroxyethanaminium 1-cyclopropyl-7-(4-ethylpiperazin-1-yl)-6-fluoro-4-oxo-1,4-dihydroquinoline- 3-carboxylate","","- C21 H29 F N4 O4 -","- C21 H29 F N4 O4 -","- C42 H58 F2 N8 O8 -","2","1","WK6021","Hong-Xiang Sun; Yuan Li; Yuan-Jiang Pan","2-Hydroxyethanaminium enrofloxacinate","Acta Crystallographica Section E","2004","60","10","o1694","o1696","10.1107/S1600536804021233","","","0.71073","MoKα","","0.056","0.037","","","0.097","0.102","","","","","","0.948","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204399","7.4923","0.0014","7.7866","0.0014","14.406","0.003","94.492","0.003","102.639","0.003","113.064","0.003","741.8","0.2","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","N-(p-Methoxybenzoyl)-N'-o-tolylthiourea","","- C16 H16 N2 O2 S -","- C16 H16 N2 O2 S -","- C32 H32 N4 O4 S2 -","2","1","WK6026","M. Sukeri M. Yusof; Bohari M. Yamin","<i>N</i>-(4-Methoxybenzoyl)-<i>N</i>'-<i>o</i>-tolylthiourea","Acta Crystallographica Section E","2004","60","10","o1687","o1688","10.1107/S1600536804021373","","","0.71073","MoKα","","0.041","0.038","","","0.107","0.11","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204400","9.065","0.002","20.736","0.005","7.1111","0.0018","90","","102.166","0.002","90","","1306.7","0.5","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aquanitritobis(picolinato-κ^2^N,O)cobalt(III)","","- C12 H10 Co N3 O7 -","- C12 H10 Co N3 O7 -","- C48 H40 Co4 N12 O28 -","4","1","WK6029","Chen, Bai-Quan; Han, Lei; Xu, Ying; Wu, Ben-Lai; Hong, Mao-Chun","Aquanitritobis(picolinato-κ^2^<i>N</i>,<i>O</i>)cobalt(III)","Acta Crystallographica Section E","2004","60","10","m1376","m1378","10.1107/S1600536804021270","","","0.71073","MoKα","","0.0313","0.0295","","","0.0844","0.0864","","","","","","1.035","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204401","57.334","0.006","7.9101","0.0008","10.1991","0.001","90","","97.237","0.002","90","","4588.6","0.8","293","2","293","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","Barium indium nitride","","","- Ba19 In9 N9 -","- Ba19 In9 N9 -","- Ba76 In36 N36 -","4","0.5","WM6029","Yamane, Hisanori; Sasaki, Shinya; Kajiwara, Takashi; Takahiro Yamada; Shimada, Masahiko","Ba~19~In~9~N~9~, a subnitride containing isolated [In~5~]^5{-^} and [In~8~]^12{-^} Zintl anions","Acta Crystallographica Section E","2004","60","10","i120","i123","10.1107/S160053680402224X","","","0.71069","MoKα","","0.0603","0.0419","","","0.1015","0.1061","","","","","","0.952","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204402","13.292","0.004","7.529","0.002","17.213","0.005","90","","111.607","0.005","90","","1601.6","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-Chloro-N-(7-fluoro-3-oxo-4-(prop-2-ynyl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl)- 2,2-dimethylpropionamide","","- C16 H16 Cl F N2 O3 -","- C16 H16 Cl F N2 O3 -","- C64 H64 Cl4 F4 N8 O12 -","4","1","WN6255","Cao, De-Yong; Chen, Li-Gong; Song, Jian; Feng, Rong-Xiu; Lou, Ke-Xia","3-Chloro-<i>N</i>-[7-fluoro-3-oxo-4-(prop-2-ynyl)-3,4-dihydro-2<i>H</i>-1,4-benzoxazin-6-yl]-2,2-dimethylpropionamide","Acta Crystallographica Section E","2004","60","10","o1788","o1789","10.1107/S160053680402121X","","","0.71073","MoKα","","0.0555","0.0367","","","","0.1027","","","","","","1.029","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204403","8.2319","0.0005","22.757","0.0015","14.6764","0.0008","90","","90","","90","","2749.4","0.3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C16 H12 N2 O2 -","- C16 H12 N2 O2 -","- C128 H96 N16 O16 -","8","1","WN6271","Erdem, Talip Kaya; Atalay,Şehriman; Akdemir, Nesuhi; Aǧar, Erbil; Kantar, Cihan","4-(2-Methoxy-4-methylphenoxy)phthalonitrile","Acta Crystallographica Section E","2004","60","10","o1849","o1850","10.1107/S160053680401894X","","","0.71073","MoKα","","0.0641","0.0432","","","0.1077","0.1172","","","","","","0.905","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204404","11.193","0.003","6.4489","0.0019","14.427","0.004","90","","93.139","0.005","90","","1039.8","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2-Chloro-N-(5-chloro-4-fluoro-2-nitrophenyl)acetamide","","- C8 H5 Cl2 F N2 O3 -","- C8 H5 Cl2 F N2 O3 -","- C32 H20 Cl8 F4 N8 O12 -","4","1","WN6273","Zhang, Ying; Feng, Tian-Yang","2-Chloro-<i>N</i>-(5-chloro-4-fluoro-2-nitrophenyl)acetamide","Acta Crystallographica Section E","2004","60","10","o1717","o1718","10.1107/S1600536804021646","","","0.71073","MoKα","","0.0511","0.0348","","","0.0865","0.0952","","","","","","1.024","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204405","9.517","0.003","9.9163","0.0019","13.194","0.005","75.3","0.02","70.12","0.03","80.03","0.019","1127.5","0.6","296","","296","","","","","","","","","5","P -1","-P 1","2","","","","- C21 H17 Cl2 N3 O8 -","- C21 H17 Cl2 N3 O8 -","- C42 H34 Cl4 N6 O16 -","2","1","WN6274","Hiroyuki Ishida; Bilkish Rahman; Setsuo Kashino","3,5-Lutidinium‒2-chloro-4-nitrobenzoate‒2-chloro-4-nitrobenzoic acid (1/1/1)","Acta Crystallographica Section E","2004","60","10","o1661","o1663","10.1107/S1600536804021075","","","0.71073","MoKα","","0.158","0.059","","","0.135","0.167","","","","","","1.01","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204406","10.012","0.003","10.318","0.003","13.974","0.002","90","","110.767","0.015","90","","1349.8","0.6","300","","300","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H8 Cl N3 O4 -","- C13 H8 Cl N3 O4 -","- C52 H32 Cl4 N12 O16 -","4","1","WN6275","Hiroyuki Ishida; Takeo Fukunaga","3-Cyanopyridine‒2-chloro-4-nitrobenzoic acid (1/1)","Acta Crystallographica Section E","2004","60","10","o1664","o1665","10.1107/S1600536804021087","","","0.71073","MoKα","","0.122","0.051","","","0.099","0.119","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204407","16.25","0.003","10.0614","0.0015","20.021","0.003","90","","90","","90","","3273.4","0.9","298","2","298","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","Bis(ethylenediammonium) tris(pyridine-2,6-dicarboxylato-κ^3^O,O',N)cadmium(II) hexahydrate","","- C25 H41 Cd N7 O18 -","- C25 H41 Cd N7 O18 -","- C100 H164 Cd4 N28 O72 -","4","0.5","WN6276","Fu, Ai-Yun; Wang, Da-Qi; Liu, Ai-Zhen","Bis(ethylenediammonium) tris(pyridine-2,6-dicarboxylato-κ^3^<i>O,O</i>',<i>N</i>)cadmium(II) hexahydrate","Acta Crystallographica Section E","2004","60","10","m1372","m1373","10.1107/S1600536804021567","","","0.71073","MoKα","","0.0493","0.0277","","","0.0612","0.067","","","","","","0.952","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2204408","13.853","0.004","6.918","0.002","20.723","0.006","90","","99.855","0.005","90","","1956.7","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(4-formyl-3-methyl-1-phenyl-1H-pyrazol-5-yl) sulfide","","- C22 H18 N4 O2 S -","- C22 H18 N4 O2 S -","- C88 H72 N16 O8 S4 -","4","1","WN6277","Li-Min Yang; Hong-Qing Wang; Zhao-Jie Liu; Hai-Bin Song","Bis(4-formyl-3-methyl-1-phenyl-1<i>H</i>-pyrazol-5-yl) sulfide","Acta Crystallographica Section E","2004","60","10","o1898","o1899","10.1107/S1600536804024043","","","0.71073","MoKα","","0.0654","0.0406","","","0.0931","0.1033","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204409","15.239","0.002","7.85","0.001","15.846","0.003","90","","101","0.01","90","","1860.8","0.5","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 9-amino-7-(p-tolyl)-7H-pyrano[3,2-c]coumarin-8-carboxylate","","- C22 H19 N O5 -","- C22 H19 N O5 -","- C88 H76 N4 O20 -","4","1","WN6278","Jing Wang; Daqing Shi; Xiangshan Wang","Ethyl 2-amino-5-oxo-4-(<i>p</i>-tolyl)-4<i>H</i>,5<i>H</i>-pyrano[3,2-<i>c</i>]chromene-8-carboxylate","Acta Crystallographica Section E","2004","60","10","o1725","o1727","10.1107/S1600536804021841","","","0.71073","MoKα","","0.066","0.0397","","","0.0947","0.1012","","","","","","0.908","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204410","8.534","0.004","16.122","0.006","22.481","0.009","90","","90","","90","","3093","2","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-(3,5-dimethyl)phenyl-5-(4-ethyl)phenyl-1,3,4-oxadiazole","","- C18 H18 N2 O -","- C18 H18 N2 O -","- C144 H144 N16 O8 -","8","1","WN6279","Chun-Hui Mao; Qing-Min Wang; Run-Qiu Huang; Li Chen; Jian Shang; Hai-Bin Song","2-(3,5-Dimethylphenyl)-5-(4-ethylphenyl)-1,3,4-oxadiazole","Acta Crystallographica Section E","2004","60","10","o1823","o1825","10.1107/S1600536804022020","","","0.71073","MoKα","","0.126","0.0591","","","0.1225","0.148","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204411","12.92","0.002","11.411","0.002","7.448","0.001","90","","99.329","0.002","90","","1083.5","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-[Hydroxy(4-chlorophenyl)methyl]-cyclopent-2-en-1-one","2-[Hydroxy(4-chlorophenyl)methyl]-cyclopent-2-en-1-one","","- C12 H11 Cl O2 -","- C12 H11 Cl O2 -","- C48 H44 Cl4 O8 -","4","1","WN6280","Huo, Fangjun; Yin, Caixia; Yang, Pin","2-[(4-Chlorophenyl)hydroxymethyl]cyclopent-2-en-1-one","Acta Crystallographica Section E","2004","60","10","o1775","o1777","10.1107/S1600536804022597","","","0.71073","MoKα","","0.0632","0.0458","","","0.1143","0.122","","","","","","1.096","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204412","10.9898","0.0004","15.7406","0.0007","20.7781","0.0006","90","","90","","90","","3594.3","0.2","295","1","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C33 H48 Cl N O9 -","- C33 H48 Cl N O9 -","- C132 H192 Cl4 N4 O36 -","4","1","WN6281","Guo-Bin Zhou; Yong Ni; Peng-Fei Zhang; Yuan-Jiang Pan","4-Chloro-<i>N</i>-(2,3,4,6-tetra-<i>O</i>-pivaloyl-β-<small>D</small>-galactopyranosyl)benzylideneamine","Acta Crystallographica Section E","2004","60","10","o1905","o1906","10.1107/S1600536804023876","","","0.7107","MoKα","","","0.055","","","","0.134","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204413","11.427","0.001","12.042","0.001","12.992","0.002","77.87","0.01","67.73","0.01","81.02","0.01","1611.7","0.3","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","2,9b-cis-3,9b-trans-2,3-Bis(4-bromophenyl)-2,3,3a,4,5,9b,1',2',3',4'-decahydro- 1H-benzo[e]indene-1-spiro-2'-naphthalene-1',9b-diol acetone solvate","","- C37 H36 Br2 O3 -","- C37 H36 Br2 O3 -","- C74 H72 Br4 O6 -","2","1","WN6283","Daqing Shi; Chunling Shi; Xiangshan Wang; Liangce Rong; Hongwen Hu","2,9b-<i>trans</i>-3,9b-<i>cis</i>-2,3-Bis(4-bromophenyl)-2,3,3a,4,5,9b,1',2',3',4'-decahydro-1<i>H</i>-benzo[<i>e</i>]indene-1-spiro-2'-naphthalene-1',9b-diol acetone solvate","Acta Crystallographica Section E","2004","60","10","o1859","o1861","10.1107/S1600536804023268","","","0.71073","MoKα","","0.1195","0.0361","","","0.0403","0.045","","","","","","0.8","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204414","8.9725","0.0018","10.138","0.002","10.247","0.002","114.92","0.03","100.2","0.03","100.07","0.03","798.8","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","diacetatobis(3-hydroxypyridine)copper(II)","","- C14 H16 Cu N2 O6 -","- C14 H16 Cu N2 O6 -","- C28 H32 Cu2 N4 O12 -","2","1","WW6268","Gao, Shan; Lu, Zhen-Zhong; Huo, Li-Hua; Zhang, Xian-Fa; Zhao, Hui","A one-dimensional hydrogen-bonding chain of diacetatobis(3-hydroxypyridine)copper(II)","Acta Crystallographica Section E","2004","60","10","m1353","m1355","10.1107/S1600536804021154","","","0.71073","MoKα","","0.0514","0.0389","","","0.1015","0.1076","","","","","","1.059","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204415","11.4645","0.0011","9.8317","0.0009","8.3674","0.0008","90","","98.551","0.002","90","","932.65","0.15","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(4-dihydroxyborylphenyl)cyclobutanone","","- C10 H11 B O3 -","- C10 H11 B O3 -","- C40 H44 B4 O12 -","4","1","WW6276","Lo, Jem-Mau; Chen, Shyh-Ming; Chen, Mei-Hsun; Chen, Yu-Jen; Liao, Fen-Ling; Lu, Tian-Huey","3-(4-Dihydroxyborylphenyl)cyclobutanone","Acta Crystallographica Section E","2004","60","10","o1851","o1853","10.1107/S1600536804022366","","","0.71073","MoKα","","0.0662","0.0341","","","0.0856","0.1018","","","","","","0.955","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204416","15.975","0.005","9.654","0.003","14.566","0.004","90","","115.752","0.004","90","","2023.3","1.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-(4-Chlorophenyl)-1-phenyl-3-(p-toluenesulfonylamino)propan-1-one","","- C22 H20 Cl N O3 S -","- C22 H20 Cl N O3 S -","- C88 H80 Cl4 N4 O12 S4 -","4","1","WW6277","Yu, Zhi-Fang; Gu, Xiu-Yan; Zhao, Bing; Sun, Jian-Wei","3-(4-Chlorophenyl)-1-phenyl-3-(<i>p</i>-tolylsulfonylamino)propan-1-one","Acta Crystallographica Section E","2004","60","10","o1728","o1729","10.1107/S1600536804021907","","","0.71073","MoKα","","0.0997","0.049","","","0.1187","0.1482","","","","","","1.058","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204417","13.046","0.005","14.242","0.006","16.289","0.007","90","","95.01","0.04","90","","3015","2","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Dichloro{1-[2-(diphenylphosphino-κP)ethyl]-1,3-dihydro-3-(2,4,6- trimethylphenyl)-2H-imidazol-2-ylidene-κC}palladium(II) diethyl ether solvate","","- C30 H37 Cl2 N2 O P Pd -","- C30 H37 Cl2 N2 O P Pd -","- C120 H148 Cl8 N8 O4 P4 Pd4 -","4","1","WW6283","Lee, Hon Man; Chiu, Pei Ling","Dichloro{1-[2-(diphenylphosphino-κ<i>P</i>)ethyl]-1,3-dihydro-3-(2,4,6-trimethylphenyl)-2<i>H</i>-imidazol-2-ylidene-κ<i>C</i>}palladium(II) diethyl ether solvate","Acta Crystallographica Section E","2004","60","10","m1473","m1474","10.1107/S1600536804023086","","","0.71073","MoKα","","0.0485","0.0312","","","0.0704","0.0803","","","","","","1.009","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204418","12.65","0.003","15.488","0.003","8.772","0.002","90","","90","","90","","1718.6","0.7","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","3,3-Dibenzylbenzo[b]furan-2(3H)-one","","- C22 H18 O2 -","- C22 H18 O2 -","- C88 H72 O8 -","4","0.5","WW6287","Wang, Hai-Bo; Chen, Jia-Hui; Wang, Jin-Tang","3,3-Dibenzylbenzo[<i>b</i>]furan-2(3<i>H</i>)-one","Acta Crystallographica Section E","2004","60","10","o1842","o1843","10.1107/S1600536804022846","","","0.71073","MoKα","","0.0933","0.0455","","","0.1286","0.1583","","","","","","0.979","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204419","8.9688","0.0005","10.9081","0.0004","19.8159","0.0011","90","","100.841","0.004","90","","1904.04","0.17","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(5-Benzoyl-2-oxo-4-phenyl-1,2-dihydropyrimidin-1-yl)benzamide","","- C24 H17 N3 O3 -","- C24 H17 N3 O3 -","- C96 H68 N12 O12 -","4","1","WW6292","Mehmet Akkurt; Sema Öztürk; Zülbiye Önal; Behzat Altural; Orhan Büyükgüngör","<i>N</i>-(5-Benzoyl-2-oxo-4-phenyl-1,2-dihydropyrimidin-1-yl)benzamide","Acta Crystallographica Section E","2004","60","10","o1844","o1846","10.1107/S1600536804023050","","","0.71073","MoKα","","0.0452","0.0322","","","0.0808","0.0846","","","","","","1.02","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204420","9.212","0.006","7.349","0.002","15.045","0.004","90","","98.52","0.03","90","","1007.3","0.8","301","","301","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H20 Cl2 N2 O6 -","- C18 H20 Cl2 N2 O6 -","- C36 H40 Cl4 N4 O12 -","2","0.5","WW6295","Hiroyuki Ishida","Bis(3-picolinium) chloranilate dihydrate","Acta Crystallographica Section E","2004","60","10","o1900","o1901","10.1107/S1600536804023256","","","0.71073","MoKα","","0.081","0.038","","","0.09","0.104","","","","","","1","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204421","11.3602","0.0004","13.7513","0.0008","16.4755","0.001","104.026","0.001","99.319","0.001","100.192","0.003","2400.4","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(2,2'-bipyridine)-1κ^2^N:N';3κ^2^N:N'-tris(μ-α-methylacrylato- 1:2κ^2^O:O')tris(μ-α-methylacrylato-2:3κ^2^O:O')(nitrato- 2κ^2^O:O')dizinc(II)praseodymium(III)","","- C44 H46 N5 O15 Pr Zn2 -","- C44 H46 N5 O15 Pr Zn2 -","- C88 H92 N10 O30 Pr2 Zn4 -","2","1","YA6221","Yue Zhu; Weimin Lu; Fang Chen","Bis(2,2'-bipyridine)-1κ^2^<i>N</i>:<i>N</i>';3κ^2^<i>N</i>:<i>N</i>'-tris(μ-α-methylacrylato-1:2κ^2^<i>O</i>:<i>O</i>')tris(μ-α-methylacrylato-2:3κ^2^<i>O</i>:<i>O</i>')(nitrato-2κ^2^<i>O</i>:<i>O</i>')dizinc(II)praseodymium(III)","Acta Crystallographica Section E","2004","60","10","m1459","m1461","10.1107/S1600536804022779","","","0.71073","MoKα","","0.0367","0.0286","","","0.081","0.0898","","","","","","1.169","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204422","13.438","0.003","3.9893","0.0009","27.727","0.006","90","","99.508","0.004","90","","1466","0.6","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","N-(2-Chlorophenyl)-N-(4-methoxybenzoyl)thiourea","","- C15 H13 Cl N2 O2 S -","- C15 H13 Cl N2 O2 S -","- C60 H52 Cl4 N8 O8 S4 -","4","1","AC6114","M. Sukeri M. Yusof; Bohari M. Yamin","<i>N</i>-(2-Chlorophenyl)-<i>N</i>'-(4-methoxybenzoyl)thiourea","Acta Crystallographica Section E","2004","60","11","o1998","o1999","10.1107/S1600536804024985","","","0.71073","MoKα","","0.074","0.059","","","0.133","0.14","","","","","","1.19","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204423","11.0517","0.0005","9.3304","0.0004","15.6876","0.0009","90","","116.832","0.001","90","","1443.49","0.12","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(9H-fluoren-9-ylidene)-N-(-2-methoxyphenyl)amine","","- C20 H15 N O -","- C20 H15 N O -","- C80 H60 N4 O4 -","4","1","AC6121","Glagovich, Neil M.; Reed, Elizabeth M.; Crundwell, Guy; Updegraff, James B. III; Zeller, Matthias; Hunter, Allen D.","<i>N</i>-(9<i>H</i>-Fluoren-9-ylidene)-<i>N</i>-(-2-methoxyphenyl)amine","Acta Crystallographica Section E","2004","60","11","o2000","o2001","10.1107/S1600536804024018","","","0.71073","MoKα","","0.0535","0.0511","","","0.1365","0.1386","","","","","","1.085","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204424","11.943","0.004","11.944","0.005","9.102","0.003","89.81","0.03","91.89","0.03","75.43","0.03","1255.9","0.8","298","1","","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H28 Cu N2 O2 -","- C30 H28 Cu N2 O2 -","- C60 H56 Cu2 N4 O4 -","2","1","AC6123","Akitsu, Takashiro; Einaga, Yasuaki","Bis[2-(phenethyliminomethyl)phenolato-κ^2^N,O]copper(II)","Acta Crystallographica, Section E: Structure Reports Online","2004","60","11","m1555","m1557","10.1107/S1600536804023736","","","0.7107","MoKα","","","0.0333","","","","0.1041","","","","","","1.01","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2204425","7.4772","0.0001","21.9462","0.0004","6.7828","0.0001","90","","102.491","0.001","90","","1086.69","0.03","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-(p-Nitrophenoxy)terahydropyran","2-(p-Nitrophenoxy)terahydropyran","","- C11 H13 N O4 -","- C11 H13 N O4 -","- C44 H52 N4 O16 -","4","1","AC6124","Chopra, Reenu; Ning Shan; Motherwell, W. D. Sam; Jones, William","2-(<i>p</i>-Nitrophenoxy)tetrahydropyran","Acta Crystallographica Section E","2004","60","11","o1923","o1924","10.1107/S1600536804023748","","","0.71069","MoKα","","0.0587","0.0422","","","0.1099","0.1208","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204426","8.7227","0.0013","5.8099","0.0009","18.074","0.003","90","","103.203","0.006","90","","891.7","0.2","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","2-(4-Bromobenzyl)-1,3-diphenylpropane-1,3-dione","","- C22 H17 Br O2 -","- C22 H17 Br O2 -","- C44 H34 Br2 O4 -","2","1","AC6125","Karban, James W.; Aparicio, Michael K.; Palacios, Rene R.; Richardson, Kyle A.; Klausmeyer, Kevin K.","2-(4-Bromobenzyl)-1,3-diphenylpropane-1,3-dione","Acta Crystallographica Section E","2004","60","11","o2043","o2044","10.1107/S1600536804026200","","","0.71073","MoKα","","0.0372","0.0306","","","0.0823","0.085","","","","","","1.094","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204427","11.829","0.009","4.482","0.003","27.91","0.01","90","","91.5","0.05","90","","1479.2","1.6","298","2","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H18 N2 O2 -","- C18 H18 N2 O2 -","- C72 H72 N8 O8 -","4","0.5","AC6126","Luis Nunez; Jesse D. Brown; Adam M. Donnelly; Christine R. Whitlock; Allison J. Dobson","1,4-Dibenzylpiperazine-2,5-dione","Acta Crystallographica Section E","2004","60","11","o2076","o2078","10.1107/S1600536804026194","","","0.7107","MoKα","","","0.067","","","","0.094","","","","","","1.168","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204428","10.5117","0.0007","13.5401","0.0009","7.4285","0.0005","90","","103.197","0.001","90","","1029.37","0.12","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","9-Nitroanthracene","9-Nitroanthracene","","- C14 H9 N O2 -","- C14 H9 N O2 -","- C56 H36 N4 O8 -","4","1","AC6129","Glagovich, Neil M.; Foss, Paul C. D.; Michalewski, Oliver; Reed, Elizabeth M.; Strathearn, Katherine E.; Weiner, Yan F.; Crundwell, Guy; Updegraff, III, James B.; Zeller, Matthias; Hunter, Allen D.","Redetermination of 9-nitroanthracene at 100K","Acta Crystallographica Section E","2004","60","11","o2125","o2126","10.1107/S1600536804025267","","","0.71073","MoKα","","0.0514","0.0455","","","0.1422","0.1483","","","","","","1.282","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204429","6.5738","0.0006","8.0973","0.0009","9.619","0.0006","104.843","0.007","107.936","0.006","101.842","0.009","447.85","0.08","293","2","293","2","","","","","","","","3","P -1","-P 1","2","Iron (II, III) arsenate","Triiron(II) tetrairon (III) hexakisorthoarsenate(V)","","- As6 Fe7 O24 -","- As6 Fe7 O24 -","- As6 Fe7 O24 -","1","0.5","BR6166","Weil, Matthias","Fe^II^~3~Fe^III^~4~(AsO~4~)~6~, the first arsenate adopting the Fe~7~(PO~4~)~6~ structure type","Acta Crystallographica, Section E","2004","60","11","i139","i141","10.1107/S1600536804026182","","","0.71073","MoKα","","0.0239","0.0205","","","0.0475","0.0483","","","","","","1.158","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2204430","10.644","0.002","10.415","0.002","13.736","0.003","90","","91.07","0.03","90","","1522.5","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[(1,10-phenanthroline-κ^2^N,N')cadmium(II)]-μ- imidazole-4,5-dicarboxylato-κ^4^N,O:N,O']","","- C17 H10 Cd N4 O4 -","- C17 H10 Cd N4 O4 -","- C68 H40 Cd4 N16 O16 -","4","1","BR6167","Gao, Shan; Gu, Chang-Sheng; Huo, Li-Hua; Zhao, Hui; Zhao, Jing-Gui","<i>catena</i>-Poly[[(1,10-phenanthroline-κ^2^<i>N,N</i>')cadmium(II)]-μ-imidazole-4,5-dicarboxylato-κ^4^<i>N,O:N,O</i>']","Acta Crystallographica Section E","2004","60","11","m1672","m1674","10.1107/S1600536804026297","","","0.71073","MoKα","","0.0221","0.0199","","","0.0511","0.0518","","","","","","1.043","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204431","9.7563","0.0013","7.71","0.001","22.81","0.003","90","","102.348","0.004","90","","1676.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 4-oxo-r-2,c-6-diphenylpiperidine-3-carboxylate","","- C19 H19 N O3 -","- C19 H19 N O3 -","- C76 H76 N4 O12 -","4","1","BT6517","N. Sampath; S. Aravindhan; M. N. Ponnuswamy; M. Nethaji","Methyl 4-oxo-<i>r</i>-2,<i>c</i>-6-diphenylpiperidine-3-carboxylate","Acta Crystallographica Section E","2004","60","11","o2105","o2106","10.1107/S1600536804026224","","","0.71073","MoKα","","0.0548","0.0448","","","0.1279","0.1362","","","","","","1.054","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204432","26.006","0.003","7.3714","0.0006","10.7541","0.0012","90","","106.416","0.008","90","","1977.5","0.4","293","2","296","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Bis(acetylsalicylato-κ^2^O,O')diaquacadmium(II)","bis[2-(acetyloxy)benzoato-κ^2^O,O']diaquacadmium(II)","","- C18 H18 Cd O10 -","- C18 H18 Cd O10 -","- C72 H72 Cd4 O40 -","4","0.5","BT6519","Vásquez-Árciga, Horacio; Pérez-Benítez, Aarón; Álvarez-Hernández, Alejandro; Bernès, Sylvain; Méndez-Rojas, Miguel Angel","Bis(acetylsalicylato-κ^2^<i>O,O</i>')diaquacadmium(II)","Acta Crystallographica Section E","2004","60","11","m1621","m1623","10.1107/S1600536804024717","","","0.71073","MoKα","","0.0218","0.0203","","","0.0544","0.0552","","","","","","1.108","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204433","9.115","0.003","9.271","0.003","11.248","0.003","92","0.02","105.09","0.02","118.82","0.02","789.5","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4-methyl-1-(3-nitrophenacyl)-5,6,7,8-tetrahydroquinolin-2(1H)-one","","- C18 H18 N2 O4 -","- C18 H18 N2 O4 -","- C36 H36 N4 O8 -","2","1","BT6531","Dmitry V. Albov; Victor B. Rybakov; Eugene V. Babaev; Leonid A. Aslanov","4-Methyl-1-(3-nitrophenacyl)-5,6,7,8-tetrahydroquinolin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2004","60","11","o1952","o1953","10.1107/S1600536804024468","","","0.71073","MoKα","","0.1028","0.0495","","","0.1181","0.1288","","","","","","1.062","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204434","11.7771","0.0008","22.6876","0.0012","11.7725","0.0009","90","","116.822","0.005","90","","2807.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(1,3-Benzothiazol-2-yl)-4-(dimethylamino)benzylamine","","- C16 H15 N3 S -","- C16 H15 N3 S -","- C128 H120 N24 S8 -","8","2","BT6532","Hanife Saraçoĝlu; Orhan Büyükgüngör; Ceyda Davran; Serkan Soylu; Hümeyra Batı; Nezihe Çalıs̨kan","<i>N</i>-(1,3-Benzothiazol-2-yl)-4-(dimethylamino)benzylamine","Acta Crystallographica Section E","2004","60","11","o2090","o2092","10.1107/S1600536804026236","","","0.71073","MoKα","","0.0758","0.0354","","","0.068","0.0756","","","","","","0.812","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204435","5.948","0.0003","7.501","0.0004","17.3197","0.001","90","","92.751","0.001","90","","771.84","0.07","213","2","213","2","","","","","","","","4","P 1 21 1","P 2yb","4","","[(1-Phenylethyl)iminomethyl]ferrocene","","- C19 H19 Fe N -","- C19 H19 Fe N -","- C38 H38 Fe2 N2 -","2","1","BT6533","Hecht, Elmar","[(1-Phenylethyl)iminomethyl]ferrocene","Acta Crystallographica Section E","2004","60","11","m1593","m1594","10.1107/S1600536804024754","","","0.71073","MoKα","","0.0319","0.0276","","","0.0739","0.0842","","","","","","1.115","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204436","8.7031","0.0008","10.3718","0.001","11.5289","0.0011","116.715","0.002","92.739","0.002","91.216","0.002","927.46","0.15","160","2","160","2","","","","","","","","4","P -1","-P 1","2","","Bis[μ-2-(phenylamido)pyridine]bis{[2-(phenylamino)pyridine]lithium(I)}","","- C44 H38 Li2 N8 -","- C44 H38 Li2 N8 -","- C44 H38 Li2 N8 -","1","0.5","BT6534","Clegg, William; Liddle, Stephen T.","Bis[μ-2-(phenylamido)pyridine]bis{[2-(phenylamino)pyridine]lithium(I)}","Acta Crystallographica Section E","2004","60","11","m1587","m1589","10.1107/S1600536804024766","","","0.71073","MoKα","","0.0607","0.0404","","","0.0956","0.1019","","","","","","0.923","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204437","9.65","0.0003","9.674","0.0002","13.641","0.0004","90","","104.968","0.0014","90","","1230.24","0.06","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(η^5^-cyclopentadienyl)bis(thiocyanato-κN)vanadium(IV)","","- C12 H10 N2 S2 V -","- C12 H10 N2 S2 V -","- C48 H40 N8 S8 V4 -","4","1","BT6535","Honzíček, Jan; Erben, Milan; Císařová, Ivana; Vinklárek, Jaromír","Bis(η^5^-cyclopentadienyl)bis(thiocyanato-κ<i>N</i>)vanadium(IV)","Acta Crystallographica Section E","2004","60","11","m1617","m1618","10.1107/S160053680402519X","","","0.71073","MoKα","","0.0363","0.0291","","","0.0615","0.0644","","","","","","1.077","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204438","11.12","0.002","10.529","0.002","16.253","0.003","90","","90","","90","","1902.9","0.6","295","2","295","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","5-aminonaphthalene-2-sulfonic acid","5-ammonio-2-naphthalenesulfonate","","- C10 H9 N O3 S -","- C10 H9 N O3 S -","- C80 H72 N8 O24 S8 -","8","1","BT6536","Graham Smith; Urs D. Wermuth; David J. Young; Jonathan M. White","Zwitterionic 5-amino-2-naphthalenesulfonic acid","Acta Crystallographica Section E","2004","60","11","o2014","o2016","10.1107/S1600536804025206","","","1.5418","CuKα","","0.0417","0.0392","","","0.1026","0.1046","","","","","","1.063","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204439","13.6004","0.0003","8.7668","0.0002","23.544","0.0005","90","","98.493","0.001","90","","2776.41","0.11","180","2","180","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-Methyl-N-(2-pyridiniomethyl)-2-[N-(2-pyridiniomethyl)methylamino]- N-(2-pyridylmethyl)ethanaminium tris(perchlorate)","","- C22 H30 Cl3 N5 O12 -","- C22 H30 Cl3 N5 O12 -","- C88 H120 Cl12 N20 O48 -","4","1","BT6537","Rompel, Annette; Bond, Andrew D.; McKenzie, Christine J.","<i>N</i>-Methyl-<i>N</i>-(2-pyridiniomethyl)-2-[<i>N</i>-(2-pyridiniomethyl)methylamino]-<i>N</i>-(2-pyridylmethyl)ethanaminium tris(perchlorate)","Acta Crystallographica Section E","2004","60","11","o1987","o1988","10.1107/S1600536804025103","","","0.71073","MoKα","","0.07","0.056","","","0.1446","0.1539","","","","","","1.055","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204440","28.4989","0.0007","9.3347","0.0002","22.7954","0.0005","90","","132.401","0.0008","90","","4478.09","0.18","295","1","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[[bis(1,10-phenanthroline)samarium]-di-μ- 2-hydroxybenzoato-sodium-di-μ-2-hydroxybenzoato]","","- C52 H36 N4 Na O12 Sm -","- C52 H36 N4 Na O12 Sm -","- C208 H144 N16 Na4 O48 Sm4 -","4","0.5","BT6538","Cun-Jin Xu; Hui Yang; Fei Xie; Xing-zhong Guo","<i>catena</i>-Poly[[bis(1,10-phenanthroline)samarium]-di-μ-2-hydroxybenzoato-sodium-di-μ-2-hydroxybenzoato]","Acta Crystallographica Section E","2004","60","11","m1627","m1629","10.1107/S1600536804025346","","","0.7107","MoKα","","","0.021","","","","0.045","","","","","","1.007","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204441","8.8523","0.0006","17.8849","0.001","9.9601","0.0007","90","","99.55","0.008","90","","1555.05","0.18","170","2","170","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Silver(I)bromide-4-methylpyridine","catena-Poly[[(4-methylpyridine-κN)silver(I)]-μ~3~bromo]","","- C6 H7 Ag Br N -","- C6 H7 Ag Br N -","- C48 H56 Ag8 Br8 N8 -","8","2","BT6539","Näther, Christian; Beck, Andreas","Redetermination of <i>catena</i>-Poly[[(4-methylpyridine-κ<i>N</i>)silver(I)]-μ~3~-bromo]","Acta Crystallographica Section E","2004","60","11","m1608","m1610","10.1107/S1600536804025139","","","0.71073","MoKα","","0.0641","0.0318","","","0.0676","0.0783","","","","","","0.925","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204442","16.7315","0.0014","7.037","0.0006","11.708","0.001","90","","107.979","0.002","90","","1311.18","0.19","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(Isobutyryloxy)propanaminium bromide","","- C10 H22 Br N O2 -","- C10 H22 Br N O2 -","- C40 H88 Br4 N4 O8 -","4","1","BT6540","Flörke, Ulrich; Röder, Thorsten; Kramer, Thomas","3-(Isobutyryloxy)propanaminium bromide","Acta Crystallographica Section E","2004","60","11","o2007","o2008","10.1107/S1600536804025449","","","0.71073","MoKα","","0.0418","0.0259","","","0.0477","0.0494","","","","","","0.844","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204443","12.0496","0.0008","7.0295","0.0005","19.8296","0.0013","90","","100.856","0.001","90","","1649.56","0.19","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4'-methoxy-4-methoxycarbonyl-2,6-dinitrostilbene","methyl 4-(4-methoxybenzylidenemethyl)-3,5-dinitrobenzoate","","- C17 H14 N2 O7 -","- C17 H14 N2 O7 -","- C68 H56 N8 O28 -","4","1","BT6541","P. G. Aravindan; S. Selvanayagam; D. Velmurugan; K. Ravikumar; S. Saravanan; P. C. Srinivasan","Methyl 4-(4-methoxybenzylidenemethyl)-3,5-dinitrobenzoate","Acta Crystallographica Section E","2004","60","11","o2053","o2055","10.1107/S1600536804025875","","","0.71073","MoKα","","0.0626","0.0463","","","0.1326","0.1451","","","","","","1.02","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204444","12.369","0.0008","8.305","0.0006","13.9204","0.0009","90","","115.013","0.001","90","","1295.85","0.15","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","trans-Dichlorobis[pyrimidine-2(1H)-thione-κN^1^]cobalt(II)","","- C8 H8 Cl2 Co N4 S2 -","- C8 H8 Cl2 Co N4 S2 -","- C32 H32 Cl8 Co4 N16 S8 -","4","0.5","BT6542","Shi, Wen-Juan; Li, Dan; Ng, Seik Weng","<i>trans</i>-Dichlorobis[pyrimidine-2(1<i>H</i>)-thione-κ<i>N</i>]cobalt(II)","Acta Crystallographica Section E","2004","60","11","m1664","m1665","10.1107/S1600536804025887","","","0.71073","MoKα","","0.028","0.026","","","0.069","0.071","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204445","14.6795","0.001","14.6795","0.001","7.5114","0.0004","90","","90","","120","","1401.76","0.15","170","2","170","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","Chlorotris(3-methylpyridine-κN)silver(I)","","- C18 H21 Ag Cl N3 -","- C18 H21 Ag Cl N3 -","- C54 H63 Ag3 Cl3 N9 -","3","0.166667","BT6543","Näther, Christian; Beck, Andreas","Chlorotris(3-methylpyridine-κ<i>N</i>)silver(I)","Acta Crystallographica Section E","2004","60","11","m1678","m1680","10.1107/S1600536804026121","","","0.71073","MoKα","","0.0295","0.0285","","","0.0676","0.0683","","","","","","1.089","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204446","8.6832","0.0007","9.4024","0.0008","10.7392","0.0009","81.761","0.007","73.297","0.007","69.777","0.006","787.07","0.12","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","4-(3-Bromobenzylideneamino)-3-(4-chlorobenzyl)-4,5-dihydro-1H-1,2,4-triazol- 5-one","","- C16 H12 Br Cl N4 O -","- C16 H12 Br Cl N4 O -","- C32 H24 Br2 Cl2 N8 O2 -","2","1","BT6544","Atalay,Şehriman; Yavuz, Metin; Kahveci, Bahittin; Ağar, Erbil; Şaşmaz, Selami","4-(3-Bromobenzylideneamino)-3-(4-chlorobenzyl)-4,5-dihydro-1<i>H</i>-1,2,4-triazol-5-one","Acta Crystallographica Section E","2004","60","11","o2119","o2121","10.1107/S1600536804026601","","","0.71073","MoKα","","0.0435","0.0317","","","0.0733","0.0765","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204447","8.5598","0.0006","9.6111","0.0005","17.9319","0.0009","90","","100.364","0.004","90","","1451.17","0.15","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-Amino-4-(methylsulfanyl)-2-oxo-1-tolyl-1,2-dihydropyridine-3,5-dicarbonitrile","","- C15 H12 N4 O S -","- C15 H12 N4 O S -","- C60 H48 N16 O4 S4 -","4","1","BT6546","Elgemeie, Galal H.; Jones, Peter G.","6-Amino-4-(methylsulfanyl)-2-oxo-1-tolyl-1,2-dihydropyridine-3,5-dicarbonitrile","Acta Crystallographica Section E","2004","60","11","o2107","o2109","10.1107/S1600536804026285","","","0.71073","MoKα","","0.0418","0.0328","","","0.0856","0.089","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204448","9.5358","0.0007","10.711","0.0008","12.2233","0.0009","65.862","0.001","68.36","0.001","80.33","0.001","1058.79","0.14","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","[4'-(4-Pyridyl)-2,2':6',2''-terpyridine-κ^3^N,N',N'']dithiocyanatozinc(II)","","- C22 H14 N6 S2 Zn -","- C22 H14 N6 S2 Zn -","- C44 H28 N12 S4 Zn2 -","2","1","BT6548","Lei, Hou; Li, Dan; Ng, Seik Weng","[4'-(4-Pyridyl)-2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']dithiocyanatozinc(II)","Acta Crystallographica Section E","2004","60","11","m1734","m1735","10.1107/S1600536804026595","","","0.71073","MoKα","","0.05","0.041","","","0.105","0.11","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204449","16.5624","0.0012","5.629","0.0003","16.3266","0.0014","90","","112.61","0.004","90","","1405.14","0.18","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-(4-Ethoxybenzyl)indan","","- C18 H20 O -","- C18 H20 O -","- C72 H80 O4 -","4","1","BT6549","Turner, Alan B.; Harrison, William T. A.","2-(4-Ethoxybenzyl)indan","Acta Crystallographica Section E","2004","60","11","o2138","o2139","10.1107/S1600536804026492","","","0.71073","MoKα","","0.1967","0.0891","","","0.1656","0.2107","","","","","","1.018","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204450","10.1017","0.0011","10.276","0.0012","20.187","0.002","90","","95.278","0.002","90","","2086.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","8a,13b-cis-8,8,13-Trimethyl-11-phenyl-8,8a,9,13b- tetrahydropyrazolo[3'',4''-b']thiapyrano[5',4':3,4]pyrano[5,6-c]coumarin","","- C25 H22 N2 O3 S -","- C25 H22 N2 O3 S -","- C100 H88 N8 O12 S4 -","4","1","BT6550","S. Selvanayagam; D. Velmurugan; K. Ravikumar; S. Narasinga Rao; J. Jayashankaran; R. Rathna Durga; R. Raghunathan","8a,13b-<i>cis</i>-8,8,13-Trimethyl-11-phenyl-8,8a,9,13b-tetrahydropyrazolo[3'',4''-<i>b</i>']thiapyrano[5',4':3,4]pyrano[5,6-<i>c</i>]coumarin","Acta Crystallographica Section E","2004","60","11","o2155","o2156","10.1107/S1600536804026674","","","0.71073","MoKα","","0.1141","0.0838","","","0.1794","0.1944","","","","","","1.157","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204451","13.0966","0.0012","8.6225","0.0008","15.7306","0.0014","90","","100.045","0.001","90","","1749.2","0.3","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","3'-(2-Chlorophenyl)-1'-methyl-4'nitrospiro[indan-2, 2'-pyrrolidine]-1,3-dione","","- C19 H15 Cl N2 O4 -","- C19 H15 Cl N2 O4 -","- C76 H60 Cl4 N8 O16 -","4","1","BT6551","S. Selvanayagam; D. Velmurugan; K. Ravikumar; S. Narasinga Rao; M. Poornachandran; R. Raghunathan","3'-(2-Chlorophenyl)-1'-methyl-4'nitrospiro[indan-2,2'-pyrrolidine]-1,3-dione","Acta Crystallographica Section E","2004","60","11","o2157","o2159","10.1107/S1600536804026686","","","0.71073","MoKα","","0.0427","0.0405","","","0.1006","0.1023","","","","","","1.015","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204452","6.8598","0.0006","10.3438","0.0009","21.1315","0.0018","90","","95.718","0.002","90","","1492","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 N2 O4 S -","- C16 H12 N2 O4 S -","- C64 H48 N8 O16 S4 -","4","1","BV6003","Xian-Zhong Sun; Ming-Hua Zeng; Bao-Hui Ye","Linear chains in the 1:1 complex of thiophene-2,5-dicarboxylic acid and 4,4'-bipyridine","Acta Crystallographica Section E","2004","60","11","o2103","o2104","10.1107/S160053680402639X","","","0.71073","MoKα","","0.0673","0.0549","","","0.1365","0.1448","","","","","","1.065","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204453","5.0974","0.001","22.414","0.005","6.5617","0.0013","90","","111.87","0.03","90","","695.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diaquabis(5-carboxy-1H-imidazole-4-carboxylato-κ^2^N^3^,O^4^)zinc(II)","","- C10 H10 N4 O10 Zn -","- C10 H10 N4 O10 Zn -","- C20 H20 N8 O20 Zn2 -","2","0.5","BV6004","Liu, Ji-Wei; Gao, Shan; Huo, Li-Hua; Gu, Chang-Sheng; Zhao, Hui; Zhao, Jing-Gui","Diaquabis(5-carboxy-1<i>H</i>-imidazole-4-carboxylato-κ^2^<i>N</i>^3^,<i>O</i>^4^)zinc(II)","Acta Crystallographica Section E","2004","60","11","m1697","m1699","10.1107/S1600536804026388","","","0.71073","MoKα","","0.026","0.0229","","","0.0623","0.0638","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204454","6.1269","0.0002","14.6159","0.0005","12.6541","0.0004","90","","103.228","0.002","90","","1103.11","0.06","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Chlorobenzoic acid N,N-dimethylformamide solvate","","- C10 H12 Cl N O3 -","- C10 H12 Cl N O3 -","- C40 H48 Cl4 N4 O12 -","4","1","CF6379","Xu, Xuelian; Kennedy, Alan R.; Florence, Alastair J.; Shankland, Norman","4-Chlorobenzoic acid <i>N,N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2004","60","11","o1950","o1951","10.1107/S1600536804024511","","","0.71073","MoKα","","0.0462","0.0346","","","0.0809","0.0864","","","","","","1.018","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204455","7.542","0.002","21.22","0.005","9.478","0.002","90","","95.836","0.004","90","","1509","0.6","295","2","295","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","catena-Poly[bis[aqua(1,10-phenanthroline)cobalt(II)]-μ~4~-1,2,4,5- benzenetetracarboxylato]","","- C34 H22 Co2 N4 O10 -","- C34 H22 Co2 N4 O10 -","- C68 H44 Co4 N8 O20 -","2","0.5","CF6381","Fu, Yun-Long; Ren, Jia-Lin; Ng, Seik Weng","<i>catena</i>-Poly[bis[aqua(1,10-phenanthroline)cobalt(II)]-μ~4~-1,2,4,5-benzenetetracarboxylato]","Acta Crystallographica Section E","2004","60","11","m1716","m1718","10.1107/S1600536804026765","","","0.71073","MoKα","","0.1071","0.0739","","","0.1757","0.1946","","","","","","1.081","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204456","12.0231","0.0012","14.269","0.003","14.559","0.003","90","","90","","90","","2497.7","0.8","296","2","296","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","Tris(ethylenediamine-κ^2^N,N')zinc(II) bis[2,3-dimercaptobutenedinitrile(2-)-κ^2^S,S']zincate(II)","","- C14 H24 N10 S4 Zn2 -","- C14 H24 N10 S4 Zn2 -","- C56 H96 N40 S16 Zn8 -","4","0.5","CF6385","Fu, Ai-Yun; Wang, Da-Qi; Yu, Tao","Tris(ethylenediamine-κ^2^<i>N,N</i>')zinc(II) bis[2,3-dimercaptobutenedinitrile(2‒)-κ^2^<i>S,S</i>']zincate(II)","Acta Crystallographica Section E","2004","60","11","m1736","m1737","10.1107/S160053680402714X","","","0.71073","MoKα","","0.0969","0.0541","","","0.1257","0.1381","","","","","","0.999","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204457","15.597","0.009","5.509","0.004","12.648","0.007","90","","95.06","0.02","90","","1082.5","1.2","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","Diaquabis(3-hydroxynaphthalene-2-carboxylato-κO)zinc(II)","","- C22 H18 O8 Zn -","- C22 H18 O8 Zn -","- C44 H36 O16 Zn2 -","2","0.5","CI6447","Deng, Bing; Liu, Zhao-Di; Liu, Xiu-Ying; Tan, Min-Yu; Zhu, Hai-Liang","Diaquabis(3-hydroxynaphthalene-2-carboxylato-κ<i>O</i>)zinc(II)","Acta Crystallographica Section E","2004","60","11","m1568","m1569","10.1107/S1600536804023669","","","0.71073","MoKα","","0.084","0.0569","","","0.1399","0.1577","","","","","","1.016","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204458","4.9184","0.0008","23.655","0.004","10.6092","0.0017","90","","101.556","0.003","90","","1209.3","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2'-(2-Fluorobenzylidene)-2-hydroxybenzohydrazide","","- C14 H11 F N2 O2 -","- C14 H11 F N2 O2 -","- C56 H44 F4 N8 O8 -","4","1","CI6453","Jian-Guo Yang; Fu-You Pan","2'-(2-Fluorobenzylidene)-2-hydroxybenzohydrazide","Acta Crystallographica Section E","2004","60","11","o2009","o2010","10.1107/S1600536804024614","","","0.71073","MoKα","","0.0667","0.0536","","","0.1329","0.1422","","","","","","1.007","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204459","8.781","0.002","8.845","0.002","10.171","0.002","90","","101.34","0.03","90","","774.5","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(2-aminomethylpyridine-κ^2^N,N')dinitratoiron(II)","","- C12 H16 Fe N6 O6 -","- C12 H16 Fe N6 O6 -","- C24 H32 Fe2 N12 O12 -","2","0.5","CI6455","Chen, Guang; Yu-Xi Sun; Min Sun; Wei Qi","Bis[2-(aminomethyl)pyridine-κ^2^<i>N</i>,<i>N</i>']dinitratoiron(II)","Acta Crystallographica Section E","2004","60","11","m1547","m1549","10.1107/S1600536804024183","","","0.71073","MoKα","","0.1295","0.0774","","","0.1565","0.1792","","","","","","0.952","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204460","30.614","0.006","8.4578","0.0017","7.7462","0.0015","90","","90","","90","","2005.7","0.7","273","2","273","2","","","","","","","","5","C m c 21","C 2c -2","36","","[N,N'-Bis(2-oxido-1-naphthylmethylene)propane-1,3-diamine]copper(II)","","- C25 H20 Cu N2 O2 -","- C25 H20 Cu N2 O2 -","- C100 H80 Cu4 N8 O8 -","4","0.5","CI6456","Chen, Guang","[<i>N</i>,<i>N</i>'-Bis(2-oxido-1-naphthylmethylene)propane-1,3-diamine]copper(II)","Acta Crystallographica Section E","2004","60","11","m1550","m1551","10.1107/S1600536804024195","","","0.71073","MoKα","","0.0524","0.0473","","","0.1192","0.1235","","","","","","1.012","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204461","7.913","0.002","11.192","0.002","11.438","0.003","64.8","0.02","82.26","0.03","77.32","0.03","893.2","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Hemi(4,4'-bipyridylium) hydrogen 2,2'-dithiodibenzoate monohydrate","","- C38 H32 N2 O10 S4 -","- C38 H32 N2 O10 S4 -","- C38 H32 N2 O10 S4 -","1","0.5","CI6457","Hu, Rui-Feng; Wen, Yi-Hang; Zhang, Jian; Li, Zhao-Ji; Yao, Yuan-Gen","4,4'-Bipyridylium bis(hydrogen 2,2'-dithiodibenzoate) dihydrate","Acta Crystallographica Section E","2004","60","11","o2029","o2031","10.1107/S1600536804025565","","","0.71073","MoKα","","","0.0579","","","0.1459","0.186","","","","","","1.156","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204462","4.8087","0.0017","12.043","0.004","18.481","0.006","90","","91.16","0.008","90","","1070","0.6","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,4-Bis(1H-benzotriazol-1-ylmethyl))benzene tetrahydrate","","- C20 H24 N6 O4 -","- C20 H24 N6 O4 -","- C40 H48 N12 O8 -","2","0.5","CI6458","Yue-Peng Cai; Guo-Bi Li; Guang-Ping He; Cheng-Yong Su; An-Wu Xu; Chi Zhang","1,4-Bis(1<i>H</i>-benzotriazol-1-ylmethyl)benzene tetrahydrate","Acta Crystallographica Section E","2004","60","11","o2062","o2064","10.1107/S1600536804026157","","","0.71073","MoKα","","0.1399","0.0688","","","0.1876","0.2277","","","","","","0.888","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204463","9.4266","0.0019","9.938","0.002","15.347","0.003","88.9","0.03","86.63","0.03","70.37","0.03","1351.8","0.5","291","2","291","2","","","","","","","","4","P -1","-P 1","2","","5-(4-Methoxyphenyl)-1-phenyl-3-hydroxy-1H-pyrazole","","- C16 H14 N2 O2 -","- C16 H14 N2 O2 -","- C64 H56 N8 O8 -","4","2","CI6459","Zhu, Hong-Jun; Wang, Dan-Dan; Ma, Ji","3-Hydroxy-5-(4-methoxyphenyl)-1-phenyl-1<i>H</i>-pyrazole","Acta Crystallographica Section E","2004","60","11","o2144","o2146","10.1107/S1600536804026789","","","0.71073","MoKα","","0.0962","0.0531","","","0.1155","0.1379","","","","","","1.013","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204464","16.334","0.002","16.334","0.002","13.975","0.002","90","","90","","90","","3728.5","0.8","294","2","294","2","","","","","","","","4","P 42/n :2","-P 4bc","86","","9-[4-(1,2,3,4,5,6,7,8,9,10-Decahydro-3,3,6,6-tetramethyl-1,8-dioxoacridin- 9-yl)phenyl]-1,2,3,4,5,6,7,8,9,10-decahydro-3,3,6,6-tetramethylacridine- 1,8-dione dihydrate","","- C40 H52 N2 O6 -","- C40 H52 N2 O6 -","- C160 H208 N8 O24 -","4","0.5","CI6460","Chang-Sheng Yao; Chen-Xia Yu; Shu-Jiang Tu; Da-Qing Shi; Xiang-Shan Wang","9-[4-(1,2,3,4,5,6,7,8,9,10-Decahydro-3,3,6,6-tetramethyl-1,8-dioxoacridin-9-yl)phenyl]-1,2,3,4,5,6,7,8,9,10-decahydro-3,3,6,6-tetramethylacridine-1,8-dione dihydrate","Acta Crystallographica Section E","2004","60","11","o2022","o2024","10.1107/S1600536804025462","","","0.71073","MoKα","","0.1334","0.0591","","","0.1372","0.16","","","","","","0.809","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204465","12.42","0.002","12.999","0.002","15.18","0.003","90","","107.245","0.003","90","","2340.6","0.7","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetrapyridinedithiocyanatocopper(II)","","- C22 H20 Cu N6 S2 -","- C22 H20 Cu N6 S2 -","- C88 H80 Cu4 N24 S8 -","4","0.5","CI6461","Li, Zong-Xiao; Zhang, Xin-Li","Tetrapyridinedithiocyanatocopper(II)","Acta Crystallographica Section E","2004","60","11","m1597","m1598","10.1107/S160053680402495X","","","0.71073","MoKα","","0.0497","0.0449","","","0.1415","0.1456","","","","","","1.071","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204466","18.23","0.003","18.23","0.003","8.531","0.002","90","","90","","90","","2835.1","0.9","293","2","293","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","Tetrakis{μ-1-[2-(2-oxidoethylamino)ethyliminomethyl]-2- naphtholato}tetrazinc(II)","","- C60 H64 N8 O8 Zn4 -","- C60 H64 N8 O8 Zn4 -","- C120 H128 N16 O16 Zn8 -","2","0.25","CI6463","You, Zhong-Lu; Ma, Ji-Long; Zhu, Hai-Liang; Liu, Wei-Sheng","Tetrakis{μ-1-[2-(2-oxidoethylamino)ethyliminomethyl]-2-naphtholato}tetrazinc(II)","Acta Crystallographica Section E","2004","60","11","m1599","m1601","10.1107/S1600536804024997","","","0.71073","MoKα","","0.0557","0.0421","","","0.0993","0.1039","","","","","","0.97","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204467","14.1794","0.0015","8.6881","0.0009","13.2708","0.0013","90","","90","","90","","1634.9","0.3","193","2","193","2","","","","","","","","4","P n a 21","P 2c -2n","33","","9-(4-Methoxyphenyl)-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione","","- C20 H21 N O3 -","- C20 H21 N O3 -","- C80 H84 N4 O12 -","4","1","CI6464","Cheng Guo; Shujiang Tu; Tuanjie Li; Songlei Zhu","9-(4-Methoxyphenyl)-3,4,6,7,9,10-hexahydroacridine-1,8(2<i>H</i>,5<i>H</i>)-dione","Acta Crystallographica Section E","2004","60","11","o2035","o2037","10.1107/S1600536804025796","","","0.7107","MoKα","","0.0491","0.0439","","","0.0928","0.0953","","","","","","1.1","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204468","10.046","0.005","21.735","0.01","7.189","0.003","90","","131.879","0.004","90","","1168.7","0.9","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diamminesilver(I) picrate","","- C6 H8 Ag N5 O7 -","- C6 H8 Ag N5 O7 -","- C24 H32 Ag4 N20 O28 -","4","0.5","CI6465","You, Zhong-Lu; Zhu, Hai-Liang; Liu, Wei-Sheng","Diamminesilver(I) picrate","Acta Crystallographica Section E","2004","60","11","m1624","m1626","10.1107/S1600536804025425","","","0.71073","MoKα","","0.0303","0.0266","","","0.0685","0.0718","","","","","","1.102","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2204469","6.8876","0.0001","13.9289","0.0001","16.5396","0.0005","90","","95.146","0.003","90","","1580.36","0.05","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,2-Bis(2,4-dinitrophenoxy)ethane","","- C14 H10 N4 O10 -","- C14 H10 N4 O10 -","- C56 H40 N16 O40 -","4","0.5","CI6466","P. G. Aravindan; S. Selvanayagam; D. Velmurugan; K. Ravikumar; S. Saravanan; P. C. Srinivasan","1,2-Bis(2,4-dinitrophenoxy)ethane","Acta Crystallographica Section E","2004","60","11","o2056","o2058","10.1107/S1600536804025577","","","0.71073","MoKα","","0.0539","0.0482","","","0.14","0.1477","","","","","","1.009","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204470","10.617","0.0008","6.0354","0.0005","23.0654","0.0017","90","","101.649","0.001","90","","1447.54","0.19","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","S-p-Tolyl 3-methanesulfonyl-2-oxoimidazolidine-1-carbothioate","","- C12 H14 N2 O4 S2 -","- C12 H14 N2 O4 S2 -","- C48 H56 N8 O16 S8 -","4","1","CI6469","Xian-Rui Liang; Jian-Hua Chen; Wen Feng; Wei-Ke Su; Wei-Rong Chen","<i>S</i>-<i>p</i>-Tolyl 3-methanesulfonyl-2-oxoimidazolidine-1-carbothioate","Acta Crystallographica Section E","2004","60","11","o2115","o2116","10.1107/S1600536804026376","","","0.71073","MoKα","","0.0551","0.0475","","","0.1116","0.1165","","","","","","1.084","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204471","3.8051","0.0017","11.852","0.005","13.903","0.006","90","","95.035","0.007","90","","624.6","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Fluoro-4-hydroxybenzonitrile","","- C7 H4 F N O -","- C7 H4 F N O -","- C28 H16 F4 N4 O4 -","4","1","CV6381","Song, Xiu-Yan; Dong, Xiao-Hong; Zhang, Shu-Sheng; Li, Xue-Mei; Wen, Yong-Hong; Zhong, Hui-Min","2-Fluoro-4-hydroxybenzonitrile","Acta Crystallographica Section E","2004","60","11","o1919","o1920","10.1107/S1600536804024250","","","0.71073","MoKα","","0.0395","0.0342","","","0.094","0.0985","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204472","7.257","0.0007","12.0869","0.0011","14.4455","0.0011","90","","93.465","0.002","90","","1264.77","0.19","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Nitrobenzaldehyde 4-nitrophenylhydrazone","","- C13 H10 N4 O4 -","- C13 H10 N4 O4 -","- C52 H40 N16 O16 -","4","1","CV6384","Shang Shan; Xiao-Juan Wang; Wei-Xiao Hu; Duan-Jun Xu","2-Nitrobenzaldehyde 4-nitrophenylhydrazone","Acta Crystallographica Section E","2004","60","11","o1954","o1956","10.1107/S1600536804024572","","","0.71073","MoKα","","0.049","0.038","","","0.096","0.101","","","","","","1.063","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204473","14.964","0.002","6.09","0.0008","15.754","0.002","90","","108.387","0.002","90","","1362.4","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-(2-Methylprop-2-enyl)-1-[3-(trifluoromethyl)phenyl]thiosemicarbazide","","- C12 H14 F3 N3 S -","- C12 H14 F3 N3 S -","- C48 H56 F12 N12 S4 -","4","1","CV6385","Chopra, Deepak; Choudhury, A. R; Nagarajan, K.; Guru Row, T. N.","4-(2-Methylprop-2-enyl)-1-[3-(trifluoromethyl)phenyl]thiosemicarbazide","Acta Crystallographica Section E","2004","60","11","o2017","o2018","10.1107/S1600536804025322","","","0.71073","MoKα","","0.1254","0.0763","","","0.2227","0.249","","","","","","0.906","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2204474","9.088","0.0004","10.2194","0.0005","26.51","0.0013","90","","90","","90","","2462.1","0.2","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","6-Deoxy-1,2:3,4-di-O-isopropylidene-α-D-galacto-heptodialdo-1,5- pyranose diphenyl dithioacetal","","- C25 H30 O5 S2 -","- C25 H30 O5 S2 -","- C100 H120 O20 S8 -","4","1","CV6386","Weaver, Travis D.; Norris, Peter; Zeller, Matthias","6-Deoxy-1,2:3,4-di-<i>O</i>-isopropylidene-α-<small>D</small>-<i>galacto</i>-heptodialdo-1,5-pyranose diphenyl dithioacetal","Acta Crystallographica Section E","2004","60","11","o2113","o2114","10.1107/S1600536804025097","","","0.71073","MoKα","","0.0455","0.0452","","","0.1065","0.1066","","","","","","1.367","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204475","7.224","0.0014","9.565","0.0019","33.245","0.007","90","","95.22","0.03","90","","2287.6","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-[(2,6-Dimethylphenyl)aminocarbonylmethyl]- 4-{[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl}piperazine","","- C23 H26 N6 O4 -","- C23 H26 N6 O4 -","- C92 H104 N24 O16 -","4","1","CV6388","Wang, Hai-Bo; Chen, Jia-Hui; Pu, Yue-Qing; Wang, Jin-Tang","1-[(2,6-Dimethylphenyl)aminocarbonylmethyl]-4-{[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl}piperazine","Acta Crystallographica Section E","2004","60","11","o2041","o2042","10.1107/S1600536804025656","","","0.71073","MoKα","","0.1813","0.0702","","","0.1818","0.2286","","","","","","1.064","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204476","9.7793","0.0004","11.3997","0.0004","19.147","0.0007","90","","90","","90","","2134.53","0.14","160","1","160","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","17-butyl-16,17a-dioxo-17-aza-D-homoestra-1,3,5(10)-trien-3-yl acetate","","- C24 H31 N O4 -","- C24 H31 N O4 -","- C96 H124 N4 O16 -","4","1","CV6389","Hema, R.; Parthasarathi, V.; Ranju Gupta; Linden, Anthony","17-Butyl-16,17a-dioxo-17-aza-<small>D</small>-homoestra-1,3,5(10)-trien-3-yl acetate","Acta Crystallographica Section E","2004","60","11","o2002","o2004","10.1107/S1600536804025061","","","0.71073","MoKα","","0.0664","0.0457","","","0.11","0.1236","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204477","10.659","0.005","12.768","0.006","6.556","0.003","90","","90","","90","","892.2","0.7","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","Cesium(I) hydrogen phthalate","","- C8 H5 Cs O4 -","- C8 H5 Cs O4 -","- C32 H20 Cs4 O16 -","4","1","CV6390","Mancheng Hu; Chunyu Geng; Shuni Li; Zhihong Liu; Yucheng Jiang; Guofang Zhang","Caesium(I) hydrogen phthalate","Acta Crystallographica Section E","2004","60","11","m1713","m1715","10.1107/S1600536804026479","","","0.71073","MoKα","","0.0287","0.0268","","","0.0719","0.0734","","","","","","1.007","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204478","9.4395","0.0018","26.225","0.005","9.8059","0.0019","90","","98.954","0.003","90","","2397.9","0.8","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(N-Ethyl-N-propyldithiocarbamato)triphenyltin(IV)","","- C24 H27 N S2 Sn -","- C24 H27 N S2 Sn -","- C96 H108 N4 S8 Sn4 -","4","1","CV6391","Sanuddin, M.; Farina, Yang; Yamin, Bohari M.","(<i>N</i>-Ethyl-<i>N</i>-propyldithiocarbamato)triphenyltin(IV)","Acta Crystallographica Section E","2004","60","11","m1662","m1663","10.1107/S1600536804025784","","","0.71073","MoKα","","0.032","0.028","","","0.061","0.063","","","","","","1.14","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204479","9.728","0.003","8.064","0.003","15.746","0.005","90","","94.492","0.006","90","","1231.4","0.7","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(2,2-Bipyridine N,N'-dioxide-κ^2^O,O')dichloromercury(II)","","- C10 H8 Cl2 Hg N2 O2 -","- C10 H8 Cl2 Hg N2 O2 -","- C40 H32 Cl8 Hg4 N8 O8 -","4","1","CV6392","Tedmann, Onyango M.; Zavalij, Peter Y.; Madan, Stanley K.; Oliver, Scott R. J.","(2,2-Bipyridine <i>N</i>,<i>N</i>'-dioxide-κ^2^<i>O</i>,<i>O</i>')dichloromercury(II)","Acta Crystallographica Section E","2004","60","11","m1706","m1707","10.1107/S1600536804026261","","","0.71073","MoKα","","0.1015","0.0542","","","0.1159","0.1355","","","","","","0.999","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204480","21.1482","0.0013","9.9476","0.0012","11.973","0.0008","90","","112.69","0.002","90","","2323.9","0.4","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(3-methylbenzoato-κ^2^O,O')(phenanthroline-κ^2^N,N')copper(II)","","- C28 H22 Cu N2 O4 -","- C28 H22 Cu N2 O4 -","- C112 H88 Cu4 N8 O16 -","4","0.5","CV6393","Xu, Tu-Gen; Xu, Duan-Jun","Bis(3-methylbenzoato-κ^2^<i>O</i>,<i>O</i>')(phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)","Acta Crystallographica Section E","2004","60","11","m1650","m1652","10.1107/S1600536804025759","","","0.71073","MoKα","","0.049","0.037","","","0.087","0.091","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204481","9.7007","0.0009","20.774","0.002","8.9149","0.0009","90","","90","","90","","1796.6","0.3","298","2","298","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","(S)-(-)-5,5'-Bis(diphenylphosphino)-2,2,2',2'-tetramethyl-4,4'-bi- 1,3-benzodioxole","","- C42 H36 O4 P2 -","- C42 H36 O4 P2 -","- C84 H72 O8 P4 -","2","0.5","CV6394","Jiang Cheng; Yan-Hui Sun; Yi Pan; Jian-Hua Xu","(<i>S</i>)-(‒)-5,5'-Bis(diphenylphosphino)-2,2,2',2'-tetramethyl-4,4'-bi-1,3-benzodioxole","Acta Crystallographica Section E","2004","60","11","o2133","o2134","10.1107/S1600536804026510","","","0.71073","MoKα","","0.0394","0.0345","","","0.0789","0.0809","","","","","","0.989","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204482","7.7618","0.0012","7.7618","0.0012","24.35","0.0017","90","","90","","90","","1467","0.3","295","2","295","2","","","","","","","","4","P 41","P 4w","76","","3,4-Dimethoxybenzaldehyde 4-nitrophenylhydrazone","","- C15 H15 N3 O4 -","- C15 H15 N3 O4 -","- C60 H60 N12 O16 -","4","1","CV6396","Shang Shan; Wei-Xiao Hu; Duan-Jun Xu","3,4-Dimethoxybenzaldehyde 4-nitrophenylhydrazone","Acta Crystallographica Section E","2004","60","11","o2059","o2061","10.1107/S1600536804026145","","","0.71073","MoKα","","0.054","0.041","","","0.082","0.087","","","","","","1.131","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204483","12.587","0.003","21.037","0.005","12.738","0.003","90","","90.907","0.005","90","","3372.5","1.4","273","2","273","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","{2'-[1-(5-Bromo-2- oxidophenyl)ethylidene]benzohydrazidato(2-)}tris(pyridine)nickel(II)] pyridine solvate","","- C35 H30 Br Cl N6 Ni O2 -","- C35 H30 Br Cl N6 Ni O2 -","- C140 H120 Br4 Cl4 N24 Ni4 O8 -","4","1","CV6397","Ali, Hapipah M.; Khamis, Nur Ashikin; Yamin, Bohari M.","{2'-[1-(5-Bromo-2-oxidophenyl)ethylidene]benzohydrazidato(2‒)}tris(pyridine)nickel(II)] pyridine solvate","Acta Crystallographica Section E","2004","60","11","m1708","m1709","10.1107/S1600536804026522","","","0.71073","MoKα","","0.1083","0.0588","","","0.1175","0.1369","","","","","","1.005","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204484","10.776","0.002","13.283","0.003","20.89","0.004","90","","90","","90","","2990.1","1","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","catena-Poly[[(2,2'-bipyridine-κ^2^N,N')cadmium(II)]-μ-5-carboxyimidazole- 4-carboxylato-κ^4^N^3^,O^4^:N^1^,O^5^]","","- C15 H10 Cd N4 O4 -","- C15 H10 Cd N4 O4 -","- C120 H80 Cd8 N32 O32 -","8","1","CV6398","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui","<i>catena</i>-Poly[[(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]-μ-5-carboxyimidazole-4-carboxylato-κ^4^<i>N</i>^3^,<i>O</i>^4^:<i>N</i>^1^,<i>O</i>^5^]","Acta Crystallographica Section E","2004","60","11","m1728","m1730","10.1107/S1600536804026844","","","0.71073","MoKα","","0.0211","0.0189","","","0.0533","0.0543","","","","","","1.029","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204485","13.131","0.003","9.942","0.002","15.031","0.003","90","","112.47","0.03","90","","1813.3","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Methanol-κO)[3-methoxysalicylaldehyde (4-methoxybenzoyl)hydrazonato(2-)-κ^3^O,O',N]dioxomolybdenum(VI)","","- C17 H18 Mo N2 O7 -","- C17 H18 Mo N2 O7 -","- C68 H72 Mo4 N8 O28 -","4","1","CV6399","Gao, Shan; Zhang, Xian-Fa; Huo, Li-Hua; Zhao, Hui","(Methanol-κ<i>O</i>)[3-methoxysalicylaldehyde (4-methoxybenzoyl)hydrazonato(2‒)-κ^3^<i>O</i>,<i>O</i>',<i>N</i>]dioxomolybdenum(VI)","Acta Crystallographica Section E","2004","60","11","m1731","m1733","10.1107/S1600536804026856","","","0.71073","MoKα","","0.0314","0.0277","","","0.0718","0.0736","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204486","26.29","0.002","14.445","0.002","15.568","0.002","90","","107.3","0.03","90","","5644.6","1.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(N-Hydroxy-N-phenylbenzamidato-κ^2^O,O')[3-methoxysalicylaldehyde (2,4-dichlorophenoxyacetyl)hydrazonato-κ^3^O,N,O']oxovanadium(V)","","- C29 H22 Cl2 N3 O7 V -","- C29 H22 Cl2 N3 O7 V -","- C232 H176 Cl16 N24 O56 V8 -","8","1","CV6400","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui","(<i>N</i>-Hydroxy-<i>N</i>-phenylbenzamidato-κ^2^<i>O</i>,<i>O</i>')[3-methoxysalicylaldehyde (2,4-dichlorophenoxyacetyl)hydrazonato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']oxovanadium(V)","Acta Crystallographica Section E","2004","60","11","m1722","m1724","10.1107/S1600536804026741","","","0.71073","MoKα","","0.0558","0.0424","","","0.1067","0.1145","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204487","10.267","0.002","7.011","0.001","26.352","0.003","90","","93.94","0.01","90","","1892.4","0.5","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Amino-6-methoxy-4-(4-methoxyphenyl)-9,10-dihydro-4H-benzo[f]chromene- 3-carbonitrile","","- C22 H20 N2 O3 -","- C22 H20 N2 O3 -","- C88 H80 N8 O12 -","4","1","DN6161","Yu, Chen-Xia; Shi, Da-Qing; Wang, Xiang-Shan; Zhuang, Qi-Ya","2-Amino-6-methoxy-4-(4-methoxyphenyl)-9,10-dihydro-4<i>H</i>-benzo[<i>f</i>]chromene-3-carbonitrile","Acta Crystallographica Section E","2004","60","11","o1928","o1930","10.1107/S1600536804024274","","","0.71073","MoKα","","0.0765","0.0391","","","0.0835","0.0921","","","","","","0.854","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204488","10.373","0.003","8.037","0.003","8.077","0.003","90","","98.86","0.03","90","","665.3","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","3,3-Pentamethylenediaziridine","3,3-Pentamethylenediaziridine","","- C6 H12 N2 -","- C6 H12 N2 -","- C24 H48 N8 -","4","1","DN6163","Charette, André B.; Legault, Claude; Bélanger-Gariépy, Francine","3,3-Pentamethylenediaziridine","Acta Crystallographica Section E","2004","60","11","o1921","o1922","10.1107/S1600536804023888","","","1.54178","CuKα","","0.0476","0.0342","","0.0919","","0.0878","","","0.896","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204489","11.1774","0.0008","11.2461","0.0008","29.072","0.002","90","","90","","90","","3654.4","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C33 H49 N O10 -","- C33 H49 N O10 -","- C132 H196 N4 O40 -","4","1","DN6165","Guo-Bin Zhou; Peng-Fei Zhang; Yuan-Jiang Pan","2-Hydroxy-<i>N</i>-(2,3,4,6-tetra-<i>O</i>-pivaloyl-β-<small>D</small>-glucopyranosyl)benzylideneamine","Acta Crystallographica Section E","2004","60","11","o1959","o1960","10.1107/S1600536804024602","","","0.71073","MoKα","","0.0902","0.0473","","","0.0973","0.1098","","","","","","0.871","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204490","14.782","0.003","17.431","0.003","10.425","0.002","90","","124.16","0.03","90","","2222.7","1.1","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","μ-Chloro-μ-hydrido-bis[chloro(η^6^-p-cymene)ruthenium(II)](Ru—Ru)","","- C20 H29 Cl3 Ru2 -","- C20 H29 Cl3 Ru2 -","- C80 H116 Cl12 Ru8 -","4","0.5","DN6166","Therrien, Bruno; Frein, Stéphane; Süss-Fink, Georg","μ-Chloro-μ-hydrido-bis[chloro(η^6^-<i>p</i>-cymene)ruthenium(II)](<i>Ru{—</i>Ru}): a second polymorph","Acta Crystallographica Section E","2004","60","11","m1666","m1668","10.1107/S1600536804025899","","","0.71073","MoKα","","0.0308","0.0216","","","0.0473","0.0487","","","","","","0.919","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204491","3.9367","0.0005","20.461","0.003","10.0799","0.0013","90","","94.512","0.002","90","","809.41","0.19","100","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(4-Ethynylphenyl)methoxymethanimine","(4-Ethynylphenyl)methoxymethanimine","","- C10 H9 N O -","- C10 H9 N O -","- C40 H36 N4 O4 -","4","1","FL6119","Archan Dey; Rahul Banerjee","(4-Ethynylphenyl)methoxymethanimine","Acta Crystallographica Section E","2004","60","11","o2117","o2118","10.1107/S1600536804024808","","","0.71073","MoKα","","0.0498","0.0426","","","0.1072","0.1116","","","","","","1.067","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204492","7.5924","0.0007","8.6639","0.0008","21.7191","0.0019","90","","107.396","0.002","90","","1363.3","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","p-Anisolecarbonitrile","","- C8 H7 N O -","- C8 H7 N O -","- C64 H56 N8 O8 -","8","2","FL6120","Lesley, M. J. Gerald; Pineau, Mark R.; Hunter, Allen D.; Zeller, Matthias","<i>p</i>-Anisolecarbonitrile","Acta Crystallographica Section E","2004","60","11","o1937","o1938","10.1107/S1600536804022913","","","0.71073","MoKα","","0.0466","0.043","","","0.112","0.1147","","","","","","1.087","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204493","15.3472","0.0011","19.652","0.0014","36.444","0.003","90","","91.8281","0.0017","90","","10986","1.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","ALPOP","Tris[2-(2-hydroxyphenyl)-5-phenyl-1,3,4-oxadiazolato]aluminium","","- C42 H27.33 Al N6 O6.167 -","- C42 H27.3333 Al N6 O6.16667 -","- C504 H328 Al12 N72 O74 -","12","3","FL6121","Alice Dawson; Jia-Fu Wang; Michael D. Carducci; Eugene A. Mash","Tris[2-(2-oxidophenyl)-5-phenyl-1,3,4-oxadiazole-κ^2^<i>O</i>^2^,<i>N</i>^3^]aluminium 0.167-hydrate","Acta Crystallographica Section E","2004","60","11","m1644","m1646","10.1107/S1600536804025243","","","0.71073","MoKα","","0.2163","0.0743","","","0.1587","0.2349","","","","","","1.009","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2204494","11.7267","0.0004","8.1512","0.0002","16.8433","0.0005","90","","105.612","0.001","90","","1550.6","0.08","90","1","90","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Dicarbonylbis(triphenylphosphine)nickel(0)","","- C38 H30 Ni O2 P2 -","- C38 H30 Ni O2 P2 -","- C76 H60 Ni2 O4 P4 -","2","0.5","FL6122","Moncol, Jan; Gembicky, Milan; Coppens, Phillip","Dicarbonylbis(triphenylphosphine)nickel(0): a redetermination at 90K","Acta Crystallographica Section E","2004","60","11","m1582","m1583","10.1107/S1600536804024377","","","0.71069","MoKα","","0.0328","0.0242","","","0.0708","0.0745","","","","","","1.036","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204495","6.1413","0.0011","10.2111","0.0012","21.174","0.003","90","","90","","90","","1327.8","0.3","296","1","296","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1'R,3S)-2-Oxo-1-(1'-phenylethyl)piperidine-3-carboxylic acid","","- C14 H17 N O3 -","- C14 H17 N O3 -","- C56 H68 N4 O12 -","4","1","FL6123","Lumbreras-Garcá, Ana-María; Galindo-Guzmán, Alberto; Gnecco, Dino; Terán, Joel-Luis; Bernès, Sylvain","(1'<i>R</i>,3<i>S</i>)-2-Oxo-1-(1'-phenylethyl)piperidine-3-carboxylic acid: a case of a very strong intramolecular hydrogen bond","Acta Crystallographica Section E","2004","60","11","o2110","o2112","10.1107/S1600536804024171","","","0.71073","MoKα","","0.0864","0.0442","","","0.107","0.1316","","","","","","0.982","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204496","13.825","0.003","17.563","0.005","10.499","0.001","90","","90","","90","","2549.2","0.9","297","1","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C22 H24 Cl4 Cu N2 O2 -","- C22 H24 Cl4 Cu N2 O2 -","- C88 H96 Cl16 Cu4 N8 O8 -","4","1","FL6124","Akitsu, Takashiro; Einaga, Yasuaki","Bis[(<i>S</i>)-<i>N</i>-(2-butyl)-3,5-dichlorosalicylideneaminato-κ^2^<i>N</i>,<i>O</i>]copper(II)","Acta Crystallographica Section E","2004","60","11","m1605","m1607","10.1107/S1600536804024882","","","0.7107","MoKα","","","0.0474","","","","0.1074","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204497","10.481","0.002","10.844","0.002","11.151","0.003","106.576","0.009","106.92","0.01","111.192","0.01","1016.4","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","3-[(4-Bromoanilino)carbonyl]prop-2-enoic acid","","- C10 H8 Br N O3 -","- C10 H8 Br N O3 -","- C40 H32 Br4 N4 O12 -","4","2","FL6125","Parvez, Masood; Shahid, Khadija; Shahzadi, Saira; Ali, Saqib","3-[(4-Bromoanilino)carbonyl]prop-2-enoic acid","Acta Crystallographica Section E","2004","60","11","o2079","o2081","10.1107/S1600536804026029","","","0.71073","MoKα","","0.052","0.034","","","0.075","0.083","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204498","7.062","0.001","12.665","0.002","13.875","0.003","98.372","0.007","102.792","0.008","92.732","0.009","1193.2","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","3-[(2,4,6-Trichloroanilino)carbonyl]prop-2-enoic acid","","- C10 H6 Cl3 N O3 -","- C10 H6 Cl3 N O3 -","- C40 H24 Cl12 N4 O12 -","4","2","FL6126","Parvez, Masood; Shahzadi, Saira; Shahid, Khadija; Ali, Saqib","3-[(2,4,6-Trichloroanilino)carbonyl]prop-2-enoic acid","Acta Crystallographica Section E","2004","60","11","o2082","o2084","10.1107/S1600536804026030","","","0.71073","MoKα","","0.066","0.038","","","0.091","0.104","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204499","12.078","0.005","19.923","0.005","8.336","0.005","90","","92.537","0.005","90","","2003.9","1.5","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-Isopropyl-3-(2-morpholinioethyl)benzimidazolium diiodide","","- C16 H25 I2 N3 O -","- C16 H25 I2 N3 O -","- C64 H100 I8 N12 O4 -","4","1","FL6128","Mehmet Akkurt; Sevim Türktekin; Hasan Küçükbay; Ülkü Yılmaz; Orhan Büyükgüngör","1-Isopropyl-3-(2-morpholinioethyl)benzimidazolium diiodide","Acta Crystallographica Section E","2004","60","11","o2135","o2137","10.1107/S1600536804026637","","","0.71073","MoKα","","0.0247","0.0195","","","0.0439","0.045","","","","","","0.97","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204500","8.358","0.0017","10.522","0.002","10.581","0.002","90.13","0.03","102.08","0.03","99.73","0.03","896.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Methyl 2-{[3-(4-methylsulfanyl)phenyl-1,2,4-oxadiazol- 5-yl]methoxy}phenylacetate","","- C19 H18 N2 O4 S -","- C19 H18 N2 O4 S -","- C38 H36 N4 O8 S2 -","2","1","FL6129","Wang, Hai-Bo; Chen, Jia-Hui; Pu, Yue-Qing; Wang, Jin-Tang","Methyl 2-{[3-(4-methylsulfanyl)phenyl-1,2,4-oxadiazol-5-yl]methoxy}phenylacetate","Acta Crystallographica Section E","2004","60","11","o2122","o2124","10.1107/S1600536804026649","","","0.71073","MoKα","","0.0554","0.0406","","","0.1276","0.1419","","","","","","0.906","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204501","12.687","0.003","23.424","0.017","12.956","0.008","90","","104.8","0.04","90","","3723","4","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H29 Cl F12 N6 P2 Ru -","- C36 H29 Cl F12 N6 P2 Ru -","- C144 H116 Cl4 F48 N24 P8 Ru4 -","4","1","GH6001","Coe, Benjamin J.; Curati, Naomi R. M.; Grabowski, Simon R.; Horton, Peter N.; Hursthouse, Michael B.","<i>cis</i>-Bis(2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')chloro(1-phenyl-4,4'-bipyridinium-κ<i>N</i>^1'^)ruthenium(II) bis(hexafluorophosphate)","Acta Crystallographica Section E","2004","60","11","m1562","m1564","10.1107/S1600536804024006","","","0.71073","MoKα","","0.1154","0.0598","","","0.1108","0.1277","","","","","","1.026","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204502","20.539","0.003","7.012","0.002","19.243","0.003","90","","116.95","0.03","90","","2470.4","1.1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Strontium ferron trihydrate","Diaquabis(8-oxido-7-iodoquinolinium-5-sulfonato)strontium monohydrate","","- C18 H16 I2 N2 O11 S2 Sr -","- C18 H16 I2 N2 O11 S2 Sr -","- C72 H64 I8 N8 O44 S8 Sr4 -","4","1","HB6083","Balasubramani, Kasthuri; Francis, Savarimuthu; Muthiah, Packianathan Thomas; Bocelli, Gabriele; Cantoni, Andrea","Diaquabis(7-iodo-8-oxidoquinolinium-5-sulfonato)strontium(II) monohydrate","Acta Crystallographica Section E","2004","60","11","m1576","m1579","10.1107/S1600536804024067","","","0.71069","MoKa","","0.1145","0.0747","","","0.2033","0.23","","","","","","0.998","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204503","11.313","0.002","12.907","0.003","14.483","0.003","83.049","0.003","76.301","0.003","68.085","0.003","1904.9","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Tris(1,10-phenanthroline-κ^2^N,N')zinc(II) bis(perchlorate) ethanol solvate monohydrate","","- C38 H32 Cl2 N6 O10 Zn -","- C38 H32 Cl2 N6 O10 Zn -","- C76 H64 Cl4 N12 O20 Zn2 -","2","1","HB6094","Wei, Yibin; Yuan, Caixia; Yang, Pin","Tris(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')zinc(II) bis(perchlorate) ethanol solvate monohydrate","Acta Crystallographica Section E","2004","60","11","m1686","m1688","10.1107/S1600536804026212","","","0.71073","MoKα","","0.1459","0.0851","","","0.1442","0.1684","","","","","","1.003","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204504","30.601","0.004","8.4526","0.0011","7.7465","0.001","90","","90","","90","","2003.7","0.5","273","2","273","2","","","","","","","","5","C m c 21","C 2c -2","36","","{1,1'-[1,3-Propanediylbis(nitrilomethylidyne)]di-2-naphtholato}zinc(II)","","- C25 H20 N2 O2 Zn -","- C25 H20 N2 O2 Zn -","- C100 H80 N8 O8 Zn4 -","4","0.5","HB6099","Wu, Chuan-Bao","{1,1'-[1,3-Propanediylbis(nitrilomethylidyne)]di-2-naphtholato}zinc(II), containing a square-planar ZnO~2~N~2~ group","Acta Crystallographica Section E","2004","60","11","m1580","m1581","10.1107/S1600536804023177","","","0.71073","MoKα","","0.0425","0.0412","","","0.1222","0.124","","","","","","1.106","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204505","14.5818","0.0015","5.3508","0.0006","9.7958","0.0011","90","","90","","90","","764.31","0.14","295","2","295","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","catena-poly[[diaquamanganese(II)]-μ-iminodiacetato-κ^3^N,O,O']","","- C4 H9 Mn N O6 -","- C4 H9 Mn N O6 -","- C16 H36 Mn4 N4 O24 -","4","1","HB6100","Bing-Xin Liu; Duan-Jun Xu","Redetermination of <i>catena</i>-poly[[diaquamanganese(II)]-μ-iminodiacetato-κ^4^<i>N</i>,<i>O</i>,<i>O</i>':<i>O</i>'']","Acta Crystallographica Section E","2004","60","11","m1570","m1572","10.1107/S1600536804024262","","","0.71073","MoKα","","0.022","0.021","","","0.05","0.051","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204506","6.9258","0.0019","7.513","0.002","12.907","0.004","77.622","0.008","83.212","0.009","74.103","0.008","629.6","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Tcatena-Poly[[[aqua(2-carboxy-6-nitrobenzoato-κO)sodium]-di-μ-aqua] monohydrate]","","- C8 H12 N Na O10 -","- C8 H12 N Na O10 -","- C16 H24 N2 Na2 O20 -","2","1","HB6105","Guo, Ming-Lin","<i>catena</i>-Poly[[[aqua(2-carboxy-6-nitrobenzoato-κ<i>O</i>)sodium]-di-μ-aqua] monohydrate]","Acta Crystallographica Section E","2004","60","11","m1684","m1685","10.1107/S1600536804026273","","","0.71073","MoKα","","0.0665","0.048","","","0.1219","0.1318","","","","","","1.105","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204507","7.8618","0.0016","11.709","0.002","13.231","0.003","105.25","0.03","102.68","0.03","104.42","0.03","1083.8","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis[μ-3-methoxysalicylaldehyde (4-methoxybenzoyl)hydrazonato]bis[pyridinecopper(II)] methanol disolvate","","- C44 H46 Cu2 N6 O10 -","- C44 H46 Cu2 N6 O10 -","- C44 H46 Cu2 N6 O10 -","1","0.5","HB6106","Huo, Li-Hua; Lu, Zhen-Zhong; Gao, Shan; Zhao, Hui; Zhao, Jing-Gui","Bis[μ-3-methoxysalicylaldehyde (4-methoxybenzoyl)hydrazonato]bis[pyridinecopper(II)] methanol disolvate","Acta Crystallographica Section E","2004","60","11","m1636","m1638","10.1107/S1600536804025413","","","0.71073","MoKα","","0.0439","0.0366","","","0.094","0.0973","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204508","16.921","0.004","10.073","0.002","17.59","0.005","90","","115.647","0.004","90","","2702.7","1.1","193","2","193","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(isothiocyanato-κN)bis[8-(methoxycarbonylmethoxy)quinoline-κN]copper(II)","","- C26 H22 Cu N4 O6 S2 -","- C26 H22 Cu N4 O6 S2 -","- C104 H88 Cu4 N16 O24 S8 -","4","0.5","HB6107","Song, Rui-Feng; Wang, Yu-Hong; Jiang, Fan","Bis(isothiocyanato-κ<i>N</i>)bis[8-(methoxycarbonylmethoxy)quinoline-κ<i>N</i>]copper(II)","Acta Crystallographica Section E","2004","60","11","m1695","m1696","10.1107/S1600536804025668","","","0.7107","MoKα","","0.0637","0.0549","","","0.0985","0.1013","","","","","","1.22","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204509","25.259","0.0009","13.981","0.0005","12.308","0.0005","90","","111.348","0.002","90","","4048.3","0.3","150","1","150","1","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Bis(μ-phenylphosphido-κ^2^P:P)bis{[1,2-(dicyclohexylphosphino)ethane- κ^2^P,P']platinum(I)} dichloride bis(dichloromethane) hexane solvate","","- C72 H126 Cl6 P6 Pt2 -","- C66 H112 Cl6 P6 Pt2 -","- C132 H224 Cl12 P12 Pt4 -","2","0.25","HB6109","Jaska, Cory A.; Lough, Alan J.; Manners, Ian","Bis(μ-phenylphosphido-κ^2^<i>P</i>:<i>P</i>)bis{[1,2-(dicyclohexylphosphino)ethane-κ^2^<i>P,P</i>']platinum(I)} dichloride bis(dichloromethane) hexane solvate","Acta Crystallographica Section E","2004","60","11","m1653","m1655","10.1107/S1600536804025309","","","0.71073","MoKα","","0.0452","0.0362","","","0.0843","0.0874","","","","","","1.086","","","","has coordinates,has disorder,has Fobs","209451","2020-10-21","18:00:00",""
"2204510","15.014","0.003","6.568","0.002","15.33","0.003","90","","106.69","0.02","90","","1448","0.6","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Diaminopyrimidinium sulfate monohydrate","Bis(2,4-diamino-6-oxopyrimidinium) sulfate monohydrate","","- C8 H16 N8 O7 S -","- C8 H16 N8 O7 S -","- C32 H64 N32 O28 S4 -","4","1","HB6111","Packianathan Thomas Muthiah; Madhukar Hemamalini; Gabriele Bocelli; Andrea Cantoni","Bis(2,4-diamino-6-oxopyrimidinium) sulfate monohydrate","Acta Crystallographica Section E","2004","60","11","o2038","o2040","10.1107/S1600536804025747","","","0.71069","MoKα","","0.0848","0.0754","","","0.242","0.2508","","","","","","1.126","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204511","7.7843","0.0016","21.977","0.004","11.129","0.002","90","","90","","90","","1903.9","0.6","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Triaquaformatobis(4-formyl-2-methoxyphenolato)gadolinium(III)","","- C17 H21 Gd O11 -","- C17 H21 Gd O11 -","- C68 H84 Gd4 O44 -","4","0.5","HB6118","Gao, Shan; Huo, Li-Hua; Zhang, Xian-Fa; Zhao, Hui","Triaquaformatobis(4-formyl-2-methoxyphenolato)gadolinium(III)","Acta Crystallographica Section E","2004","60","11","m1738","m1740","10.1107/S1600536804027205","","","0.71073","MoKα","","0.018","0.017","","","0.043","0.044","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204512","7.6328","0.0007","9.78","0.0009","9.8622","0.0009","89.351","0.001","73.954","0.001","80.565","0.001","697.5","0.11","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Aqua(oxalato-κ^2^O,O')oxo(1,10-phenanthroline-κ^2^N,N')vanadium(IV)","","- C14 H10 N2 O6 V -","- C14 H10 N2 O6 V -","- C28 H20 N4 O12 V2 -","2","1","HB6202","Fu, Yun-Long; Ren, Jia-Lin; Ng, Seik Weng","Aqua(oxalato-κ^2^<i>O</i>,<i>O</i>')oxo(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')vanadium(IV)","Acta Crystallographica Section E","2004","60","11","m1584","m1586","10.1107/S1600536804024432","","","0.71073","MoKα","","0.059","0.043","","","0.109","0.125","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204513","34.738","0.004","7.45","0.002","12.929","0.004","90","","106.23","0.02","90","","3212.7","1.4","295","2","275","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C60 H74 Co2 N8 O25 -","- C60 H72 Co2 N8 O25 -","- C120 H144 Co4 N16 O50 -","2","0.5","HB6203","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","μ-4,4'-Bipyridine-κ^2^<i>N</i>:<i>N</i>'-bis[triaqua(4,4'-bipyridine-κ^2^<i>N</i>,<i>N</i>')[1,3-phenylenedi(oxyacetato)-κ<i>O</i>]cobalt(II)] 4,4'-bipyridine heptahydrate","Acta Crystallographica Section E","2004","60","11","m1590","m1592","10.1107/S1600536804024535","","","0.71073","MoKα","","0.0367","0.0318","","","0.0759","0.0778","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204514","11.877","0.001","11.559","0.001","18.766","0.002","90","","108.449","0.002","90","","2443.9","0.4","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[N-(2-Aminocyclohexyl)salicylaldiminato-κ^3^O,N,N']dichlorophenyltin(IV) chloroform solvate","","- C20 H23 Cl5 N2 O Sn -","- C20 H23 Cl5 N2 O Sn -","- C80 H92 Cl20 N8 O4 Sn4 -","4","1","HB6204","Lee, See Mun; Lo, Kong Mun; Ng, Seik Weng","[<i>N</i>-(2-Aminocyclohexyl)salicylaldiminato-κ^3^<i>O,N,N</i>']dichlorophenyltin(IV) chloroform solvate","Acta Crystallographica Section E","2004","60","11","m1614","m1616","10.1107/S1600536804025036","","","0.71073","MoKα","","0.048","0.041","","","0.109","0.114","","","","","","1.01","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204515","6.1589","0.0002","9.682","0.006","18.714","0.006","90","","90","","90","","1115.9","0.8","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","L-ornithinium sulfate monohydrate","L-ornithinium sulfate monohydrate","","- C5 H16 N2 O7 S -","- C5 H16 N2 O7 S -","- C20 H64 N8 O28 S4 -","4","1","HG6090","Ravikumar, B.; Athimoolam, S.; Rajaram, R. K.","<small>L</small>-Ornithinium sulfate monohydrate","Acta Crystallographica Section E","2004","60","11","o2093","o2095","10.1107/S1600536804026108","","","0.71073","MoKα","","0.0665","0.0587","","","0.1628","0.1707","","","","","","1.06","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204516","13.576","0.002","4.0362","0.0006","27.495","0.004","90","","98.621","0.003","90","","1489.6","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","N-(2-Bromophenyl)-N'-(4-methoxybenzoyl)thiourea","","- C15 H13 Br N2 O2 S -","- C15 H13 Br N2 O2 S -","- C60 H52 Br4 N8 O8 S4 -","4","1","HG6091","M. Sukeri M. Yusof; Bohari M. Yamin","<i>N</i>-(2-Bromophenyl)-<i>N</i>'-(4-methoxybenzoyl)thiourea","Acta Crystallographica Section E","2004","60","11","o2045","o2046","10.1107/S1600536804025590","","","0.71073","MoKα","","0.066","0.042","","","0.091","0.1","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204517","26.082","0.014","14.385","0.007","16.231","0.008","90","","118.808","0.008","90","","5336","5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[tris(2-benzimidazolylmethyl)amine]dinitratocadmium(II)","","- C24 H21 Cd N9 O6 -","- C24 H21 Cd N9 O6 -","- C192 H168 Cd8 N72 O48 -","8","1","HG6092","Jin-Lei Tian; Ming-Jin Xie; Shi-Ping Yan; Dai-Zheng Liao; Zhong-Hui Jiang; Peng Cheng","The heptacoordinate cadmium(II) complex [tris(2-benzimidazolylmethyl)amine]dinitratocadmium(II)","Acta Crystallographica Section E","2004","60","11","m1689","m1691","10.1107/S1600536804026091","","","0.71073","MoKα","","0.0794","0.0386","","","0.0698","0.0773","","","","","","0.963","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204518","7.8609","0.0003","10.747","0.0004","16.5516","0.0006","90","","90","","90","","1398.3","0.09","190","","190","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C13 H20 O7 -","- C13 H20 O7 -","- C52 H80 O28 -","4","1","HG6094","Howard A. Shallard-Brown; Christopher C. Harding; David J. Watkin; Raquel Soengas; Ulla P. Skytte; George W. J. Fleet","2,3:5,6-Di-<i>O</i>-isopropylidene-2-<i>C</i>-hydroxymethyl-<small>D</small>-talono-1,4-lactone","Acta Crystallographica Section E","2004","60","11","o2163","o2164","10.1107/S160053680402700X","","","0.71073","MoKα","","0.0419","0.0333","","0.0735","0.0698","0.0735","","","","","","0.9219","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204519","11.2419","0.0005","14.5966","0.0007","15.873","0.0008","64.813","0.0012","86.689","0.0012","81.076","0.0012","2328.38","0.19","293","2","293","2","","","","","","","","6","P -1","-P 1","2","catena-poly[(5,12-dimethyl-7,14-diphenyl-1,4,8,11- tetracyclotetradecane)copper(II) bis[[(5,12-dimethyl-7,14-diphenyl-1,4,8,11- tetracyclotetradecane)copper(II)]-μ-oxalato-[(acetonitrile)copper(II)]-μ- oxalato] diperchlorate]","catena-poly[(5,12-dimethyl-7,14-diphenyl-1,4,8,11- tetracyclotetradecane)copper(II) bis[[(5,12-dimethyl-7,14-diphenyl-1,4,8,11- tetracyclotetradecane)copper(II)]-μ-oxalato-[(acetonitrile)copper(II)]-μ- oxalato] diperchlorate]","","- C84 H114 Cl2 Cu5 N14 O24 -","- C84 H114 Cl2 Cu5 N14 O24 -","- C84 H114 Cl2 Cu5 N14 O24 -","1","0.5","HG6095","Li, Yanping; Yang, Pin; Huang, Zixiang; Xie, Fuxin","A novel one-dimensional polymeric complex of a tetraaza-macrocycle‒copper(II) unit with a [Cu(C~2~O~4~)~2~(CH~3~CN)]^2{‒^} bridging anion","Acta Crystallographica Section E","2004","60","11","m1710","m1712","10.1107/S160053680402656X","","","0.71073","MoKα","","0.0853","0.0637","","","0.15","0.1739","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204520","15.6095","0.0008","6.8297","0.0004","18.6854","0.0009","90","","103.739","0.004","90","","1935.02","0.18","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","N-[(2'-Cyanobiphenyl-4-yl)methyl]-L-valine methyl ester hydrochloride","methyl 2-[(2'-cyanobiphenyl-4-yl)methylammonio]-3-methylbutanoate chloride","","- C20 H23 Cl N2 O2 -","- C20 H23 Cl N2 O2 -","- C80 H92 Cl4 N8 O8 -","4","2","HG6096","Yathirajan, Hemmige S.; Nagaraj, Basavegowda; Gaonkar, Santhosh L.; Narasegowda, Rajenahally S.; Nagarajab, Padmarajaiah; Prabhuswamy, Basappa; Bolte, Michael","<i>N</i>-[(2'-Cyanobiphenyl-4-yl)methyl]-<small>L</small>-valine methyl ester hydrochloride: an intermediate in the synthesis of valsartan","Acta Crystallographica Section E","2004","60","11","o2160","o2162","10.1107/S1600536804026790","","","0.71073","MoKα","","0.0368","0.0294","","","0.0666","0.0681","","","","","","0.904","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204521","8.65","0.0017","10.7","0.002","14.817","0.003","107.66","0.03","97.5","0.03","95.15","0.03","1283.4","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Methyl 2-(2-{1-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2- (dimethylamino)vinyloxy}phenyl)-3-(dimethylamino)acrylate","","- C26 H30 N4 O6 -","- C26 H30 N4 O6 -","- C52 H60 N8 O12 -","2","1","IS6005","Chen, Jia-Hui; Wang, Hai-Bo; Pu, Yue-Qing; Wang, Jin-Tang","Methyl 2-(2-{1-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-(dimethylamino)vinyloxy}phenyl)-3-(dimethylamino)acrylate","Acta Crystallographica Section E","2004","60","11","o2070","o2072","10.1107/S160053680402611X","","","0.71073","MoKα","","0.178","0.0715","","","0.2113","0.2606","","","","","","1.037","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204522","13.2773","0.0011","5.4948","0.0006","16.0402","0.0014","90","","95.7432","0.0018","90","","1164.36","0.19","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Diaquabis(4-chlorobenzoato-κO)bis(1H-imidazole-κN^3^)cobalt(II)","","- C20 H20 Cl2 Co N4 O6 -","- C20 H20 Cl2 Co N4 O6 -","- C40 H40 Cl4 Co2 N8 O12 -","2","0.5","IS6006","Tu-Gen Xu; Duan-Jun Xu","Diaquabis(4-chlorobenzoato-κ<i>O</i>)bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)cobalt(II)","Acta Crystallographica Section E","2004","60","11","m1669","m1671","10.1107/S1600536804025966","","","0.71073","MoKα","","0.035","0.03","","","0.079","0.081","","","","","","1.04","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204523","10.165","0.005","14.205","0.007","13.262","0.006","90","","90","","90","","1915","1.6","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","1-(1-Ferrocenyl-1-methoxy-3-phenylpropan-2-yl)-1H-1,2,4-triazole","","- C22 H23 Fe N3 O -","- C22 H23 Fe N3 O -","- C88 H92 Fe4 N12 O4 -","4","1","KP6004","Jin, Zhong; Song, Hai-bing; Liu, Wei; Hu, Yan; Liu, Jian-bin; Shao, Ling; Fang, Jian-xin","1-(1-Ferrocenyl-1-methoxy-3-phenyl-2-propyl)-1<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2004","60","11","m1692","m1694","10.1107/S1600536804025620","","","0.71073","MoKα","","0.0752","0.0416","","","0.083","0.1081","","","","","","1.058","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2204524","8.4902","0.0009","9.0205","0.0016","9.3236","0.0014","115.456","0.012","112.034","0.01","94.799","0.013","571.48","0.18","296","","296","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H24 Cl2 N2 O4 -","- C22 H24 Cl2 N2 O4 -","- C22 H24 Cl2 N2 O4 -","1","0.5","KP6006","Hiroyuki Ishida","Bis(2,4,6-trimethylpyridinium) chloranilate","Acta Crystallographica Section E","2004","60","11","o2005","o2006","10.1107/S1600536804025334","","","0.71073","MoKα","","0.087","0.046","","","0.106","0.122","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204525","10.8029","0.0014","10.9431","0.0009","12.376","0.002","105.92","0.01","93.838","0.012","94.804","0.009","1395.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Diethyl 3-[2-methoxy-5-(1-methyl-1-phenylethyl)phenyl]-2-phenyl-2,3,4,5- tetrahydroisoxazole-4,5-dicarboxylate","","- C31 H35 N O6 -","- C31 H35 N O6 -","- C62 H70 N2 O12 -","2","1","KP6007","V. Sridharan; P. Kalanidhi; K. Karthikeyan; S. Muthusubramanian; K. Anitha; R. K. Rajaram","Diethyl 3-[2-methoxy-5-(1-methyl-1-phenylethyl)phenyl]-2-phenyl-2,3,4,5-tetrahydroisoxazole-4,5-dicarboxylate","Acta Crystallographica Section E","2004","60","11","o2068","o2069","10.1107/S1600536804025681","","","0.71073","MoKα","","0.1096","0.0455","","","0.1073","0.1398","","","","","","1.004","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204526","10.436","0.002","5.18","0.001","31.56","0.006","90","","92.94","0.03","90","","1703.8","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 2-{[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]methoxy}phenylacetate","","- C18 H15 N3 O6 -","- C18 H15 N3 O6 -","- C72 H60 N12 O24 -","4","1","KP6008","Wang, Hai-Bo; Chen, Jia-Hui; Pu, Yue-Qing; Wang, Jin-Tang","Methyl 2-{[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]methoxy}phenylacetate","Acta Crystallographica Section E","2004","60","11","o2073","o2075","10.1107/S160053680402625X","","","0.71073","MoKα","","0.1322","0.0536","","","0.1472","0.1897","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204527","6.0584","0.0011","19.717","0.004","8.9513","0.0016","90","","98.257","0.004","90","","1058.2","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","7-Nitro-2,3-dihydro-1H-cyclopenta[b]chromen-1-one","","- C12 H9 N O4 -","- C12 H9 N O4 -","- C48 H36 N4 O16 -","4","1","LH6267","Huo, Fangjun; Yin, Caixia; Yang, Pin","7-Nitro-2,3-dihydro-1<i>H</i>-cyclopenta[<i>b</i>]chromen-1-one","Acta Crystallographica Section E","2004","60","11","o2087","o2089","10.1107/S1600536804026078","","","0.71073","MoKα","","0.0946","0.0524","","","0.1081","0.1247","","","","","","0.978","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204528","5.4608","0.0006","14.4068","0.0017","24.392","0.003","90","","90","","90","","1919","0.4","193","2","193","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","5,6,7,9-Tetra-O-acetyl-4,8-anhydro-1,2,3-trideoxy-D-glycero-D-gulo- non-1-enitol","","- C17 H24 O9 -","- C17 H24 O9 -","- C68 H96 O36 -","4","1","LH6268","Rhoad, Jonathon S.; Lowary, Todd L.; Ferguson, Michael J.","5,6,7,9-Tetra-<i>O</i>-acetyl-4,8-anhydro-1,2,3-trideoxy-<small>D</small>-<i>glycero</i>-<small>D</small>-<i>gulo</i>-non-1-enitol","Acta Crystallographica Section E","2004","60","11","o1939","o1941","10.1107/S1600536804024407","","","0.71073","MoKα","","0.0921","0.0526","","","0.0892","0.1003","","","","","","1.02","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204529","13.3072","0.0014","13.3072","0.0014","5.1172","0.0011","90","","90","","120","","784.8","0.2","193","2","193","2","","","","","","","","3","P 32","P 32","145","","4,8-anhydro-1,2,3,5-tetradeoxy-D-allo-non-1-enitol","","- C9 H16 O4 -","- C9 H16 O4 -","- C27 H48 O12 -","3","1","LH6269","Rhoad, Jonathon S.; Lowary, Todd L.; Ferguson, Michael J.","4,8-Anhydro-1,2,3,5-tetradeoxy-<small>D</small>-<i>allo</i>-non-1-enitol","Acta Crystallographica Section E","2004","60","11","o1942","o1944","10.1107/S1600536804024419","","","0.71073","MoKα","","0.1024","0.0631","","","0.1459","0.1788","","","","","","1.143","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204530","9.463","0.005","9.638","0.002","10.908","0.003","100.31","0.02","115.1","0.03","100.64","0.04","847.6","0.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","trans-Bis(1H-benzimidazol-2-ylmethyl-κN^3^ diethyl phosphate)dichloropalladium(II) monohydrate","","- C24 H36 Cl2 N4 O9 P2 Pd -","- C24 H34 Cl2 N4 O8 P2 Pd -","- C24 H34 Cl2 N4 O8 P2 Pd -","1","0.5","LH6279","Chęcińska, Lilianna; Małecka, Magdalena; Kalinowska, Urszula; Ochocki, Justyn","<i>trans</i>-Bis(1<i>H</i>-benzimidazol-2-ylmethyl-κ<i>N</i>^3^ diethyl phosphate)dichloropalladium(II) monohydrate","Acta Crystallographica Section E","2004","60","11","m1558","m1561","10.1107/S1600536804023943","","","0.7107","MoKα","","0.1433","0.0459","","","0.1073","0.1196","","","","","","0.901","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204531","7.647","0.002","21.158","0.004","14.122","0.003","90","","95.08","0.03","90","","2275.9","0.9","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Benzimidazolium 3-carboxyphenoxyacetate 3-carboxyphenoxyacetatic acid","","- C25 H22 N2 O10 -","- C25 H22 N2 O10 -","- C100 H88 N8 O40 -","4","1","LH6280","Gao, Shan; Huo, Li-Hua; Gu, Chang-Sheng; Zhao, Hui; Ng, Seik Weng","A second monoclinic modification of benzimidazolium 3-carboxyphenoxyacetate 3-carboxyphenoxyacetic acid","Acta Crystallographica Section E","2004","60","11","o1914","o1916","10.1107/S1600536804024158","","","0.71073","MoKα","","0.094","0.051","","","0.108","0.123","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204532","11.549","0.001","11.72","0.001","12.458","0.001","112.263","0.002","95.223","0.002","91.974","0.002","1549.7","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","5'-Aminohydroxymethylene-1',2'-dichloro-spiro[7H- pyrano[3,2-c;5,6-c']dichromene-7,4'-cyclohex-2'-ene]-3',6,6',8-tetraone dimethylformamide disolvate","","- C31 H25 Cl2 N3 O10 -","- C31 H25 Cl2 N3 O10 -","- C62 H50 Cl4 N6 O20 -","2","1","LH6281","Zhang, Sheng-Ling; Huang, Zhi-Shu; Gu, Lian-Quan; Ng, Seik Weng","5'-Aminohydroxymethylene-1',2'-dichloro-spiro[7<i>H</i>-pyrano[3,2-<i>c</i>;5,6-<i>c</i>']dichromene-7,4'-cyclohex-2'-ene]-3',6,6',8-tetraone dimethylformamide disolvate, a spiro compound from the reaction of 4-hydroxycoumarin with 2,3-dichloro-5,6-dicyanobenzoquinone","Acta Crystallographica Section E","2004","60","11","o1911","o1913","10.1107/S160053680402416X","","","0.71073","MoKα","","0.098","0.047","","","0.114","0.137","","","","","","1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204533","11.0105","0.0007","13.6596","0.001","26.8832","0.0018","90","","90","","90","","4043.2","0.5","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","Dibenzophospholanic acid anhydride","bis(5-hydroxy-5-oxodibenzo-5H-phosphole) anhydride or 9,9'-oxydi(9-phosphafluoren-9-one)","","- C24 H16 O3 P2 -","- C24 H16 O3 P2 -","- C192 H128 O24 P16 -","8","1","LH6282","Andreas Decken; Erin D. Gill; Frank Bottomley","Dibenzophospholanic acid anhydride","Acta Crystallographica Section E","2004","60","11","o1935","o1936","10.1107/S1600536804024390","","","0.71073","MoKα","","0.0922","0.0505","","","0.1295","0.1424","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204534","7.3854","0.0015","11.432","0.002","13.625","0.003","92.88","0.03","98.04","0.03","97.18","0.03","1127.4","0.4","173","2","173","2","","","","","","","","5","P 1","P 1","1","","catena-poly[[[tetraaquacobalt(II)]-μ-4,4-bipyridine-κ^2^N:N'] 2-carboxylatocinnamate dihydrate]","","- C20 H26 Co N2 O10 -","- C20 H26 Co N2 O10 -","- C40 H52 Co2 N4 O20 -","2","2","LH6283","Li, Feng; Wang, Yanqi; Bi, Wenhua; Li, Xing; Cao, Rong","A new supramolecular framework through hydrogen bonds in <i>catena</i>-poly[[[tetraaquacobalt(II)]-μ-4,4-bipyridine-κ^2^<i>N</i>:<i>N</i>'] 2-carboxylatocinnamate dihydrate]","Acta Crystallographica Section E","2004","60","11","m1681","m1683","10.1107/S1600536804026054","","","0.71073","MoKα","","0.0228","0.0215","","","0.0452","0.0455","","","","","","0.929","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204535","7.297","0.0003","14.7022","0.0007","15.8692","0.0007","90","","90","","90","","1702.48","0.13","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,3,4,6-Tetra-O-acetyl-β-D-glucopyranosyl azide","","- C14 H19 N3 O9 -","- C14 H19 N3 O9 -","- C56 H76 N12 O36 -","4","1","LH6285","Temelkoff, David P.; Norris, Peter; Zeller, Matthias","2,3,4,6-Tetra-<i>O</i>-acetyl-β-<small>D</small>-glucopyranosyl azide","Acta Crystallographica Section E","2004","60","11","o1975","o1976","10.1107/S1600536804024900","","","0.71073","MoKα","","0.0414","0.0411","","","0.1027","0.1029","","","","","","1.198","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204536","10.326","0.002","24.76","0.004","11.178","0.002","90","","96.274","0.007","90","","2840.8","0.9","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","trans-Dichloro(dicyclohexylamine)(triphenylphosphine)palladium(II)","trans-Dichloro(dicyclohexylamine)(triphenylphosphine)palladium(II)","","- C30 H38 Cl2 N P Pd -","- C30 H38 Cl2 N P Pd -","- C120 H152 Cl8 N4 P4 Pd4 -","4","1","LH6286","Parvez, Masood; Badshah, Amin; Asma, Maliha; Ali, Saqib; Ahmad, Saeed; Malik, Abdul; Ahmed, Fiaz","<i>trans</i>-Dichloro(dicyclohexylamine)(triphenylphosphine)palladium(II)","Acta Crystallographica Section E","2004","60","11","m1602","m1604","10.1107/S1600536804024912","","","0.71073","MoKα","","0.044","0.029","","","0.063","0.068","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204537","11.04","0.007","11.782","0.007","14.363","0.009","90","","105.76","0.04","90","","1798","2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Benzoylspiro[1H-isoindole-1,3'-isochromene]-1',3,4'(2H,3'H)-trione","","- C23 H13 N O5 -","- C23 H13 N O5 -","- C92 H52 N4 O20 -","4","1","LH6287","McSweeney, Nigel; Pratt, Albert C.; Creaven, Bernadette S.; Long, Conor; Howie, R. Alan","2-Benzoylspiro[1<i>H</i>-isoindole-1,3'-isochromene]-1',3,4'(2<i>H</i>,3'<i>H</i>)-trione","Acta Crystallographica Section E","2004","60","11","o2025","o2028","10.1107/S1600536804025279","","","0.71073","MoKα","","0.1801","0.0873","","","0.1392","0.1677","","","","","","1.024","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204538","14.265","0.002","8.154","0.0011","11.229","0.002","90","","102.8","0.015","90","","1273.7","0.3","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Tricarbonyl(3-carboxypropyl)(η^5^-cyclopentadienyl)tungsten(II)","","- C12 H12 O5 W -","- C12 H12 O5 W -","- C48 H48 O20 W4 -","4","1","LH6288","Friedrich, Holger B.; Howie, R. Alan; Onani, Martin O.","Tricarbonyl(3-carboxypropyl)(η^5^-cyclopentadienyl)tungsten(II)","Acta Crystallographica, Section E","2004","60","11","m1641","1643","10.1107/S1600536804025371","","","0.71073","MoKα","","0.0294","0.0261","","","0.0685","0.0716","","","","","","1.079","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2204539","13.5029","0.0003","6.7601","0.0001","18.2628","0.0003","90","","102.261","0.0013","90","","1629.02","0.05","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Dieuropium trisulfate octahydrate","","- Eu2 H16 O20 S3 -","- Eu2 H16 O20 S3 -","- Eu8 H64 O80 S12 -","4","0.5","LH6289","Sarangarajan, Thanjavur R.; Panchanatheswaran, Krishnaswamy; Low, John N.; Glidewell, Christopher","Dieuropium(III) trisulfate octahydrate: a redetermination at 120K","Acta Crystallographica Section E","2004","60","11","i142","i144","10.1107/S160053680402608X","","","0.71073","MoKα","","0.0203","0.0191","","","0.0535","0.0543","","","","","","1.255","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204540","10.9918","0.0006","9.082","0.0005","20.5555","0.0011","90","","94.5","0.001","90","","2045.68","0.19","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(guanidinium) diaquapentakis(nitrato-κ^2^O,O')lanthanum","","- C2 H16 La N11 O17 -","- C2 H16 La N11 O17 -","- C8 H64 La4 N44 O68 -","4","0.5","LH6290","Fowkes, Adrian; Harrison, William T. A.","Bis(guanidinium) diaquapentakis(nitrato-κ^2^O,O')lanthanum","Acta Crystallographica, Section E","2004","60","11","m1647","m1659","10.1107/S1600536804025255","","","0.71073","MoKα","","0.0389","0.0288","","","0.0441","0.0459","","","","","","0.91","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204541","8.0494","0.0012","6.4253","0.0009","12.95","0.002","90","","92.248","0.004","90","","669.26","0.17","105","2","105","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Ammonium L-alanyl-L-phenylalaninate","","- C12 H19 N3 O3 -","- C12 H19 N3 O3 -","- C24 H38 N6 O6 -","2","1","LH6291","Görbitz, Carl Henrik","Ammonium <small>L</small>-alanyl-<small>L</small>-phenylalaninate","Acta Crystallographica Section E","2004","60","11","o2065","o2067","10.1107/S1600536804025917","","","0.71073","MoKα","","0.0416","0.0326","","","0.077","0.0816","","","","","","1.025","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204542","30.241","0.009","7.441","0.002","16.29","0.007","90","","100.103","0.012","90","","3609","2","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","arjunglucoside I","β-D-Glucopyranosyl 2α,3β,19α,23-tetrahydroxyolean-12-en-28-oate","","- C36.25 H60.75 Cl0.25 O12 -","- C36.25 H60.75 Cl0.25 O12 -","- C145 H243 Cl O48 -","4","1","LH6299","Parvez, Masood; Atta-ur-Rahman; Choudhary, Iqbal M.; Zareen, Seema; Akhtar, Nadeem M.; Shujaat, Shahida; Ngounou, F. N.","Arjunglucoside I chloromethane 0.25-solvate monohydrate","Acta Crystallographica Section E","2004","60","11","o2130","o2132","10.1107/S1600536804026546","","","0.71073","MoKα","","0.054","0.043","","","0.108","0.115","","","","","","0.98","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204543","17.446","0.002","10.4855","0.0009","13.0224","0.0014","90","","110.304","0.011","90","","2234.2","0.4","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-[2-Ethoxy-2-(3-methyl-1-benzofuran-2-yl)ethyl]-4-(o-tolyl)piperazin-1-ium chloride","","- C24 H31 Cl N2 O2 -","- C24 H31 Cl N2 O2 -","- C96 H124 Cl4 N8 O8 -","4","1","NC6001","Kurfürst, Pavel; Marek, Jaromír; Vančo, Ján; Csöllei, Jozef","1-[2-Ethoxy-2-(3-methyl-1-benzofuran-2-yl)ethyl]-4-(<i>o</i>-tolyl)piperazin-1-ium chloride","Acta Crystallographica Section E","2004","60","11","o1989","o1991","10.1107/S1600536804024894","","","0.71073","MoKα","","0.0377","0.0329","","","0.0822","0.0848","","","","","","1.015","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204544","3.8132","0.0005","6.0226","0.0008","30.378","0.004","90","","92.5","0.02","90","","696.98","0.16","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3-fluoro-tolic acid","3-fluoro-4-methylbenzoic acid","","- C8 H7 F O2 -","- C8 H7 F O2 -","- C32 H28 F4 O8 -","4","1","NC6002","Batsanov, Andrei S.","3-Fluoro-4-methylbenzoic acid","Acta Crystallographica Section E","2004","60","11","o1948","o1949","10.1107/S1600536804024389","","","0.71073","MoKα","","0.06","0.0541","","","0.1533","0.1571","","","","","","1.118","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204545","11.4821","0.0002","7.2107","0.0001","18.2817","0.0003","90","","106.692","0.001","90","","1449.83","0.04","105","2","105","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","cytosine N-benzoylglycine monohydrate","","- C13 H16 N4 O5 -","- C13 H16 N4 O5 -","- C52 H64 N16 O20 -","4","1","NC6003","Görbitz, Carl Henrik; Sagstuen, Einar","Cytosinium <i>N</i>-benzoylglycinate monohydrate, a redetermination at 105K","Acta Crystallographica Section E","2004","60","11","o1945","o1947","10.1107/S160053680402447X","","","0.71073","MoKα","","0.0356","0.0333","","","0.0898","0.0919","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204546","10.051","0.002","10.176","0.002","11.762","0.002","90","","103.76","0.02","90","","1168.5","0.4","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-tert-Butyl-1-isopropyl-1H-imidazole-2(3H)-thione","4-tert-Butyl-1-isopropyl-1H-imidazole-2(3H)-thione","","- C10 H18 N2 S -","- C10 H18 N2 S -","- C40 H72 N8 S4 -","4","1","NC6005","Brito, Iván; Caŕdenas, Alejandro; Loṕez-Rodriǵuez, Matías; Cristian Gutieŕrez; Andrea Reyes","4-<i>tert</i>-Butyl-1-isopropyl-1<i>H</i>-imidazole-2(3<i>H</i>)-thione","Acta Crystallographica Section E","2004","60","11","o2127","o2129","10.1107/S1600536804026443","","","0.71073","MoKα","","","0.0608","","","","0.1965","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204547","9.066","0.003","12.924","0.004","17.854","0.006","84.894","0.005","80.659","0.005","84.306","0.005","2048.3","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Diaquatris(nicotinato-κO)bis(1,10-phenanthroline-κ^2^N,N')neodymium(III) trihydrate","","- C42 H38 N7 Nd O11 -","- C42 H38 N7 Nd O11 -","- C84 H76 N14 Nd2 O22 -","2","1","NG6050","Liu, Fu-Chen; Wang, Xiu-Li","Diaquatris(nicotinato-κ<i>O</i>)bis(1,10-phenanthroline-κ^2^<i>N,N</i>')neodymium(III) trihydrate","Acta Crystallographica Section E","2004","60","11","m1630","m1632","10.1107/S1600536804025383","","","0.71073","MoKα","","0.0388","0.0285","","","0.0539","0.061","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204548","11.876","0.004","9.379","0.003","13.889","0.005","90","","96.573","0.007","90","","1536.9","0.9","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(O,O'-dicyclohexyl dithiophosphato-κ^2^S,S')platinum(II)","","- C24 H44 O4 P2 Pt S4 -","- C24 H44 O4 P2 Pt S4 -","- C48 H88 O8 P4 Pt2 S8 -","2","0.5","NG6051","Fong Sheen Kuan; Tiekink, Edward R. T.","Bis(<i>O,O</i>'-dicyclohexyl dithiophosphato-κ^2^<i>S,S</i>')platinum(II)","Acta Crystallographica Section E","2004","60","11","m1619","m1620","10.1107/S1600536804025280","","","0.71069","MoKα","","0.045","0.034","","","0.079","0.085","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204549","8.1588","0.001","8.304","0.001","25.008","0.003","90","","93.956","0.002","90","","1690.3","0.4","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[μ-N,N-bis(2-hydroxyethyl)dithiocarbamato]- 1:2κ^3^S,S':S';2:1κ^3^S,S':S'-bis{[N,N-bis(2- hydroxyethyl)dithiocarbamato-κ^2^S,S']cadmium(II)}","","- C20 H40 Cd2 N4 O8 S8 -","- C20 H40 Cd2 N4 O8 S8 -","- C40 H80 Cd4 N8 O16 S16 -","2","0.5","NG6052","Zhong, Yun; Zhang,Weiguang; Fan, Jun; Tan, Mingyu; Chian, Sing Lai; Tiekink, Edward R. T.","Bis[μ-<i>N,N</i>-bis(2-hydroxyethyl)dithiocarbamato]-1:2κ^3^<i>S,S</i>':<i>S</i>';2:1κ^3^<i>S,S</i>':<i>S</i>'-bis{[<i>N,N</i>-bis(2-hydroxyethyl)dithiocarbamato-κ^2^<i>S,S</i>']cadmium(II)}","Acta Crystallographica Section E","2004","60","11","m1633","m1635","10.1107/S1600536804025395","","","0.71069","MoKα","","0.045","0.041","","","0.099","0.1","","","","","","1.33","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204550","10.0629","0.0008","12.402","0.0008","12.863","0.0008","92.241","0.005","110.245","0.005","99.343","0.007","1478.26","0.19","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(meso-5,7,7,12,14,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane- κ^4^N)nickel(II) [N,N-o-phenylenebis(oxamato)-κ^4^O,N,N',O']cuprate(II) dihydrate","","- C26 H44 Cu N6 Ni O8 -","- C26 H43 Cu N6 Ni O8 -","- C52 H86 Cu2 N12 Ni2 O16 -","2","1","NG6053","Gao, En-Qing","(<i>meso</i>-5,7,7,12,14,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>)nickel(II) [<i>N</i>,<i>N</i>-<i>o</i>-phenylenebis(oxamato)-κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>']cuprate(II) dihydrate","Acta Crystallographica Section E","2004","60","11","m1700","m1702","10.1107/S1600536804026315","","","0.71073","MoKα","","0.055","0.029","","","0.0598","0.0843","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204551","6.924","0.0002","14.046","0.0004","13.056","0.0004","90","","96.562","0.001","90","","1261.44","0.06","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(2,2'-Bipyridine)dichlorogold(III) nitrate","","- C10 H8 Au Cl2 N3 O3 -","- C10 H8 Au Cl2 N3 O3 -","- C40 H32 Au4 Cl8 N12 O12 -","4","0.5","NG6054","Bjernemose, Jens K.; Raithby, Paul R.; Toftlund, Hans","(2,2'-Bipyridine)dichlorogold(III) nitrate","Acta Crystallographica Section E","2004","60","11","m1719","m1721","10.1107/S1600536804026558","","","0.71073","MoKα","","0.0351","0.0262","","","0.0502","0.0526","","","","","","1.064","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204552","6.8865","0.0006","9.9508","0.0006","11.6702","0.0008","65.397","0.004","88.452","0.006","86.194","0.006","725.51","0.09","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","3-(4-Bromophenyl)-2,2-dimethyl-2,3-dihydroquinazolin-4(1H)-one","","- C16 H15 Br N2 O -","- C16 H15 Br N2 O -","- C32 H30 Br2 N4 O2 -","2","1","OB6417","Daqing Shi; Zhengyi Li; Chunling Shi; Qiya Zhuang; Yong Zhang","3-(4-Bromophenyl)-2,2-dimethyl-2,3-dihydroquinazolin-4(1<i>H</i>)-one","Acta Crystallographica Section E","2004","60","11","o1992","o1994","10.1107/S1600536804025115","","","0.7107","MoKα","","0.0312","0.0274","","","0.0667","0.0685","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204553","9.788","0.002","13.142","0.003","10.114","0.002","90","","111.329","0.004","90","","1211.9","0.4","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(4-Chlorophenyl)-3,4-dihydroquinazolin-2(1H)-one","","- C14 H11 Cl N2 O -","- C14 H11 Cl N2 O -","- C56 H44 Cl4 N8 O4 -","4","1","OB6418","Daqing Shi; Zhengyi Li; Chunling Shi; Xiangshan Wang; Yong Zhang","3-(4-Chlorophenyl)-3,4-dihydroquinazolin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2004","60","11","o2011","o2013","10.1107/S1600536804025218","","","0.7107","MoKα","","0.0402","0.0372","","","0.0934","0.096","","","","","","1.083","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204554","9.2879","0.0012","10.4526","0.0012","11.0678","0.001","63.905","0.01","75.826","0.014","80.288","0.015","933.3","0.2","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","2-Amino-3-cyano-4-(2,4-dichlorophenyl)-8-methylpyrano[3,2-c]pyran-5(4H)-one ethanol solvate","","- C18 H16 Cl2 N2 O4 -","- C18 H11 Cl2 N2 O4 -","- C36 H22 Cl4 N4 O8 -","2","1","OB6419","Daqing Shi; Lihui Niu; Xiangshan Wang; Qiya Zhuang; Yong Zhang","2-Amino-3-cyano-4-(2,4-dichlorophenyl)-8-methylpyrano[3,2-<i>c</i>]pyran-5(4<i>H</i>)-one ethanol solvate","Acta Crystallographica Section E","2004","60","11","o1995","o1997","10.1107/S1600536804025127","","","0.7107","MoKα","","0.0565","0.0497","","","0.1409","0.1469","","","","","","1.084","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204555","8.9157","0.001","11.256","0.0013","21.496","0.003","90","","97.37","0.003","90","","2139.4","0.5","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","9-Chloro-2,3-diphenyl-5,6-dihydroimidazo[1,2-c]quinazolin-5-one N,N-dimethylformamide solvate","","- C25 H21 Cl N4 O2 -","- C25 H21 Cl N4 O2 -","- C100 H84 Cl4 N16 O8 -","4","1","OB6420","Da-Qing Shi; Zheng-Yi Li; Chun-Ling Shi; Qi-Ya Zhuang; Xiang-Shan Wang; Yong Zhang","9-Chloro-2,3-diphenyl-5,6-dihydroimidazo[1,2-<i>c</i>]quinazolin-5-one <i>N</i>,<i>N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2004","60","11","o2032","o2034","10.1107/S1600536804025553","","","0.7107","MoKα","","0.0552","0.0464","","","0.1074","0.1124","","","","","","1.099","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204556","13.592","0.003","7.5178","0.0015","29.233","0.006","90","","90.69","0.03","90","","2986.9","1.1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Aquabis(9-hydroxyfluorene-9-carboxylato)(methanol)copper(II) methanol disolvate","","- C31 H32 Cu O10 -","- C31 H32 Cu O10 -","- C124 H128 Cu4 O40 -","4","1","OB6425","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui","Aquabis(9-hydroxyfluorene-9-carboxylato)(methanol)copper(II) methanol disolvate","Acta Crystallographica Section E","2004","60","11","m1725","m1727","10.1107/S1600536804026716","","","0.71073","MoKα","","0.073","0.057","","","0.144","0.154","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204557","7.4427","0.0013","7.5697","0.0013","8.249","0.0014","83.27","0.002","67.445","0.002","65.599","0.002","390.39","0.12","90","0.2","90","0.2","","","","","","","","3","P -1","-P 1","2","dithiocoumarin","2H-thiochromene-2-thione","","- C9 H6 S2 -","- C9 H6 S2 -","- C18 H12 S4 -","2","1","OB6428","Munshi, Parthapratim; Guru Row, T. N.","2<i>H</i>-Thiachromene-2-thione","Acta Crystallographica Section E","2004","60","11","o2168","o2170","10.1107/S1600536804026984","","","0.71073","MoKα","","0.0284","0.0271","","","0.0761","0.0771","","","","","","1.074","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204558","14.7961","0.001","12.4953","0.0008","14.5148","0.001","90","","110.091","0.001","90","","2520.2","0.3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dibromobis(methyldiphenylphosphine)nickel(II)","","- C26 H26 Br2 Ni P2 -","- C26 H26 Br2 Ni P2 -","- C104 H104 Br8 Ni4 P8 -","4","0.5","RN6024","Zeller, Matthias; DiMuzio, Steven J.; Hunter, Allen D.","Dibromobis(methyldiphenylphosphine)nickel(II)","Acta Crystallographica Section E","2004","60","11","m1595","m1596","10.1107/S1600536804024675","","","0.71073","MoKα","","0.0242","0.0216","","","0.0561","0.0573","","","","","","1.065","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204559","11.928","0.0001","11.012","0.0001","28.17","0.0003","90","","92.654","0.001","90","","3696.19","0.06","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-[(E)-2-Phenylethen-1-yl]quinolin-8-ol","","- C17 H13 N O -","- C17 H13 N O -","- C204 H156 N12 O12 -","12","3","RN6027","Bjernemose, Jens K.; Less, Robert J.; Raithby, Paul R.","5-[(<i>E</i>)-2-Phenylethen-1-yl]quinolin-8-ol","Acta Crystallographica Section E","2004","60","11","o1981","o1983","10.1107/S1600536804025012","","","0.71069","MoKα","","0.0981","0.0518","","","0.1214","0.1421","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204560","6.1266","0.0002","6.7254","0.0002","13.8419","0.0005","90","","99.6456","0.0014","90","","562.28","0.03","150","","150","","","","","","","","","4","P 1 21 1","P 2yb","4","","5-Amino-5-deoxy-2-C-hydroxymethyl-2,3-O-isopropylidene-D-talono-1,5-lactam","","- C10 H17 N O6 -","- C10 H17 N O6 -","- C20 H34 N2 O12 -","2","1","RZ6003","Ameijde, Jeroen van; Cowley, Andrew R.; Fleet, George W. J.; Nash, Robert J.; Iezzi Simone, Michela; Soengas, Raquel","5-Amino-5-deoxy-2-<i>C</i>-hydroxymethyl-2,3-<i>O</i>-isopropylidene-<small>D</small>-talono-1,5-lactam","Acta Crystallographica Section E","2004","60","11","o2140","o2141","10.1107/S1600536804025292","","","0.71073","MoKα","","0.0334","0.0276","","0.0352","0.0343","0.0343","","","","","","1.0968","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204561","6.4765","0.0002","13.2189","0.0002","25.7075","0.0006","90","","90","","90","","2200.88","0.09","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,2:5,6-Di-O-isopropylidene-2-C-hydroxymethyl-D-glucono-1,4-lactone","","- C19 H34 O7 Si -","- C19 H34 O7 Si -","- C76 H136 O28 Si4 -","4","1","RZ6004","Cowley, Andrew R.; Fleet, George W. J.; Iezzi Simone, Michela; Soengas, Raquel","3-<i>O</i>-<i>tert</i>-Butyldimethylsilyl-2,2':5,6-di-<i>O</i>-isopropylidene-2-<i>C</i>-hydroxymethyl-<small>D</small>-1,4-gluconolactone","Acta Crystallographica Section E","2004","60","11","o2142","o2143","10.1107/S1600536804025310","","","0.71073","MoKα","","0.048","0.0373","","0.0446","0.0396","0.0396","","","","","","1.1144","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204562","14.9344","0.0012","9.216","0.0006","30.256","0.003","90","","97.811","0.002","90","","4125.7","0.6","193.15","","193.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(1H-benzotriazole-κN^3^)bis(isothiocyanato-κN)zinc(II) 1H-benzotriazole hemisolvate","","- C17 H12.5 N9.5 S2 Zn -","- C17 H12.5 N9.5 S2 Zn -","- C136 H100 N76 S16 Zn8 -","8","2","RZ6005","Ai-Hua Yuan; Hu Zhou","Bis(1<i>H</i>-benzotriazole-κ<i>N</i>^3^)bis(isothiocyanato-κ<i>N</i>)zinc(II) 1<i>H</i>-benzotriazole hemisolvate","Acta Crystallographica Section E","2004","60","11","m1565","m1567","10.1107/S1600536804023475","","","0.71073","MoKα","","0.0623","0.0488","","","0.096","0.1026","","","","","","1.09","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204563","8.2446","0.0005","8.2446","0.0005","25.088","0.004","90","","90","","90","","1705.3","0.3","293","2","293","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","(-)-α-isosparteine copper(II) dinitrite","[(6R,7S,8S,14R)-(-)-α-Isosparteine-κ^2^N,N']bis(nitrito-κ^2^O,O')copper(II)","","- C15 H26 Cu N4 O4 -","- C15 H26 Cu N4 O4 -","- C60 H104 Cu4 N16 O16 -","4","0.5","RZ6006","Shim, Yoon-Bo; Choi, Sung-Nak; Lee, Seung Jae; Kang, Sung Kwon; Lee, Yong-Min","[(6<i>R</i>,7<i>S</i>,8<i>S</i>,14<i>R</i>)-(‒)-α-Isosparteine-κ^2^<i>N</i>,<i>N</i>']bis(nitrito-κ^2^<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section E","2004","60","11","m1573","m1575","10.1107/S1600536804024249","","","0.71073","MoKα","","0.0693","0.0398","","","0.0748","0.0827","","","","","","1.003","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204564","7.508","0.002","7.605","0.002","16.271","0.003","79.23","0.03","81.42","0.03","68.91","0.03","848.1","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(4-Fluorobenzoyl)(1H-1,2,4-triazol-1-yl)methyl morpholine-4-carbodithioate","","- C15 H15 F N4 O2 S2 -","- C15 H15 F N4 O2 S2 -","- C30 H30 F2 N8 O4 S4 -","2","1","RZ6007","Liangzhong Xu; Chongyi Zhu; Yongqi Qin; Guanping Yu; Guodong Si","(4-Fluorobenzoyl)(1<i>H</i>-1,2,4-triazol-1-yl)methyl morpholine-4-carbodithioate","Acta Crystallographica Section E","2004","60","11","o2099","o2100","10.1107/S1600536804026017","","","0.71073","MoKα","","0.1083","0.0529","","","0.0955","0.1119","","","","","","1.004","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204565","17.96","0.004","5.723","0.001","20.419","0.004","90","","99.72","0.02","90","","2068.6","0.7","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","N,N'-Di-2-pyridylmethylenediamine","","- C11 H12 N4 -","- C11 H12 N4 -","- C88 H96 N32 -","8","1","RZ6008","Wu, Hui; Zhou, Jun; Yu, Hui-Zhen; Lu, Lei-Lei; Xu, Zhou; Yu, Kai-Bei; Shi, Da-Qing","<i>N</i>,<i>N</i>'-Di-2-pyridylmethylenediamine","Acta Crystallographica Section E","2004","60","11","o2085","o2086","10.1107/S1600536804025929","","","0.71073","MoKα","","0.0792","0.0393","","","0.0788","0.088","","","","","","0.812","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204566","13.534","0.003","5.071","0.001","21.294","0.006","90","","128.31","0.02","90","","1146.7","0.6","293","2","293","2","","","","","","","","5","P 1 c 1","P -2yc","7","","(1H-Benzimidazole-κN^3^)[3-methoxysalicylaldehyde (4-methoxybenzoyl)hydrazonato-κ^3^O,N,O']copper(II) methanol solvate","","- C24 H24 Cu N4 O5 -","- C24 H24 Cu N4 O5 -","- C48 H48 Cu2 N8 O10 -","2","1","RZ6009","Zhang, Xian-Fa; Gao, Shan; Huo, Li-Hua; Zhao, Hui","(1<i>H</i>-Benzimidazole-κ<i>N</i>^3^)[3-methoxysalicylaldehyde (4-methoxybenzoyl)hydrazonato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']copper(II) methanol solvate","Acta Crystallographica Section E","2004","60","11","m1675","m1677","10.1107/S1600536804026169","","","0.71073","MoKα","","0.05","0.039","","","0.085","0.089","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204567","17.617","0.004","8.363","0.003","23.099","0.004","90","","96.695","0.011","90","","3380","1.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis[μ-3-(hydroxyimino)butan-2-one benzoylhydrazonato]bis[pyridinecopper(II)] methanol solvate","","- C33 H36 Cu2 N8 O5 -","- C33 H36 Cu2 N8 O5 -","- C132 H144 Cu8 N32 O20 -","4","0.5","SJ6009","Huo, Li-Hua; Lu, Zhen-Zhong; Gao, Shan; Zhao, Hui; Ng, Seik Weng","Bis[μ-3-(hydroxyimino)butan-2-one benzoylhydrazonato]bis[pyridinecopper(II)] methanol solvate","Acta Crystallographica Section E","2004","60","11","m1611","m1613","10.1107/S1600536804024523","","","0.71073","MoKα","","0.0906","0.0511","","","0.108","0.1218","","","","","","1.005","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204568","8.7678","0.0005","17.6042","0.0009","17.973","0.0009","90","","90","","90","","2774.1","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4-Methoxybenzaldehyde 4-(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)thiosemicarbazone","","- C23 H29 N3 O10 S -","- C23 H29 N3 O10 S -","- C92 H116 N12 O40 S4 -","4","1","SJ6012","Shu-Sheng Zhang; Bo Yang; Ji-Zhi Li; Qing Liu; Xue-Mei Li; Kui Jiao; M. Kassim; Yamin, Bohari. M.","4-Methoxybenzaldehyde 4-(2,3,4,6-tetra-<i>O</i>-acetyl-β-<small>D</small>-glucopyranosyl)thiosemicarbazone","Acta Crystallographica Section E","2004","60","11","o2050","o2052","10.1107/S1600536804025589","","","0.71073","MoKα","","0.1674","0.0722","","","0.1755","0.2164","","","","","","0.977","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204569","6.978","0.003","7.298","0.003","16.064","0.007","77.05","0.006","83.614","0.006","86.078","0.007","791.5","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N-phenylethyl-N'-[3-(trifluoromethyl)phenyl]thiourea","","- C16 H15 F3 N2 S -","- C16 H15 F3 N2 S -","- C32 H30 F6 N4 S2 -","2","1","SJ6015","Chopra, Deepak; Choudhury, A. R.; Nagarajan, K.; Guru Row, T. N.","<i>N</i>-Phenylethyl-<i>N</i>'-[3-(trifluoromethyl)phenyl]thiourea","Acta Crystallographica Section E","2004","60","11","o1970","o1971","10.1107/S1600536804024961","","","0.71073","MoKα","","0.1546","0.0887","","","0.1649","0.1861","","","","","","1.143","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204570","16.8495","0.0009","12.1086","0.0009","12.357","0.0007","90","","90","","90","","2521.1","0.3","293","","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","trans,trans,trans-2,3,5,8-Tetrabromo-1,4-dihydroxy-1,2,3,4- tetrahydronaphthalene","","- C10 H8 Br4 O2 -","- C10 H8 Br4 O2 -","- C80 H64 Br32 O16 -","8","1","SJ6017","Mehmet Akkurt; Ísmail Çelik; Ramazan Erenler; Osman Çakmak; Cem Cüneyt Ersanlı; Orhan Büyükgüngör","<i>trans,trans,trans</i>-2,3,5,8-Tetrabromo-1,4-dihydroxy-1,2,3,4-tetrahydronaphthalene","Acta Crystallographica Section E","2004","60","11","o2096","o2098","10.1107/S1600536804026042","","","0.71073","MoKα","","0.0724","0.0416","","","0.0732","0.0818","","","","","","1.016","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204571","7.7625","0.0014","11.2496","0.0019","17.542","0.003","90","","90","","90","","1531.9","0.5","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1,1,1-Tris[(pyrrol-1-yl)methyl]ethane","","- C17 H21 N3 -","- C17 H21 N3 -","- C68 H84 N12 -","4","1","SU6135","Wei Xu; Yin-Xiang Lu; Zhen-Guang Zou; Chun-Ming Liu; Bi-Jian Lan; Hui Zhou","1,1,1-Tris[(pyrrol-1-yl)methyl]ethane: herring-bone packing of supramolecular assemblies in a homochiral crystal from chemically symmetric molecules","Acta Crystallographica Section E","2004","60","11","o2171","o2173","10.1107/S1600536804027011","","","0.71073","MoKα","","0.0622","0.057","","","0.1346","0.1379","","","","","","1.172","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204572","3.66","0.001","14.252","0.002","11.447","0.001","90","","98.09","0.01","90","","591.16","0.19","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Formyl-2-furanboronic acid","","- C5 H5 B O4 -","- C5 H5 B O4 -","- C20 H20 B4 O16 -","4","1","SU6141","Zarychta, Bartosz; Ejsmont, Krzysztof; Bujak, Maciej; Zaleski, Jacek; Sporzyński, Andrzej; Miśkiewicz, Agnieszka; Strutyńska, Agata; Serwatowski, Janusz","3-Formyl-2-furanboronic acid: X-ray and DFT studies","Acta Crystallographica Section E","2004","60","11","o1925","o1927","10.1107/S1600536804023293","","","0.71073","MoKα","","0.0542","0.0429","","","0.1009","0.1056","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204573","23.142","0.012","12.221","0.006","12.031","0.006","90","","94.484","0.009","90","","3392","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","cis-meso-rac-[1,3-Bis(butylsulfanyl)propane-κ^2^S,S']dichloropalladium(II)","","- C11 H24 Cl2 Pd S2 -","- C11 H24 Cl2 Pd S2 -","- C88 H192 Cl16 Pd8 S16 -","8","2","SU6145","Chen, Wei; Wang, Jing-Kang; Li, Hong","<i>cis</i>-[1,3-Bis(butylsulfanyl)propane-κ^2^<i>S</i>,<i>S</i>']dichloropalladium(II): <i>meso</i> and <i>rac</i> forms in the same crystal structure","Acta Crystallographica Section E","2004","60","11","m1656","m1658","10.1107/S1600536804025735","","","0.71073","MoKα","","0.1091","0.0464","","","0.1018","0.1323","","","","","","1.084","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204574","12.767","0.003","7.346","0.002","13.133","0.005","90","","90.66","0.03","90","","1231.6","0.6","298","1","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C32 H22 Cu N4 O2 -","- C32 H22 Cu N4 O2 -","- C64 H44 Cu2 N8 O4 -","2","0.5","TK6188","Akitsu, Takashiro; Einaga, Yasuaki","Bis[2-(quinolin-3-yliminomethyl)phenolato-κ^2^<i>N,O</i>]copper(II)","Acta Crystallographica Section E","2004","60","11","m1552","m1554","10.1107/S1600536804023591","","","0.7107","MoKα","","","0.039","","","","0.112","","","","","","0.998","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204575","15.7845","0.0016","10.09","0.0013","18.629","0.003","90","","90","","90","","2967","0.7","296","1","296","1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Se-Phenyl 3-(1H-indol-3-yl)selenoacrylate","","- C17 H13 N O Se -","- C17 H13 N O Se -","- C136 H104 N8 O8 Se8 -","8","1","TK6191","Meza, Rosa-Luisa; Quintero, Leticia; Bernès, Sylvain","<i>Se</i>-Phenyl 3-(1<i>H</i>-indol-3-yl)selenoacrylate","Acta Crystallographica Section E","2004","60","11","o1961","o1963","10.1107/S1600536804024687","","","0.71073","MoKα","","0.121","0.045","","","0.086","0.108","","","","","","0.97","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204576","9.511","0.003","11.496","0.003","11.528","0.004","90","","125.287","0.005","90","","1028.9","0.6","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","catena-poly[[[tetraaquacobalt(II)]-μ-4,4-bipyridine-κ^2^N:N'] phthalate dihydrate]","","- C18 H24 Co N2 O10 -","- C18 H24.04 Co N2 O10 -","- C36 H48.08 Co2 N4 O20 -","2","0.5","WK6022","Xie, Cheng-Zhi; Zhang, Bao-Feng; Wang, Xiao-Qing; Shen, Guang-Qiu; Shen, De-Zhong","<i>catena</i>-poly[[[tetraaquacobalt(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] phthalate dihydrate]","Acta Crystallographica Section E","2004","60","11","m1703","m1705","10.1107/S1600536804025930","","","0.71073","MoKα","","0.052","0.036","","","0.078","0.084","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204577","5.7451","0.0005","9.157","0.0009","9.6247","0.0009","89.002","0.002","76.222","0.002","77.478","0.002","479.76","0.08","150","2","150","2","","","","","","","","4","P -1","-P 1","2","Quinol‒Pyridine","Quinol‒Pyridine (1/1)","","- C11 H11 N O2 -","- C11 H11 N O2 -","- C22 H22 N2 O4 -","2","1","WK6031","Iain D. H. Oswald; W. D. Sam Motherwell; Simon Parsons","A 1:1 co-crystal of quinol and pyridine","Acta Crystallographica Section E","2004","60","11","o1967","o1969","10.1107/S1600536804024547","","","0.71073","MoKα","","0.058","0.048","","","0.113","0.12","","","","","","1.039","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204578","7.7792","0.0003","8.7583","0.0003","10.2481","0.0002","71.159","0.002","69.668","0.002","67.949","0.001","591.76","0.03","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","trans-Tetrakis(3-aminopyridine)dichlorocadmium(II)","","- C20 H24 Cd Cl2 N8 -","- C20 H24 Cd Cl2 N8 -","- C20 H24 Cd Cl2 N8 -","1","0.5","WK6033","He, Xiang; Lu, Can-Zhong; Yu, Ya-Qin; Chen, Shu-Mei; Xiao-Yuan Wu; Liu, Jiu-Hui","<i>trans</i>-Tetrakis(3-aminopyridine)dichlorocadmium(II)","Acta Crystallographica Section E","2004","60","11","m1639","m1640","10.1107/S1600536804025450","","","0.71073","MoKα","","0.0297","0.0285","","","0.1009","0.1059","","","","","","0.989","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204579","11.4935","0.0019","11.4717","0.0019","6.5297","0.0011","90","","90","","90","","860.9","0.2","293","2","293","2","","","","","","","","4","P n n 2","P 2 -2n","34","","Dilead pentaborate bromide","","- B5 Br O9 Pb2 -","- B5 Br O9 Pb2 -","- B20 Br4 O36 Pb8 -","4","1","WM6030","Yakubovich, Olga V.; Mochenova, Natalya N.; Dimitrova, Olga. V.; Massa, Werner","Reinvestigation of the Pb~2~[B~5~O~9~]Br structure based on single-crystal data","Acta Crystallographica, Section E","2004","60","11","i127","i130","10.1107/S1600536804023232","","","0.71073","MoKα","","0.0383","0.0344","","","0.0776","0.0803","","","","","","1.064","","","","has coordinates","282068","2023-03-26","10:12:36",""
"2204580","6.283","0.0009","8.0331","0.0006","7.8406","0.0007","90","","93.7","0.01","90","","394.91","0.07","293","2","293","2","","","","","","","","3","I 1 2/a 1","-I 2ya","","Europium(III) trioxoborate","Europium(III) trioxoborate","","- B3 Eu O6 -","- B3 Eu O6 -","- B12 Eu4 O24 -","4","0.5","WM6032","Goriounova, Alexandra; Held, Peter; Becker, Petra; Bohatý, Ladislav","Europium triborate, EuB~3~O~6~","Acta Crystallographica, Section E","2004","60","11","i131","i133","10.1107/S1600536804024353","","","0.71073","MoKα","","0.0497","0.0473","","","0.1048","0.1065","","","","","","1.089","","","","has coordinates","282068","2023-03-26","10:12:36",""
"2204581","6.4468","0.0002","8.1266","0.0003","7.93","0.0002","90","","93.639","0.006","90","","414.62","0.02","293","2","293","2","","","","","","","","3","I 1 2/a 1","-I 2ya","","Cerium(III) trioxoborate","Cerium(III) trioxoborate","","- B3 Ce O6 -","- B3 Ce O6 -","- B12 Ce4 O24 -","4","0.5","WM6033","Goriounova, Alexandra; Held, Peter; Becker, Petra; Bohatý, Ladislav","Cerium triborate, CeB~3~O~6~","Acta Crystallographica, Section E","2004","60","11","i134","i135","10.1107/S1600536804024365","","","0.71073","MoKα","","0.0315","0.0311","","","0.0857","0.0862","","","","","","1.191","","","","has coordinates","282068","2023-03-26","10:12:38",""
"2204582","9.6054","0.0006","6.9863","0.0005","12.2557","0.001","90","","90","","90","","822.43","0.1","150","2","150","2","","","","","","","","4","P n m a","-P 2ac 2n","62","diammonium tetrathiotungstate","","","- H8 N2 S4 W -","- H8 N2 S4 W -","- H32 N8 S16 W4 -","4","0.5","WM6034","Srinivasan, Bikshandarkoil R.; Poisot, Martha; Näther, Christian; Bensch, Wolfgang","Diammonium tetrathiotungstate(VI), (NH~4~)~2~[WS~4~], at 150K","Acta Crystallographica Section E","2004","60","11","i136","i138","10.1107/S1600536804023761","","","0.71073","MoKα","","0.0204","0.0183","","","0.047","0.0479","","","","","","1.097","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204583","11.63","0.006","10.02","0.004","16.3","0.01","90","","109.84","0.04","90","","1786.7","1.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-Bromo-1,3-dichloro-2-iodobenzene","","- C6 H2 Br Cl2 I -","- C6 H2 Br Cl2 I -","- C48 H16 Br8 Cl16 I8 -","8","2","WN6282","M. Arun Prasad; Babu Varghese; M. V. Sangaranarayanan","5-Bromo-1,3-dichloro-2-iodobenzene","Acta Crystallographica Section E","2004","60","11","o1933","o1934","10.1107/S160053680402392X","","","0.71073","MoKα","","0.0848","0.0572","","","0.1435","0.147","","","","","","0.922","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204584","10.904","0.004","8.67","0.003","35.271","0.013","90","","90","","90","","3334","2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-Fluoro-N-[7-fluoro-3,4-dihydro-2-methyl-3-oxo-4-(prop-2-ynyl)- 2H-1,4-benzoxazin-6-yl]benzamide","","- C19 H14 F2 N2 O3 -","- C19 H14 F2 N2 O3 -","- C152 H112 F16 N16 O24 -","8","1","WN6284","Hou, Zhong-Ke; Ao, Cong-Cong; Song, Jian; Chen, Li-Gong","2-Fluoro-<i>N</i>-[7-fluoro-3,4-dihydro-2-methyl-3-oxo-4-(prop-2-ynyl)-2<i>H</i>-1,4-benzoxazin-6-yl]benzamide","Acta Crystallographica Section E","2004","60","11","o1957","o1958","10.1107/S1600536804024304","","","0.71073","MoKα","","0.0907","0.0543","","","","0.1371","","","","","","1.111","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204585","7.6623","0.0012","11.1298","0.0018","13.35","0.002","90","","100.547","0.003","90","","1119.3","0.3","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","7-Oxogedunin","1-(3-furyl)-4b,7,7,10a,12a-pentamethyl-1,6a,7,10a,10b,11,12,12a- octahydronaphtho[2,1-f]oxireno[2,3-d]isochromene-3,5,8(3aH,4bH,6H)-trione","","- C26 H30 O6 -","- C26 H30 O6 -","- C52 H60 O12 -","2","1","WN6285","Watcharee Waratchareeyakul; Suchada Chantrapromma; Hoong-Kun Fun; Ibrahim Abdul Razak; Chatchanok Karalai; Chanita Ponglimanont","7-Oxogedunin","Acta Crystallographica Section E","2004","60","11","o1964","o1966","10.1107/S160053680402450X","","","0.71073","MoKα","","0.0551","0.0473","","","0.1067","0.1102","","","","","","1.112","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204586","5.0299","0.0012","9.777","0.002","28.007","0.008","90","","90","","90","","1377.3","0.6","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","9-(3-pyridylmethyl)carbazole","","- C18 H14 N2 -","- C18 H14 N2 -","- C72 H56 N8 -","4","1","WN6287","Duan, Xue-Min; Chen, Li-Gong; Xu, Yan-Jie; Li, Yang; Han, Juan; Li, Le-Ping","9-(3-Pyridylmethyl)carbazole","Acta Crystallographica Section E","2004","60","11","o1931","o1932","10.1107/S1600536804024444","","","0.71073","MoKα","","0.0598","0.0396","","","0.0876","0.0961","","","","","","1.068","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204587","20.779","0.008","15.097","0.006","7.317","0.003","90","","96.624","0.007","90","","2280","1.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-[4-(benzyloxy)phenyl]-5-(3,4-dimethoxyphenyl)-3,4-dimethylthiophene","","- C27 H26 O3 S -","- C27 H26 O3 S -","- C108 H104 O12 S4 -","4","1","WN6288","Shi, Ji-Xian; Zheng, Xiu-Fang; Zhu, Ke; Lei, Ying-Jie; Shi, Ji-Guang","2-[4-(Benzyloxy)phenyl]-5-(3,4-dimethoxyphenyl)-3,4-dimethylthiophene","Acta Crystallographica Section E","2004","60","11","o1977","o1978","10.1107/S1600536804024936","","","0.71073","MoKα","","0.1105","0.0574","","","0.1423","0.1778","","","","","","1.066","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2204588","7.467","0.003","16.753","0.006","8.606","0.003","90","","101.587","0.007","90","","1054.6","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,6-Bis(1-phenyl-1H-tetrazol-5-ylsulfanyl)hexane","","- C20 H22 N8 S2 -","- C20 H22 N8 S2 -","- C40 H44 N16 S4 -","2","0.5","WN6289","Wang, Wei; Liu, Hui-Min; Zhang, Wen-Qin","1,6-Bis(1-phenyl-1<i>H</i>-tetrazol-5-ylsulfanyl)hexane","Acta Crystallographica Section E","2004","60","11","o1979","o1980","10.1107/S1600536804024948","","","0.71073","MoKα","","0.1008","0.0495","","","","0.1101","","","","","","0.999","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204589","11.262","0.003","7.6872","0.0019","16.54","0.004","90","","93.26","0.02","90","","1429.6","0.6","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","tlatlancuayin","2',5-dimethoxy-6,7-methylenedioxyisoflavone","","- C18 H14 O6 -","- C18 H14 O6 -","- C72 H56 O24 -","4","1","WN6290","Vašinová, Marie; Marek, Jaromír; Vančo, Ján; Suchý, Václav","Tlatlancuayin","Acta Crystallographica Section E","2004","60","11","o2019","o2021","10.1107/S160053680402536X","","","0.71073","MoKα","","0.043","0.0364","","","0.0902","0.0949","","","","","","0.997","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204590","8.0627","0.0003","5.6494","0.0002","26.7944","0.0011","90","","94.13","0.001","90","","1217.3","0.08","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H14 O3 -","- C15 H14 O3 -","- C60 H56 O12 -","4","1","WN6292","Mughal, Robila K.; Pritchard, Robin G.; Davey, Roger J.","(<i>RS</i>)-Benzyl mandelate","Acta Crystallographica Section E","2004","60","11","o1984","o1986","10.1107/S1600536804025024","","","0.71073","MoKα","","0.0665","0.0387","","","0.0799","0.0893","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204591","5.579","0.002","7.857","0.003","20.59","0.007","84.044","0.005","87.89","0.006","89.572","0.006","897.1","0.6","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","1,8-Bis(phenylthio)octane","","- C20 H26 S2 -","- C20 H26 S2 -","- C40 H52 S4 -","2","1","WN6295","Chen, Wei; Yin, Qiu-Xiang; Xie, Chuang; Wang, Jing-Kang; Li, Hong","1,8-Bis(phenylsulfanyl)octane","Acta Crystallographica Section E","2004","60","11","o2147","o2148","10.1107/S1600536804026893","","","0.71073","MoKα","","0.0838","0.0522","","","0.1159","0.1315","","","","","","1.042","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204592","16.6609","0.0001","10.4558","0.0009","17.4457","0.0002","90","","116.589","0.001","90","","2717.7","0.2","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5''-Benzylidene-1',1''-dimethyl-4'-phenyl-acenapthene-2-spiro-2'- pyrrolidine-3'-spiro-3''-piperidine-1,4''-dione","","- C34 H30 N2 O2 -","- C34 H30 N2 O2 -","- C136 H120 N8 O8 -","4","1","WN6297","P. G. Aravindan; S. Selvanayagam; D. Velmurugan; K. Ravikumar; Gowri Sridhar; R. Raghunathan","5''-Benzylidene-1',1''-dimethyl-4'-phenylacenapthene-2-spiro-2'-pyrrolidine-3'-spiro-3''-piperidine-1,4''-dione","Acta Crystallographica Section E","2004","60","11","o2149","o2151","10.1107/S160053680402690X","","","0.71073","MoKα","","0.107","0.0702","","","0.15","0.1672","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204593","18.1752","0.0001","13.6193","0.0009","18.487","0.0001","90","","90","","90","","4576.2","0.3","273","2","273","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1'-Methyl-4'-phenyl-9H-fluorene-9-spiro-3'-pyrrolidine-2'-spiro-3''- 1H-indol-2''(3''H)-one","","- C30 H24 N2 O -","- C30 H24 N2 O -","- C240 H192 N16 O8 -","8","1","WN6298","P.G.Aravindan; S.Selvanayagam; D.Velmurugan; K.Ravikumar; J. Jayashankaran; R.Raghunathan","1'-Methyl-4'-phenyl-<i>H</i>-fluorene-9-spiro-3'-pyrrolidine-2'-spiro-3''-1<i>H</i>-indol-2''(3''<i>H</i>)-one","Acta Crystallographica Section E","2004","60","11","o2152","o2154","10.1107/S1600536804026911","","","0.71073","MoKα","","0.1226","0.0805","","","0.1596","0.1786","","","","","","1.124","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204594","8.5494","0.0009","9.5609","0.001","27.627","0.003","90","","98.78","0.002","90","","2231.8","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Benzyl 3,5-bis(1H-benzotriazol-1-ylmethyl)phenyl ether","","- C27 H22 N6 O -","- C27 H22 N6 O -","- C108 H88 N24 O4 -","4","1","WN6299","S. Selvanayagam; D. Velmurugan; K. Ravikumar; M. Dhanasekaran; P. Rajakumar","Benzyl 3,5-bis(1<i>H</i>-benzotriazol-1-ylmethyl)phenyl ether","Acta Crystallographica Section E","2004","60","11","o2165","o2167","10.1107/S1600536804027138","","","0.71073","MoKα","","0.0663","0.0493","","","0.1198","0.1301","","","","","","1.015","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204595","16.396","0.004","31.633","0.008","7.1438","0.0019","90","","90","","90","","3705.2","1.6","120","2","120","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","1-Benzylsulfanyl-2-(benzylsulfanylmethyl)propanaminium chloride","","- C18 H24 Cl N S2 -","- C18 H24 Cl N S2 -","- C144 H192 Cl8 N8 S16 -","8","2","YA6215","Cline, Daniel J.; Schnieder, Joel P.; Thorpe, Colin; Yap, Glenn P. A.","1-Benzylsulfanyl-2-(benzylsulfanylmethyl)propanaminium chloride","Acta Crystallographica Section E","2004","60","11","o1972","o1974","10.1107/S1600536804024924","","","0.71073","MoKα","","0.05","0.048","","","0.125","0.127","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204596","16.6732","0.0018","16.674","0.002","39.267","0.008","90","","90","","90","","10917","3","293","2","293","2","","","","","","","","3","I b c a","-I 2b 2c","73","","1,2-Bis(3,5-dimethylpyrazol-1-yl)-anti-[2.2]paracyclonaphthane","","- C34 H32 N4 -","- C34 H32 N4 -","- C544 H512 N64 -","16","1","YA6218","Jun-Wen Wang; Hai-Bin Song; Feng-Bo Xu; Qing-Shan Li; Zheng-Zhi Zhang","1,2-Bis(3,5-dimethylpyrazol-1-yl)-<i>anti</i>-[2.2]paracyclonaphthane","Acta Crystallographica Section E","2004","60","11","o2047","o2049","10.1107/S1600536804025619","","","0.71073","MoKα","","0.107","0.05","","","0.114","0.145","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204597","6.741","0.003","15.58","0.03","15.126","0.006","90","","91.401","0.012","90","","1588","3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis(μ-2-aminoethanesulfonato)-κ^3^N,O:O';κ^3^O':N,O;-bis[(bipyridine- κ^2^N,N')(perchlorate-κO)copper(II)]","","- C24 H28 Cl2 Cu2 N6 O14 S2 -","- C24 H28 Cl2 Cu2 N6 O14 S2 -","- C48 H56 Cl4 Cu4 N12 O28 S4 -","2","0.5","YA6222","Jin-Hua Cai; Yi-Min Jiang; Xiu-Jian Wang; Zhi-Min Liu","Bis(μ-2-aminoethanesulfonato)-κ^3^<i>N</i>,<i>O</i>:<i>O</i>';κ^3^<i>O</i>':<i>N</i>,<i>O</i>-bis[(bipyridine-κ^2^<i>N</i>,<i>N</i>')(perchlorato-κ<i>O</i>)copper(II)]","Acta Crystallographica Section E","2004","60","11","m1659","m1661","10.1107/S1600536804025541","","","0.71073","MoKα","","0.051","0.038","","","0.114","0.166","","","","","","1.13","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204598","5.675","0.001","9.346","0.002","25.44","0.005","90","","92.06","0.03","90","","1348.4","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(3-Phenyl-1,2,4-oxadiazol-5-yl)-4H-1-benzopyran-3-ol","","- C17 H12 N2 O3 -","- C17 H12 N2 O3 -","- C68 H48 N8 O12 -","4","1","YA6223","Wang, Hai-Bo; Chen, Jia-Hui; Wang, Jin-Tang","2-(3-Phenyl-1,2,4-oxadiazol-5-yl)-4<i>H</i>-1-benzopyran-3-ol","Acta Crystallographica Section E","2004","60","11","o1917","o1918","10.1107/S1600536804024134","","","0.71073","MoKα","","0.073","0.043","","","0.146","0.176","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204599","12.785","0.004","14.47","0.005","12.488","0.004","90","","90","","90","","2310.3","1.3","293","2","293","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","","2,3-Dimethyl-1,4-bis(3,4,5-trimethoxyphenyl)butane-1,4-dione","","- C24 H30 O8 -","- C24 H30 O8 -","- C96 H120 O32 -","4","0.5","YA6224","Hu, Qingping; Ma, Mingliang; Shi, Jixian; Li, Yan; Zhou, Hongyu","(2<i>RS</i>,3<i>RS</i>)-2,3-Dimethyl-1,4-bis(3,4,5-trimethoxyphenyl)butane-1,4-dione","Acta Crystallographica Section E","2004","60","11","o2101","o2102","10.1107/S1600536804026327","","","0.71073","MoKα","","0.073","0.042","","","0.099","0.12","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204600","10.036","0.003","10.384","0.003","13.384","0.003","107.744","0.005","93.331","0.005","118.732","0.005","1129.4","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","trans-Diaquabis[2-[3-(dimethylamino)prop-2-enoyl]pyridine]nickel(II) bis(tetrafluoroborate) dimethylformamide tetrasolvate","","- C32 H56 B2 F8 N8 Ni O8 -","- C32 H56 B2 F8 N8 Ni O8 -","- C32 H56 B2 F8 N8 Ni O8 -","1","0.5","AC6127","Ze-Qun Yan","<i>trans</i>-Diaquabis{2-[3-(dimethylamino)prop-2-enoyl]pyridine}nickel(II) bis(tetrafluoroborate) dimethylformamide tetrasolvate","Acta Crystallographica Section E","2004","60","12","m1957","m1958","10.1107/S1600536804029952","","","0.71073","MoKα","","0.1322","0.0742","","","0.1684","0.2005","","","","","","0.976","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204601","10.204","0.003","8.775","0.003","15.128","0.004","90","","99.132","0.005","90","","1337.4","0.7","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","7b-tert-Butyl-1a,2,5,6-tetrahydro-2-hydroxy-2-methyl-4H- oxireno[2,3-h]chromen-3(7bH)-one","","- C14 H20 O4 -","- C14 H20 O4 -","- C56 H80 O16 -","4","1","AC6131","Chun-Hui Mao; Hai-Bin Song; Qing-Min Wang; Run-Qiu Huang; Li Chen; Jian Shang","7b-<i>tert</i>-Butyl-1a,2,5,6-tetrahydro-2-hydroxy-2-methyl-4<i>H</i>-oxireno[2,3-<i>h</i>]chromen-3(7b<i>H</i>)-one","Acta Crystallographica Section E","2004","60","12","o2264","o2265","10.1107/S1600536804028016","","","0.71073","MoKα","","0.0943","0.0534","","","0.1271","0.1468","","","","","","1.014","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204602","6.8164","0.0017","7.2165","0.0018","7.2951","0.0018","111.4","0.01","104.57","0.01","101.06","0.01","306.93","0.14","174","2","174","2","","","","","","","","4","P -1","-P 1","2","","2,6-Difluorobenzonitrile","","- C7 H3 F2 N -","- C7 H3 F2 N -","- C14 H6 F4 N2 -","2","1","AC6132","Britton, Doyle","2,6-Difluorobenzonitrile","Acta Crystallographica Section E","2004","60","12","o2189","o2190","10.1107/S1600536804027400","","","0.71073","MoKα","","0.042","0.039","","","0.117","0.12","","","","","","1.112","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204603","7.2796","0.0005","11.7664","0.0008","9.4285","0.0006","90","","104.957","0.001","90","","780.23","0.09","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","p-nitrophenetole","1-ethoxy-4-nitrobenzene","","- C8 H9 N O3 -","- C8 H9 N O3 -","- C32 H36 N4 O12 -","4","1","AC6133","McBurney, Brian; Foss, Paul C. D.; Reed, Elizabeth M.; Shine, Timothy D.; Glagovich, Neil M.; Westcott, Barry L.; Crundwell, Guy; Zeller, Matthias; Hunter, Allen D.","1-Ethoxy-4-nitrobenzene","Acta Crystallographica Section E","2004","60","12","o2179","o2180","10.1107/S1600536804027412","","","0.71073","MoKα","","0.0491","0.0479","","","0.128","0.129","","","","","","1.22","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204604","11.6338","0.0004","10.3522","0.0003","17.2434","0.0005","90","","104.393","0.002","90","","2011.54","0.11","102","2","102","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H26 Br P -","- C23 H26 Br P -","- C92 H104 Br4 P4 -","4","1","AC6135","Czerwinski, Edmund W.","Pentyltriphenylphosphonium bromide","Acta Crystallographica Section E","2004","60","12","o2393","o2394","10.1107/S1600536804029769","","","1.5418","CuKα","","0.0552","0.0397","","","","0.0892","","","","","","0.94","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204605","20.6356","0.0003","32.5388","0.0006","9.724","0.0001","90","","90","","90","","6529.25","0.17","123","2","123","2","","","","","","","","6","F d d 2","F 2 -2d","43","","Dichlorobis(triphenylphosphine oxide-κO)nickel(II)","","- C36 H30 Cl2 Ni O2 P2 -","- C36 H30 Cl2 Ni O2 P2 -","- C288 H240 Cl16 Ni8 O16 P16 -","8","0.5","AC6138","Moreno-Fuquen, Rodolfo; Cifuentes, Olga; Valderrama Naranjo, Jaime; Serratto, Luis Manuel; Kennedy, Alan R.","Dichlorobis(triphenylphosphine oxide-κ<i>O</i>)nickel(II)","Acta Crystallographica Section E","2004","60","12","m1861","m1862","10.1107/S1600536804029125","","","0.71073","MoKα","","0.0296","0.026","","","0.0617","0.0631","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204606","11.7361","0.0007","10.57","0.0007","16.0857","0.001","90","","95.574","0.003","90","","1986","0.2","273","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-Hydroxymethyl-2,2-diphenylethyl 2,4,6-trimethylphenyl ketone","","- C25 H26 O2 -","- C25 H26 O2 -","- C100 H104 O8 -","4","1","AC6140","Pinkus, A. G.; Klausmeyer, Kevin K.; Feazell, Rodney P.; Logaraj, Sundaram; Hurd, Phillip W.","1-Hydroxymethyl-2,2-diphenylethyl 2,4,6-trimethylphenyl ketone","Acta Crystallographica Section E","2004","60","12","o2432","o2433","10.1107/S1600536804030120","","","0.71073","MoKα","","0.0613","0.0416","","","0.0986","0.108","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204607","6.534","0.002","11.13","0.002","16.325","0.002","100.64","0.01","100.25","0.01","106.23","0.02","1086.6","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Bis[3-(trimethylsilyl)propyl] methylenebisphosphonate","","- C13 H34 O6 P2 Si2 -","- C13 H34 O6 P2 Si2 -","- C26 H68 O12 P4 Si4 -","2","1","BR6168","McLauchlan, Craig C.; Stepinski, Dominique C.; Herlinger, Albert W.","Bis[3-(trimethylsilyl)propyl] methylenebisphosphonate","Acta Crystallographica Section E","2004","60","12","o2232","o2234","10.1107/S1600536804028028","","","0.71073","MoKα","","0.0815","0.0607","","","0.1591","0.178","","","","","","1.148","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204608","8.819","0.006","8.852","0.005","10.404","0.006","98.71","0.03","103.96","0.04","118.818","0.016","655.5","0.7","293","2","130.15","","","","","","","","","7","P -1","-P 1","2","","catena-Poly[[bis(O,O'-diethyl dithiophosphato-κ^2^S,S')cadmium(II)]-μ-4,4'-bipyridine-N:N']","","- C18 H28 Cd N2 O4 P2 S4 -","- C18 H24 Cd N2 O4 P2 S4 -","- C18 H24 Cd N2 O4 P2 S4 -","1","0.5","BR6169","Tao Li; Zhi-Hua Li; Shao-Wu Du","<i>catena</i>-Poly[[bis(<i>O,O</i>'-diethyl dithiophosphato-κ^2^<i>S,S</i>')cadmium(II)]-μ-4,4'-bipyridine-<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2004","60","12","m1912","m1914","10.1107/S1600536804029721","","","0.71073","MoKα","","0.0563","0.0507","","","0.1311","0.1354","","","","","","1.043","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204609","8.9013","0.0006","10.2224","0.0007","10.4902","0.0007","92.306","0.001","112.334","0.001","103.566","0.001","849.36","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(μ-4-sulfobenzoato-κ^2^O:O')bis[aqua(2,2'-bipyridine-κ^2^N,N')copper(II)]","","- C34 H28 Cu2 N4 O12 S2 -","- C34 H28 Cu2 N4 O12 S2 -","- C34 H28 Cu2 N4 O12 S2 -","1","0.5","BR6171","Fan, Sai-Rong; Xiao, Hong-Ping; Zhang, Li-Ping; Zhu, Long-Guan","Bis(μ-4-sulfobenzoato-κ^2^<i>O</i>:<i>O</i>')bis[aqua(2,2'-bipyridine-κ^2^<i>N,N</i>')copper(II)]","Acta Crystallographica Section E","2004","60","12","m1833","m1835","10.1107/S1600536804028958","","","0.71073","MoKα","","0.0337","0.0319","","","0.0873","0.0888","","","","","","1.074","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204610","7.441","0.001","11.502","0.002","12.492","0.002","98.8","0.03","106","0.03","95.47","0.03","1004.9","0.3","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","1,8-anthraquinono-18-crown-5 monohydrate","","- C22 H24 O8 -","- C22 H24 O8 -","- C44 H48 O16 -","2","1","BT6547","Weber, Edwin; Kunze, Denise; Seichter, Wilhelm","1,8-Anthraquinono-18-crown-5 monohydrate","Acta Crystallographica Section E","2004","60","12","o2331","o2333","10.1107/S1600536804029022","","","1.5418","CuKα","","0.1195","0.059","","","0.1814","0.218","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204611","17.228","0.003","14.464","0.003","13.556","0.003","90","","90","","90","","3378","1.2","295","2","295","2","","","","","","","","5","A b a 2","A 2 -2ab","41","","Bis(μ-9-oxidofluorene-9-carboxylato-κ^3^O,O':O)bis[aqua(1H-imidazole- κN^3^)copper(II)] methanol solvate","","- C35 H32 Cu2 N4 O9 -","- C35 H32 Cu2 N4 O9 -","- C140 H128 Cu8 N16 O36 -","4","","BT6552","Huo, Li-Hua; Gao, Shan; Zhao, Hui; Ng, Seik Weng","Bis(μ-9-oxidofluorene-9-carboxylato-κ^3^<i>O,O</i>':<i>O</i>)bis[aqua(1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II)] methanol solvate","Acta Crystallographica Section E","2004","60","12","m1747","m1749","10.1107/S1600536804027096","","","0.71073","MoKα","","0.038","0.034","","","0.084","0.086","","","","","","1.12","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2204612","7.986","0.002","23.781","0.005","17.868","0.004","90","","102.82","0.03","90","","3308.8","1.4","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(butane-2,3-dione monooxime benzoylhydrazone-κ^3^O,N,N')nickel(II) sulfate salicylhydroxamic acid","","- C29 H33 N7 Ni O11 S -","- C29 H33 N7 Ni O11 S -","- C116 H132 N28 Ni4 O44 S4 -","4","1","BT6553","Gao, Shan; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","Bis(butane-2,3-dione monooxime benzoylhydrazone-κ^3^<i>O,N,N</i>')nickel(II) sulfate salicylhydroxamic acid","Acta Crystallographica Section E","2004","60","12","m1750","m1751","10.1107/S1600536804027102","","","0.71073","MoKα","","0.101","0.0592","","","0.1354","0.1519","","","","","","1.018","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204613","6.8262","0.0009","10.951","0.001","14.761","0.001","97.259","0.002","103.386","0.002","106.018","0.002","1010.21","0.18","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","4-[(Z)-(4-Methoxyanilino)phenylmethylene]-5-methyl-2-phenyl-2H-pyrazol-3(4H)-one","","- C24 H21 N3 O2 -","- C24 H21 N3 O2 -","- C48 H42 N6 O4 -","2","1","BT6554","Bao, Feng Bao; Lü, Xing-Qiang; Qiao, Yu-Qin; Wu, Qing; Ng, Seik Weng","4-[(<i>Z</i>)-(4-Methoxyanilino)phenylmethylene]-5-methyl-2-phenyl-2<i>H</i>-pyrazol-3(4<i>H</i>)-one","Acta Crystallographica Section E","2004","60","12","o2191","o2192","10.1107/S160053680402728X","","","0.71073","MoKα","","0.054","0.04","","","0.111","0.124","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204614","15.643","0.003","10.258","0.002","16.563","0.003","90","","116.49","0.03","90","","2378.8","1","298","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(3,4-dibenzoyl-2,5-dimethylpyrrol-1-yl)-4-methoxybenzamide","","- C28 H24 N2 O4 -","- C28 H24 N2 O4 -","- C112 H96 N8 O16 -","4","1","BT6555","Gao, Shan; Huo, Li-Hua; Ng, Seik Weng","A monoclinic modification of <i>N</i>-(3,4-dibenzoyl-2,5-dimethylpyrrol-1-yl)-4-methoxybenzamide","Acta Crystallographica Section E","2004","60","12","o2193","o2194","10.1107/S1600536804027291","","","0.71073","MoKα","","0.07","0.051","","","0.128","0.139","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204615","17.993","0.004","6.528","0.001","12.501","0.003","90","","127.74","0.03","90","","1161.2","0.6","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-Hydroxypyridinium nitrate 4-hydroxypyridine","","- C10 H11 N3 O5 -","- C10 H11 N3 O5 -","- C40 H44 N12 O20 -","4","0.5","BT6556","Gao, Shan; Lu, Zhen-Zhong; Huo, Li- Hua; Zain, Shariffudin M.; Ng, Seik Weng","Rerefinement of the co-crystal of 4-hydroxypyridine with 4-hydroxypyridinium nitrate","Acta Crystallographica Section E","2004","60","12","o2195","o2196","10.1107/S1600536804027308","","","0.71073","MoKα","","0.05","0.037","","","0.11","0.117","","","","","","1.08","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204616","11.8535","0.0007","8.6424","0.0005","21.0047","0.0013","90","","101.451","0.001","90","","2108.9","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[N,N'-Bis(1-{[2-oxido-4-(2-hydroxyethoxy)phenyl]methyl}ethylidene)ethane- 1,2-diamine]copper(II)","","- C22 H26 Cu N2 O6 -","- C22 H26 Cu N2 O6 -","- C88 H104 Cu4 N8 O24 -","4","1","BT6558","G. Usha; S. Selvanayagam; D. Velmurugan; K. Ravikumar; N. Senthil Kumar; A. Raghavan; A. Sultan Nasar","[<i>N,N</i>'-Bis(1-{[2-oxido-4-(2-hydroxyethoxy)phenyl]methyl}ethylidene)ethane-1,2-diamine]copper(II)","Acta Crystallographica Section E","2004","60","12","m1772","m1774","10.1107/S1600536804027692","","","0.71073","MoKα","","0.0472","0.0379","","","0.1018","0.1076","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204617","10.026","0.003","10.123","0.003","12.363","0.004","95.51","0.03","107.26","0.03","98.19","0.03","1173.3","0.7","143","2","143","2","","","","","","","","3","P -1","-P 1","2","","1,1-Diphenyl-2,2-bis(trimethylsilylethynyl)ethene","","- C24 H28 Si2 -","- C24 H28 Si2 -","- C48 H56 Si4 -","2","1","BT6559","Berger, Harald; Bubenitschek, Peter; Hopf, Henning; Jones, Peter G.","1,1-Diphenyl-2,2-bis(trimethylsilylethynyl)ethene","Acta Crystallographica Section E","2004","60","12","o2209","o2210","10.1107/S1600536804027448","","","0.71073","MoKα","","0.0685","0.0484","","","0.1119","0.1238","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204618","11.0573","0.0008","14.4144","0.001","23.1203","0.0017","90","","96.946","0.001","90","","3658","0.5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Bis[bis(p-dimethylaminophenyl)tellura-di-tert-butylstannoxacarbonate]","tetra-tert-butyl-di-μ~3~-carbonato-tetrakis[4-(N,N-dimethylamino)phenyl]di- μ-oxo-ditelluriumditin chloroform tetrasolvate","","- C54 H80 Cl12 N4 O8 Sn2 Te2 -","- C54 H80 Cl12 N4 O8 Sn2 Te2 -","- C108 H160 Cl24 N8 O16 Sn4 Te4 -","2","0.5","BT6560","Beckmann, Jens; Dakternieks, Dainis; Duthie, Andrew; Mitchell, Cassandra","A dimeric tellurastannoxane carbonate cluster, tetra-<i>tert</i>-butyl-di-μ~3~-carbonato-tetrakis[4-(<i>N</i>,<i>N</i>-dimethylamino)phenyl]di-μ-oxo-ditelluriumditin chloroform tetrasolvate","Acta Crystallographica Section E","2004","60","12","m1978","m1979","10.1107/S1600536804028120","","","0.71073","MoKα","","0.0762","0.0545","","","0.1046","0.1114","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204619","8.2296","0.0006","8.6309","0.0007","13.4708","0.001","75.085","0.006","88.71","0.006","77.777","0.006","903.1","0.12","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1,3-Bis(3,4-dicyanophenoxy)benzene","","- C22 H10 N4 O2 -","- C22 H10 N4 O2 -","- C44 H20 N8 O4 -","2","1","BT6561","Deveci, Özlem; Işık, Şamil; Yavuz, Metin; Akdemir, Nesuhi; Ağar, Erbil; Kantar, Cihan","1,3-Bis(3,4-dicyanophenoxy)benzene","Acta Crystallographica Section E","2004","60","12","o2309","o2310","10.1107/S1600536804028545","","","0.71073","MoKα","","0.0899","0.0649","","","0.1655","0.1862","","","","","","0.955","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204620","12.5693","0.0004","4.8531","0.0001","17.2663","0.0005","90","","99.1624","0.0015","90","","1039.81","0.05","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Acetamido-4,5-dinitrotoluene","","- C9 H9 N3 O5 -","- C9 H9 N3 O5 -","- C36 H36 N12 O20 -","4","1","BT6562","Watkin, David J.; Motherwell, W. D. S.; Copper, Richard I.; Pantos, Stefan","2-Acetamido-4,5-dinitrotoluene: a test molecule for the CCDC `Blind Structure Prediction Test, 2004'","Acta Crystallographica Section E","2004","60","12","o2295","o2297","10.1107/S1600536804028491","","","0.71073","MoKα","","0.051","0.051","","0.0953","0.0953","0.0953","","","","","","1.0014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204621","13.9704","0.0008","19.559","0.0012","14.1646","0.0009","90","","96.9","0.001","90","","3842.4","0.4","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","N-[(1S,2S,3R)-2-Bromo-3-(tert-butyldiphenylsilyloxy)-1-phenyl-4- (phenylsulfonyl)butyl]-4-methylbenzenesulfonamide","","- C39 H42 Br N O5 S2 Si -","- C39 H42 Br N O5 S2 Si -","- C156 H168 Br4 N4 O20 S8 Si4 -","4","1","BT6563","K. Ravikumar; G. Y. S. K. Swamy; S. Raghavan; Ch. Naveenkumar","<i>N</i>-[(1<i>S</i>,2<i>S</i>,3<i>R</i>)-2-Bromo-3-(<i>tert</i>-butyldiphenylsilyloxy)-1-phenyl-4-(phenylsulfonyl)butyl]-4-methylbenzenesulfonamide","Acta Crystallographica Section E","2004","60","12","o2290","o2292","10.1107/S1600536804028314","","","0.71073","MoKα","","0.0931","0.0514","","","0.1141","0.1303","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204622","20.681","0.002","9.885","0.0009","28.44","0.002","90","","100.368","0.004","90","","5719.1","0.9","173","2","173","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(μ~2~-phosphindolyl)(μ~2~-1-phenyl-phosphind-2-yl-C,P)bis(manganese- tetracarbonyl)","","- C30 H16 Mn2 O8 P2 -","- C30 H16 Mn2 O8 P2 -","- C240 H128 Mn16 O64 P16 -","8","1","BV6005","Andreas Decken; Wilkins, Brianne E.; Bottomley, Frank","A novel coordination mode for a phospholyl ligand: μ-phosphindolyl-κ^2^<i>P</i>:<i>P</i>-μ-1-phenyl-phosphindolyl-κ^2^<i>C</i>^2^:<i>P</i>-bis[tetracarbonylmanganese(I)]","Acta Crystallographica Section E","2004","60","12","m1985","m1986","10.1107/S1600536804030892","","","0.71073","MoKα","","0.1235","0.0723","","","0.169","0.1811","","","","","","0.966","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204623","10.769","0.008","24.58","0.02","13.274","0.012","90","","103","0.03","90","","3424","5","296.1","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tris(1,10-phenanthroline-κ^2^N,N')iron(III) trinitrate monohydrate","","- C36 H26 Fe N9 O10 -","- C36 H26 Fe N9 O10 -","- C144 H104 Fe4 N36 O40 -","4","0.5","CF6374","Odoko, Mamiko; Okabe, Nobuo","Tris(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')iron(III) trinitrate monohydrate","Acta Crystallographica Section E","2004","60","12","m1822","m1824","10.1107/S1600536804027345","","","0.7107","MoKα","","","0.043","","","","0.123","","","","","","1.016","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204624","7.028","0.007","11.527","0.015","17.85","0.02","72.36","0.04","88.96","0.03","75.55","0.04","1332","3","296.1","","","","","","","","","","","5","P -1","-P 1","2","","(Oxalato-κ^2^O,O')(1,10-phenanthroline-κ^2^N,N')palladium(II) monohydrate","","- C14 H10 N2 O5 Pd -","- C14 H10 N2 O5 Pd -","- C56 H40 N8 O20 Pd4 -","4","2","CF6375","Odoko, Mamiko; Wang, Yue; Okabe, Nobuo","(Oxalato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')palladium(II) monohydrate","Acta Crystallographica Section E","2004","60","12","m1825","m1827","10.1107/S1600536804027357","","","0.7107","MoKα","","","0.025","","","","0.073","","","","","","1.133","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2204625","9.535","0.003","9.72","0.003","11.955","0.004","96.928","0.004","95.608","0.004","107.68","0.004","1037.3","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[bis(ethylenediamine-κ^2^N,N')copper(II)]-μ~3~- 2,3-dimercaptobutenedinitrile-κ^4^N:S,S':N'-[(2,3-dimercaptobutenedinitrile- κ^4^S,S',N,N')cuprate(II)]]","","- C12 H16 Cu2 N8 S4 -","- C12 H16 Cu2 N8 S4 -","- C24 H32 Cu4 N16 S8 -","2","1","CF6376","Fu, Ai-Yun; Wang, Da-Qi; Sun, De-Zhi","<i>catena</i>-Poly[[bis(ethylenediamine-κ^2^<i>N,N</i>')copper(II)]-μ~3~-1,2-dicyanoethylenedithiolato-κ^4^<i>N</i>:<i>S,S</i>':<i>N</i>'-[(1,2-dicyanoethylenedithiolato-κ^2^<i>S,S</i>')cuprate(II)]]","Acta Crystallographica Section E","2004","60","12","m1869","m1871","10.1107/S1600536804027461","","","0.71073","MoKα","","0.0587","0.0359","","","0.0664","0.0709","","","","","","0.997","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204626","13.49","0.003","12.103","0.002","15.62","0.003","90","","101.331","0.003","90","","2500.6","0.8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tris(ethylenediamine-κ^2^N,N')cadmium(II) bis[2,3-dimercaptobutenedinitrile(2-)-κ^2^S,S']cuprate(II)","","- C14 H24 Cd Cu N10 S4 -","- C14 H24 Cd Cu N10 S4 -","- C56 H96 Cd4 Cu4 N40 S16 -","4","0.5","CF6378","Wang, Da-Qi; Fu, Ai-Yun; Wei, Xi-Lian","Tris(ethylenediamine-κ^2^<i>N,N</i>')cadmium(II) bis(1,2-dicyanoethylenedithiolato-κ^2^<i>S,S</i>')cuprate(II)","Acta Crystallographica Section E","2004","60","12","m1872","m1874","10.1107/S1600536804027473","","","0.71073","MoKα","","0.0432","0.0343","","","0.0893","0.0948","","","","","","0.999","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204627","12.631","0.005","8.329","0.005","17.982","0.008","90","","119.11","0.03","90","","1652.8","1.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(4-Chlorophenyl)-5-methyl-7,8-dihydro-6H- cyclopenta[e][1,3]oxazolo[3,2-a]pyridin-9-ium perchlorate","","- C17 H15 Cl2 N O5 -","- C17 H15 Cl2 N O5 -","- C68 H60 Cl8 N4 O20 -","4","1","CF6383","Dmitry V. Albov; Victor B. Rybakov; Eugene V. Babaev; Leonid A. Aslanov","2-(4-Chlorophenyl)-5-methyl-7,8-dihydro-6<i>H</i>-cyclopenta[<i>e</i>][1,3]oxazolo[3,2-<i>a</i>]pyridin-9-ium perchlorate","Acta Crystallographica Section E","2004","60","12","o2313","o2314","10.1107/S1600536804026777","","","1.5418","CuKα","","0.0453","0.0449","","","0.1017","0.1019","","","","","","0.79","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204628","11.946","0.002","9.7085","0.0019","15.247","0.003","90","","99.26","0.03","90","","1745.3","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl 4-[(2-butyl-4-chloro-5-formyl-1H-imidazol-1-yl)methyl]benzoate","","- C17 H19 Cl N2 O3 -","- C17 H19 Cl N2 O3 -","- C68 H76 Cl4 N8 O12 -","4","1","CF6384","Fengke Yang; Hailian Xiao; Fangfang Jian","Methyl 4-[(2-butyl-4-chloro-5-formyl-1<i>H</i>-imidazol-1-yl)methyl]benzoate","Acta Crystallographica Section E","2004","60","12","o2266","o2267","10.1107/S1600536804027084","","","0.71073","MoKα","","0.1216","0.0586","","","0.1342","0.1784","","","","","","1.037","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204629","5.812","0.003","14.276","0.008","13.878","0.007","90","","98.344","0.008","90","","1139.3","1","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","4-fluorobenzaldehyde picoloylhydrazone","4-fluorobenzaldehyde (pyridine-2-carbonyl)hydrazone","","- C13 H10 F N3 O -","- C13 H10 F N3 O -","- C52 H40 F4 N12 O4 -","4","1","CF6386","Shao, Si-Chang; You, Zhong-Lu; Shao-Hua Fan; Tang, Lu-Lu; Lin, Yong-Shan; Zhu, Hai-Liang","4-Fluorobenzaldehyde picoloylhydrazone","Acta Crystallographica Section E","2004","60","12","o2181","o2182","10.1107/S1600536804027369","","","0.71073","MoKα","","0.085","0.0541","","","0.1268","0.1445","","","","","","1.044","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204630","12.191","0.003","9.398","0.003","21.624","0.006","90","","103.415","0.004","90","","2409.9","1.2","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","2-nitrobenzaldehyde picoloylhydrazone","2-nitrobenzaldehyde (pyridine-2-carbonyl)hydrazone","","- C13 H10 N4 O3 -","- C13 H10 N4 O3 -","- C104 H80 N32 O24 -","8","1","CF6387","Shao, Si-Chang; You, Zhong-Lu; Shao-Hua Fan; Tang, Lu-Lu; Xiong, Zhong-Duo; Zhu, Hai-Liang","2-Nitrobenzaldehyde picoloylhydrazone","Acta Crystallographica Section E","2004","60","12","o2183","o2184","10.1107/S1600536804027370","","","0.71073","MoKα","","0.0521","0.0428","","","0.1152","0.1219","","","","","","1.053","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204631","8.499","0.007","13.783","0.011","9.82","0.008","90","","105.64","0.011","90","","1107.7","1.6","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","pyridine-2-carboxaldehyde picoloylhydrazone","pyridine-2-carboxaldehyde (pyridine-2-carbonyl)hydrazone","","- C12 H10 N4 O -","- C12 H10 N4 O -","- C48 H40 N16 O4 -","4","1","CF6388","Shao, Si-Chang; You, Zhong-Lu; Tang, Lu-Lu; Lin, Yong-Shan; Zhu, Hai-Liang","Pyridine-2-carboxaldehyde picoloylhydrazone","Acta Crystallographica Section E","2004","60","12","o2185","o2186","10.1107/S1600536804027382","","","0.71073","MoKα","","0.1358","0.0689","","","0.1186","0.136","","","","","","0.902","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204632","7.07","0.003","25.214","0.009","7.87","0.003","90","","113.541","0.005","90","","1286.2","0.9","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2-nitrobenzaldehyde salicylhydrazone","2-nitrobenzaldehyde (2-hydroxybenzoyl)hydrazone","","- C14 H11 N3 O4 -","- C14 H11 N3 O4 -","- C56 H44 N12 O16 -","4","1","CF6389","Shao, Si-Chang; You, Zhong-Lu; Xiong, Zhong-Duo; Chen, Bo; Zhu, Hai-Liang","2-Nitrobenzaldehyde salicylhydrazone","Acta Crystallographica Section E","2004","60","12","o2187","o2188","10.1107/S1600536804027394","","","0.71073","MoKα","","0.0752","0.0491","","","0.1118","0.1248","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204633","9.139","0.003","15.48","0.006","16.24","0.006","90","","95.168","0.007","90","","2288.2","1.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-Diaquabis[4-(4-methylphenyl)-3,5-bis(2-pyridyl)-4H-1,2,4- triazole]nickel(II) diperchlorate tetrahydrate","","- C38 H42 Cl2 N10 Ni O14 -","- C38 H38 Cl2 N10 Ni O14 -","- C76 H76 Cl4 N20 Ni2 O28 -","2","0.5","CI6467","Shao, Si-Chang; Liu, Zhao-Di; Zhu, Hai-Liang","<i>trans</i>-Diaquabis[4-(4-methylphenyl)-3,5-bis(2-pyridyl)-4<i>H</i>-1,2,4-triazole]nickel(II) diperchlorate tetrahydrate","Acta Crystallographica Section E","2004","60","12","m1815","m1816","10.1107/S1600536804028557","","","0.71073","MoKα","","0.1585","0.0653","","","0.1408","0.1711","","","","","","0.842","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204634","10.835","0.008","9.882","0.008","17.73","0.0012","90","","101.84","0.03","90","","1858","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Isopropoxy[2'-(2-methoxybenzoyl)-2- oxidobenzohydrazidato](isopropoxy)oxovanadium(V)","","- C18 H19 N2 O6 V -","- C18 H19 N2 O6 V -","- C72 H76 N8 O24 V4 -","4","1","CI6468","Li-Juan Chen; Ming-Xing Yang; Shen Lin","Isopropoxy[2'-(2-methoxybenzoyl)-2-oxidobenzohydrazidato]oxovanadium(V)","Acta Crystallographica Section E","2004","60","12","m1881","m1882","10.1107/S1600536804026832","","","0.71073","MoKα","","0.0502","0.0386","","","0.112","0.1168","","","","","","1.081","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204635","8.534","0.007","34.067","0.01","10.458","0.005","90","","98.91","0.05","90","","3004","3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,4-Bis(pyridine-2-carbonyl)-1-(2-pyridyl)-3,5-bis(4-tolyl)cyclohex-1-ol","","- C37 H33 N3 O3 -","- C37 H33 N3 O3 -","- C148 H132 N12 O12 -","4","1","CI6471","K. R. Krishnapriya; N. Sampath; S. Aravindhan; M. N. Ponnuswamy; M. Kandaswamy","2,4-Bis(pyridine-2-carbonyl)-1-(2-pyridyl)-3,5-di-<i>p</i>-tolylcyclohex-1-ol","Acta Crystallographica Section E","2004","60","12","o2353","o2355","10.1107/S1600536804028648","","","0.71073","MoKα","","0.1744","0.059","","","0.1579","0.1982","","","","","","0.944","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204636","7.003","0.002","9.537","0.004","12.54","0.003","100.397","0.0015","98.808","0.0015","94.549","0.0015","809.1","0.5","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","1,5-Dimethyl-4-[(4-nitrobenzylidene)amino]-2-phenyl-2,3-dihydro-1<i>H</i>- pyrazol-3-one","","- C18 H16 N4 O3 -","- C18 H16 N4 O3 -","- C36 H32 N8 O6 -","2","1","CI6472","Li, Zong-Xiao; Zhang, Xin-Li","1,5-Dimethyl-4-[(4-nitrobenzylidene)amino]-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-3-one","Acta Crystallographica Section E","2004","60","12","o2199","o2200","10.1107/S1600536804027126","","","0.71073","MoKα","","0.2324","0.0836","","","0.1647","0.2322","","","","","","0.927","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204637","9.6559","0.0011","14.983","0.0016","16.5393","0.0019","90","","102.754","0.002","90","","2333.8","0.5","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","10-Cyclopropyl-9-(3-methoxy-4-hydroxyphenyl)-3,3,6,6-tetramethyl- 1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione","","- C27 H33 N O4 -","- C27 H33 N O4 -","- C108 H132 N4 O16 -","4","1","CI6474","Shujiang Tu; Xiaojing Zhang; Jianin Xu","10-Cyclopropyl-9-(4-hydroxy-3-methoxyphenyl)-3,3,6,6-tetramethyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione","Acta Crystallographica Section E","2004","60","12","o2328","o2330","10.1107/S1600536804028612","","","0.7107","MoKα","","0.0791","0.0607","","","0.129","0.1385","","","","","","1.134","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204638","23.594","0.007","5.7205","0.0016","18.223","0.005","90","","93.308","0.006","90","","2455.5","1.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(2-benzylaminopyridine)silver(I) perchlorate","","- C24 H24 Ag Cl N4 O4 -","- C24 H24 Ag Cl N4 O4 -","- C96 H96 Ag4 Cl4 N16 O16 -","4","1","CI6475","Chong-Qing Wan; Qing-Shan Li; Hai-Bin Song; Feng-Bo Xu; Zheng-Zhi Zhang","Bis[2-(benzylamino)pyridine-κ<i>N</i>]silver(I) perchlorate","Acta Crystallographica Section E","2004","60","12","m1973","m1975","10.1107/S1600536804030703","","","0.71073","MoKα","","0.1883","0.0672","","","0.1498","0.2003","","","","","","0.959","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204640","7.696","0.002","10.759","0.002","10.9","0.002","100.54","0.03","99.51","0.03","96.76","0.03","864.9","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[μ-ethylenediamine-κ^2^N:N'-bis[(ethylenediamine- κ^2^N,N')silver(I)] [silver(I)-μ-barbiturato-κ^2^N:N']] dihydrate]","","- C22 H48 Ag4 N10 O8 -","- C22 H48 Ag4 N10 O8 -","- C22 H48 Ag4 N10 O8 -","1","0.5","CI6478","Liu, Zhao-Di; Zhu, Hai-Liang","<i>catena</i>-Poly[[μ-ethylenediamine-κ^2^<i>N</i>:<i>N</i>'-bis[(ethylenediamine-κ^2^<i>N,N</i>')silver(I)] bis[silver(I)-μ-barbiturato-κ^2^<i>N</i>:<i>N</i>']] dihydrate]","Acta Crystallographica Section E","2004","60","12","m1883","m1885","10.1107/S1600536804028661","","","0.71073","MoKα","","0.0781","0.0597","","","0.1435","0.1517","","","","","","0.935","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204641","8.0201","0.0009","12.098","0.0013","22.173","0.003","90","","90","","90","","2151.4","0.4","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","7-Methoxy-2,3-dihydro-1H-cyclopenta[b]chromen-1-one","7-Methoxy-2,3-dihydro-1H-cyclopenta[b]chromen-1-one","","- C13 H12 O3 -","- C13 H12 O3 -","- C104 H96 O24 -","8","1","CI6480","Huo, Fangjun; Yin, Caixia; Yang, Pin","7-Methoxy-2,3-dihydro-1<i>H</i>-cyclopenta[<i>b</i>]chromen-1-one","Acta Crystallographica Section E","2004","60","12","o2278","o2280","10.1107/S1600536804028478","","","0.71073","MoKα","","0.0693","0.0576","","","0.1344","0.1434","","","","","","1.106","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204642","42.152","0.008","7.643","0.002","12.435","0.002","90","","93.03","0.03","90","","4000.6","1.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C7 H10 Ag N3 O4 -","- C7 H10 Ag N3 O4 -","- C112 H160 Ag16 N48 O64 -","16","2","CI6483","You, Zhong-Lu; Zhu, Hai-Liang; Liu, Wei-Sheng","A silver(I) complex with Ag···Ag interactions: diamminesilver(I) <i>p</i>-nitrobenzoate","Acta Crystallographica Section E","2004","60","12","m1903","m1905","10.1107/S1600536804029459","","","0.71073","MoKα","","0.0921","0.0419","","","0.0787","0.0942","","","","","","0.88","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204643","11.7722","0.0013","14.401","0.0016","14.9053","0.0017","90","","105.285","0.002","90","","2437.5","0.5","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tris(ethylenediamine-κ^2^N,N')zinc(II) bis(1,2-dicyanoethylenedithiolato-κ^2^S,S')cuprate(II)","","- C14 H24 Cu N10 S4 Zn -","- C14 H24 Cu N10 S4 Zn -","- C56 H96 Cu4 N40 S16 Zn4 -","4","0.5","CI6485","Da-Qi, Wang; Ai-Yun, Fu; Jin-Yu, He","Tris(ethylenediamine-κ^2^<i>N,N</i>')zinc(II) bis(1,2-dicyanoethylenedithiolato-κ^2^<i>S,S</i>')cuprate(II)","Acta Crystallographica Section E","2004","60","12","m1915","m1917","10.1107/S1600536804029630","","","0.71073","MoKα","","0.033","0.025","","","0.061","0.065","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204644","9.971","0.004","13.239","0.005","13.649","0.005","111.141","0.006","103.553","0.006","107.231","0.006","1482.7","1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N'-tert-Butyl-N'-(3,5-dimethylbenzoyl)-N-(4-carboxyphenoxy)oxalyl- N-(4-ethylbenzoyl)hydrazine","","- C31 H32 N2 O7 -","- C31 H32 N2 O7 -","- C62 H64 N4 O14 -","2","1","CI6486","Chun-Hui Mao; Hai-Bin Song; Qing-Min Wang; Run-Qiu Huang; Li Chen; Jian Shang","<i>N</i>'-<i>tert</i>-Butyl-<i>N</i>'-(3,5-dimethylbenzoyl)-<i>N</i>-(4-carboxyphenoxy)oxalyl-<i>N</i>-(4-ethylbenzoyl)hydrazine","Acta Crystallographica Section E","2004","60","12","o2522","o2524","10.1107/S1600536804030685","","","0.71073","MoKα","","0.0996","0.0516","","","0.1235","0.1511","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204645","7.124","0.0009","7.7627","0.0009","8.1191","0.0009","108.15","0.009","92.225","0.01","94.531","0.01","424.37","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis(pyridine-2-carboxamide-κ^2^N^1^,O^2^)copper(II) squarate","","- C16 H16 Cu N4 O8 -","- C16 H16 Cu N4 O8 -","- C16 H16 Cu N4 O8 -","1","0.5","CI6487","Uçar, İbrahim; Bulut, Ahmet; Yeşilel, Okan Zafer; Ölmez, Halİs; Büyükgüngör, Orhan","Diaquabis(pyridine-2-carboxamide-κ^2^<i>N</i>^1^,<i>O</i>^2^)copper(II) squarate","Acta Crystallographica Section E","2004","60","12","m1945","m1948","10.1107/S1600536804030090","","","0.71073","MoKα","","0.0295","0.0249","","","0.0707","0.0716","","","","","","1.103","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204646","8.7438","0.0013","16.341","0.002","16.46","0.002","68.442","0.011","76.059","0.012","75.827","0.012","2090.8","0.5","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","4-indol-2,6-bis(4-methoxyphenyl)pyridine","","- C27 H22 N2 O2 -","- C27 H22 N2 O2 -","- C108 H88 N8 O8 -","4","2","CI6488","Shujiang Tu; Tuanjie Li; Fang Fang","4-(1<i>H</i>-Indol-3-yl)-2,6-bis(4-methoxyphenyl)pyridine","Acta Crystallographica Section E","2004","60","12","o2457","o2459","10.1107/S1600536804030387","","","0.7107","MoKα","","0.0983","0.0741","","","0.1352","0.1445","","","","","","1.16","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204647","8.5398","0.0014","10.1117","0.0013","12.729","0.002","72.153","0.014","81.338","0.016","65.053","0.013","948.4","0.3","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","4-(4-chlorophenyl)-6-(4-methoxyphenyl) 2-amino-3-ethoxycarbonly-pyridine","","- C21 H19 Cl N2 O3 -","- C21 H19 Cl N2 O3 -","- C42 H38 Cl2 N4 O6 -","2","1","CI6489","Yuezhao Zhu; Shujiang Tu; Fang Fang; Jianing Xu","Ethyl 2-amino-4-(4-chlorophenyl)-6-(4-methoxyphenyl)pyridine-3-carboxylate","Acta Crystallographica Section E","2004","60","12","o2460","o2461","10.1107/S1600536804030302","","","0.7107","MoKα","","0.0587","0.0498","","","0.1103","0.1148","","","","","","1.108","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204648","9.6864","0.0013","9.9047","0.0014","10.8332","0.0015","66.933","0.002","77.581","0.002","64.206","0.002","859.7","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Poly[[aqua(1,10-phenanthroline-κ^2^N,N')copper(II)]-μ-4-sulfonatobenzoato- κ^2^O^4^:O^1^]","","- C19 H14 Cu N2 O6 S -","- C19 H14 Cu N2 O6 S -","- C38 H28 Cu2 N4 O12 S2 -","2","1","CI6490","Fan, Sai-Rong; Xiao, Hong-Ping; Zhang, Li-Ping; Cai, Guo-Qiang; Zhu, Long-Guan","Poly[[aqua(1,10-phenanthroline-κ^2^<i>N,N</i>')copper(II)]-μ-4-sulfonatobenzoato-κ^2^<i>O</i>^4^:<i>O</i>^1^]","Acta Crystallographica Section E","2004","60","12","m1970","m1972","10.1107/S1600536804030697","","","0.71073","MoKα","","0.0282","0.0269","","","0.0743","0.0751","","","","","","1.026","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204649","11.7547","0.0011","16.6566","0.0011","7.2986","0.0006","90","","101.722","0.007","90","","1399.2","0.2","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-amino-5-benzoyl-4-phenylpyrimidin-2(1H)-one","","- C17 H13 N3 O2 -","- C17 H13 N3 O2 -","- C68 H52 N12 O8 -","4","1","CI6491","Dege, Necmi; Şekerci, Memet; Çetin, Ahmet; Dinçer, Muharrem; Gülcan, Mehmet; Cansız, Ahmet; Büyükgüngör, Orhan","1-Amino-5-benzoyl-4-phenylpyrimidin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2004","60","12","o2476","o2478","10.1107/S1600536804030338","","","0.71073","MoKα","","0.0547","0.0373","","","0.0977","0.1047","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204650","9.1365","0.0002","9.3759","0.0002","10.9936","0.0003","113.675","0.001","92.35","0.001","93.164","0.002","859.11","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","6-Chloro-2,3,4,5-tetrahydro-7,8-dimethoxy-1-(4-methoxyphenyl)-1H-3-benzazepine","","- C19 H22 Cl N O3 -","- C19 H22 Cl N O3 -","- C38 H44 Cl2 N2 O6 -","2","1","CV6382","Yan, Jizhong; Cheng, Dongping","6-Chloro-2,3,4,5-tetrahydro-7,8-dimethoxy-1-(4-methoxyphenyl)-1<i>H</i>-3-benzazepine","Acta Crystallographica Section E","2004","60","12","o2268","o2269","10.1107/S1600536804026248","","","0.71069","MoKα","","0.0663","0.0441","","","0.0988","0.1066","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204651","11.0108","0.0006","7.8652","0.0004","27.999","0.001","90","","90","","90","","2424.8","0.2","105","2","105","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","5-(2-Furyl)-3-hydroxy-1-phenylpenta-2,4-dien-1-one","","- C15 H12 O3 -","- C15 H12 O3 -","- C120 H96 O24 -","8","1","CV6401","Arrieta, Antonio F.; Mostad, Arvid","5-(2-Furyl)-3-hydroxy-1-phenylpenta-2,4-dien-1-one","Acta Crystallographica Section E","2004","60","12","o2444","o2446","10.1107/S1600536804030193","","","0.71073","MoKα","","0.0678","0.0302","","","0.0586","0.0615","","","","","","0.742","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204652","7.111","0.001","7.14","0.001","12.765","0.003","87.77","0.03","75.86","0.03","77.36","0.03","613.2","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Ethylenediammonium bis(3-carboxy-4-hydroxybenzenesulfonate) tetrahydrate","","- C16 H28 N2 O16 S2 -","- C16 H28 N2 O16 S2 -","- C16 H28 N2 O16 S2 -","1","0.5","CV6403","Gao, Shan; Huo, Li- Hua; Ng, Seik Weng","Ethylenediammonium bis(3-carboxy-4-hydroxybenzenesulfonate) tetrahydrate","Acta Crystallographica Section E","2004","60","12","o2197","o2198","10.1107/S1600536804027278","","","0.71073","MoKα","","0.05","0.044","","","0.134","0.143","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204653","22.802","0.004","14.879","0.002","14.635","0.002","90","","109.69","0.01","90","","4674.9","1.2","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","{2-[2'-(Diethylcarbamoylmethoxy)-1,1'-binaphthyl-2-yloxy]-N,N-diethylacetamide- κ^4^O}(2,4,6-trinitrophenolato)manganese(II)","","- C44 H40 Mn N8 O18 -","- C44 H40 Mn N8 O18 -","- C176 H160 Mn4 N32 O72 -","4","0.5","CV6404","Ya-Wen Wang; Yan-Ling Guo; Wei-Sheng Liu; Kai-Bei Yu","{2-[2'-(Diethylcarbamoylmethoxy)-1,1'-binaphth-2-yloxy]-<i>N</i>,<i>N</i>-diethylacetamide-κ^4^<i>O</i>}(2,4,6-trinitrophenolato)manganese(II)","Acta Crystallographica Section E","2004","60","12","m1801","m1802","10.1107/S1600536804028107","","","0.71073","MoKα","","0.0814","0.0399","","","0.0847","0.0937","","","","","","0.824","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204654","8.8214","0.0018","9.936","0.002","16.392","0.003","100.57","0.03","92.76","0.03","95.88","0.03","1401.6","0.5","263","2","263","2","","","","","","","","5","P -1","-P 1","2","","tetra-μ-methacrylato-κ^8^O:O'-bis[(pyridine-κN)copper(II)]","","- C26 H30 Cu2 N2 O8 -","- C26 H30 Cu2 N2 O8 -","- C52 H60 Cu4 N4 O16 -","2","1","CV6405","Wu, Bin; Wang, Guocheng","Tetra-μ-methacrylato-κ^8^<i>O</i>:<i>O</i>'-bis[(pyridine-κ<i>N</i>)copper(II)]","Acta Crystallographica Section E","2004","60","12","m1764","m1765","10.1107/S160053680402759X","","","0.71069","MoKα","","0.0475","0.0333","","","0.0743","0.0792","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204655","7.3916","0.0003","15.7043","0.0007","13.735","0.0005","90","","102.436","0.0013","90","","1556.95","0.11","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Benzylideneacetone 2,4-dinitrophenylhydrazone","","- C16 H14 N4 O4 -","- C16 H14 N4 O4 -","- C64 H56 N16 O16 -","4","1","CV6406","Shang Shan; Zheng Fan; Wei-Xiao Hu; Duan-Jun Xu","Benzylideneacetone 2,4-dinitrophenylhydrazone","Acta Crystallographica Section E","2004","60","12","o2473","o2475","10.1107/S1600536804029873","","","0.71069","MoKα","","0.064","0.048","","","0.117","0.127","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204656","7.585","0.002","8.443","0.002","10.631","0.003","67.801","0.004","74.187","0.004","85.328","0.005","606.3","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","1,1',8,8'-Tetramethoxy-10,10'-bianthrone","1,1',8,8'-tetramethoxy-9,9'-bianthracene-10,10'(9H,9'H)-dione","","- C32 H26 O6 -","- C32 H26 O6 -","- C32 H26 O6 -","1","0.5","CV6407","Shi, Zheng-Wei; Li, Yi-Zhi; Li, Ying; Lu, Guo-Yuan; Liu, Shan-Hui","1,1',8,8'-Tetramethoxy-10,10'-bianthrone","Acta Crystallographica Section E","2004","60","12","o2275","o2277","10.1107/S1600536804028168","","","0.71073","MoKα","","0.0737","0.059","","","0.1068","0.1154","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204657","9.6148","0.0016","8.9986","0.0016","19.437","0.003","90","","101.399","0.005","90","","1648.5","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1-[(2,4-Dichlorobenzoyl)methyl]-4-(N,N-dimethylamino)pyridinium bromide","","- C15 H15 Br Cl2 N2 O -","- C15 H15 Br Cl2 N2 O -","- C60 H60 Br4 Cl8 N8 O4 -","4","1","CV6408","Sundar, T. V.; Parthasarathi, V.; Sarkunam, K.; Nallu, M.; Walfort,B.; Lang, H.","1-[(2,4-Dichlorobenzoyl)methyl]-4-(<i>N,N</i>-dimethylamino)pyridinium bromide","Acta Crystallographica Section E","2004","60","12","o2345","o2346","10.1107/S1600536804029083","","","0.71073","MoKα","","0.035","0.0265","","","0.0668","0.0708","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204658","7.3357","0.0001","12.1537","0.0002","20.3204","0.0001","90","","90","","90","","1811.68","0.04","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","16α,17-epoxy-4-pregnene-3,20-dione","","- C21 H28 O3 -","- C21 H28 O3 -","- C84 H112 O12 -","4","1","CV6409","Shi Wang; Yongli Wang; Qiang Nie; Lina Zhou; Jiehua Wu","16α,17-Epoxy-4-pregnene-3,20-dione","Acta Crystallographica Section E","2004","60","12","o2337","o2338","10.1107/S1600536804029095","","","0.71073","MoKα","","0.0774","0.0381","","","0.0812","0.0924","","","","","","0.834","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204659","18.99","0.006","5.829","0.002","8.839","0.003","90","","90","","90","","978.4","0.6","293","2","293","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","(R,R)-N,N'-Bis(5-chloro-salicylidene)-1,2-cyclohexanediamine","(R,R)-4,4'-dichloro-2,2'-[cyclohexane-1,2-diylbis(nitrilomethylidyne)]diphenol","","- C20 H20 Cl2 N2 O2 -","- C20 H20 Cl2 N2 O2 -","- C40 H40 Cl4 N4 O4 -","2","0.5","CV6411","Yang, Ming-Hua; Li, Yi-Zhi; Zhu, Cheng-Jian; Pan, Yi; Liu, Shan-Hui","(<i>R</i>,<i>R</i>)-<i>N</i>,<i>N</i>'-Bis(5-chlorosalicylidene)-1,2-cyclohexanediamine","Acta Crystallographica Section E","2004","60","12","o2397","o2398","10.1107/S1600536804029319","","","0.71073","MoKα","","0.0628","0.0538","","","0.1492","0.1549","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204660","7.6851","0.0014","8.8523","0.0016","25.104","0.004","86.897","0.003","88.293","0.003","72.739","0.003","1628.4","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","1-(4-Chlorophenyl)3-(4-trifluoromethylbenzoylhydrazino)prop-2-en-1-one","","- C17 H12 Cl F3 N2 O2 -","- C17 H12 Cl F3 N2 O2 -","- C68 H48 Cl4 F12 N8 O8 -","4","2","CV6412","Li-Rong Wen; Wei-Si Guo; Ming Li; Xue-Mei Li; Shu-Sheng Zhang; Ping-Kai Ouyang; Zi-Qin Ke","1-(4-Chlorophenyl)-3-(4-trifluoromethylbenzoylhydrazino)-2-propenone","Acta Crystallographica Section E","2004","60","12","o2468","o2470","10.1107/S1600536804030223","","","0.71073","MoKα","","0.1031","0.0608","","","0.1556","0.189","","","","","","1.09","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2204661","10.1244","0.0019","10.571","0.002","11.508","0.002","95.838","0.003","107.625","0.003","104.906","0.003","1112.6","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-(4-Chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propan-1-one","","- C11 H10 Cl N3 O -","- C11 H10 Cl N3 O -","- C44 H40 Cl4 N12 O4 -","4","2","CV6414","Liang-Zhong Xu; Hai-Bin Song; Jin-Hong Liu; Kai Li; Guo-Dong Shi","1-(4-Chlorophenyl)-3-(1<i>H</i>-1,2,4-triazol-1-yl)propan-1-one","Acta Crystallographica Section E","2004","60","12","o2404","o2405","10.1107/S160053680402985X","","","0.71073","MoKα","","0.0629","0.0395","","","0.0991","0.1148","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204662","10.567","0.008","6.674","0.005","19.427","0.015","90","","91.715","0.012","90","","1369.5","1.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Captafol","2-(1,1,2,2-Tetrachloroethylsulfanyl)-3a,4,7,7a-tetrahydro-1H-isoindole- 1,3(2H)-dione","","- C10 H9 Cl4 N O2 S -","- C10 H9 Cl4 N O2 S -","- C40 H36 Cl16 N4 O8 S4 -","4","1","CV6417","Chopra, Deepak; Mohan, T. P.; Rao, K. S.; Guru Row, T. N.","2-(1,1,2,2-Tetrachloroethylsulfanyl)-3a,4,7,7a-tetrahydro-1<i>H</i>-isoindole-1,3(2<i>H</i>)-dione","Acta Crystallographica Section E","2004","60","12","o2406","o2407","10.1107/S1600536804029988","","","0.71073","MoKα","","0.1251","0.0967","","","0.2309","0.2309","","","","","","1.165","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204663","7.9107","0.0006","21.5276","0.0017","14.2691","0.0011","90","","94.573","0.002","90","","2422.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-Methoxycarbonyl-2-methyl-1H-benzimidazol-3-ium nitrate hemihydrate","","- C10 H12 N3 O5.5 -","- C10 H12 N3 O5.5 -","- C80 H96 N24 O44 -","8","2","CV6421","Cai-Feng Ding; Shu-Sheng Zhang; Xue-Mei Li; Hong Xu; Ping-Kai Ouyang","6-Methoxycarbonyl-2-methyl-1<i>H</i>-benzimidazol-3-ium nitrate hemihydrate","Acta Crystallographica Section E","2004","60","12","o2441","o2443","10.1107/S1600536804030235","","","0.71073","MoKα","","0.1924","0.0779","","","0.1911","0.2486","","","","","","0.974","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204664","5.82","0.0003","8.0891","0.0005","23.3254","0.0018","90","","90","","90","","1098.13","0.12","193","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H15 N O4 -","- C11 H15 N O4 -","- C44 H60 N4 O16 -","4","1","CV6422","Meltzer, Martin von; Marsch, Michael; Carell, Thomas; Harms, Klaus","(1<i>S</i>,2<i>R</i>,4<i>S</i>,5<i>R</i>)-<i>tert</i>-Butyl 7-oxo-3-oxa-6-azatricyclo[3.2.1.0^2,4^]octane-6-carboxylate","Acta Crystallographica Section E","2004","60","12","o2515","o2516","10.1107/S1600536804030879","","","0.71073","MoKα","","","0.0307","","","","0.0738","","","","","","1.012","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204665","5.806","0.0018","13.25","0.004","18.81","0.006","90","","90.802","0.007","90","","1446.9","0.8","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-Chloro-3-(4-chlorophenyl)-3,4-dihydroquinazolin-2(1H)-one‒acetone (2/1)","","- C15.5 H13 Cl2 N2 O1.5 -","- C15.5 H13 Cl2 N2 O1.5 -","- C62 H52 Cl8 N8 O6 -","4","1","DN6162","Da-Qing Shi; Zheng-Yi Li; Chunl-Ling Shi; Xiang-Shan Wang; Yong Zhang","6-Chloro-3-(4-chlorophenyl)-3,4-dihydroquinazolin-2(1<i>H</i>)-one acetone hemisolvate","Acta Crystallographica Section E","2004","60","12","o2465","o2467","10.1107/S160053680403020X","","","0.7107","MoKα","","0.0517","0.0471","","","0.1091","0.1119","","","","","","1.136","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2204666","23.939","0.005","7.143","0.0014","22.029","0.004","90","","113.73","0.03","90","","3448.4","1.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","2-(2-Fluoro-5-methylbenzoyl)-N-phenyl-2-(1H-1,2,4-triazol-1-yl)ethanethioamide","","- C18 H15 F N4 O S -","- C18 H15 F N4 O S -","- C144 H120 F8 N32 O8 S8 -","8","1","DN6167","Liangzhong Xu; Yongqi Qin; Chongyi Zhu; Shuanghua Yang; Kai Li","2-(2-Fluoro-5-methylbenzoyl)-<i>N</i>-phenyl-2-(1<i>H</i>-1,2,4-triazol-1-yl)ethanethioamide","Acta Crystallographica Section E","2004","60","12","o2207","o2208","10.1107/S1600536804027436","","","0.71073","MoKα","","0.1686","0.0639","","","0.0881","0.1104","","","","","","1.003","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204667","12.3833","0.0012","7.2297","0.0005","15.8926","0.0015","90","","95.488","0.007","90","","1416.3","0.2","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Benzyl-4-(4-methylphenyl)-1H-1,2,4-triazole-5(4H)-thione","","- C16 H15 N3 S -","- C16 H15 N3 S -","- C64 H60 N12 S4 -","4","1","DN6168","Sema Öztürk Yıldırım; Mehmet Akkurt; Metin Koparır; Ahmet Cansız; Memet Şekerci; Frank W. Heinemann","3-Benzyl-4-(4-methylphenyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2004","60","12","o2281","o2283","10.1107/S1600536804028302","","","0.71069","MoKα","","0.0616","0.038","","","0.077","0.0835","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204668","9.9388","0.0011","12.3703","0.0013","14.4034","0.0017","97.105","0.013","90.644","0.013","105.358","0.012","1692.7","0.3","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","Di-μ-chloro-bis[chloro(η^6^-1,2,4- trimethylbenzene)ruthenium(II)]‒dichloromethane (3/2)","","- C18.67 H35.33 Cl5.333 Ru2 -","- C18.6667 H25.3333 Cl5.33333 Ru2 -","- C56 H76 Cl16 Ru6 -","3","1.5","DN6170","Therrien, Bruno; Süss-Fink, Georg","Di-μ-chloro-bis[chloro(η^6^-1,2,4-trimethylbenzene)ruthenium(II)]‒dichloromethane (3/2)","Acta Crystallographica Section E","2004","60","12","m1766","m1768","10.1107/S160053680402745X","","","0.71073","MoKα","","0.0823","0.0525","","","0.1276","0.1356","","","","","","0.932","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204669","9.556","0.0003","15.4559","0.0005","12.0143","0.0003","90","","108.904","0.002","90","","1678.76","0.09","296","1","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H17 O P -","- C21 H17 O P -","- C84 H68 O4 P4 -","4","1","DN6171","Wei-Ming Xu; Xiu-Rong Hu; Jian-Ming Gu","[1-(Diphenylphosphinoyl)propa-1,2-dienyl]benzene","Acta Crystallographica Section E","2004","60","12","o2214","o2215","10.1107/S1600536804027710","","","0.7107","MoKα","","","0.051","","","","0.175","","","","","","1.007","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204670","7.036","0.002","10.336","0.003","13.814","0.003","90","","90","","90","","1004.6","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(4R,9S)-4-Hydroxymethyl-3,8-dioxa-1,6-diazaspiro[4.4]nonane-2,7-dithione monohydrate","","- C6 H10 N2 O4 S2 -","- C6 H10 N2 O4 S2 -","- C24 H40 N8 O16 S8 -","4","1","DN6173","Cioci, Gianluca; Leconte, Nicolas; Tatibouët, Arnaud; Rollin, Patrick; Pérez, Serge; Imberty, Anne","(4<i>R</i>,9<i>S</i>)-4-Hydroxymethyl-3,8-dioxa-1,6-diazaspiro[4.4]nonane-2,7-dithione monohydrate","Acta Crystallographica Section E","2004","60","12","o2399","o2401","10.1107/S1600536804029885","","","1.54178","CuKα","","0.0513","0.051","","","0.1297","0.1302","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204671","20.784","0.002","9.321","0.0006","11.9373","0.0011","90","","106.719","0.007","90","","2214.8","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Morpholinoethyl 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)- 4-methylhex-4-enoate","","- C23 H31 N O7 -","- C23 H31 N O7 -","- C92 H124 N4 O28 -","4","1","DN6174","Yathirajan, Hemmige S.; Nagaraj, Basavegowda; Gaonkar, Santhosh L.; Narasegowda, Rajenahally S.; Nagaraja, Padmarajaiah; Bolte, Michael","Mycophenolate mofetil","Acta Crystallographica Section E","2004","60","12","o2223","o2224","10.1107/S1600536804027539","","","0.71073","MoKα","","0.0576","0.0426","","","0.1136","0.1182","","","","","","0.968","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204672","12.0767","0.0011","19.3499","0.0012","7.8018","0.0007","90","","107.482","0.007","90","","1738.9","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H24 Cl N O3 -","- C18 H24 Cl N O3 -","- C72 H96 Cl4 N4 O12 -","4","1","DN6175","Yathirajan, Hemmige S.; Nagaraj, Basavegowda; Narasegowda, Rajenahally S.; Nagarajab, Padmarajaiah; Bolte, Michael","A monoclinic polymorph of isoxsuprine hydrochloride","Acta Crystallographica Section E","2004","60","12","o2228","o2229","10.1107/S1600536804027904","","","0.71073","MoKα","","0.0386","0.0332","","","0.0921","0.0949","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204673","11.4345","0.0007","11.4345","0.0007","9.8068","0.0012","90","","90","","90","","1282.22","0.19","295","2","295","2","","","","","","","","4","I 41","I 4bw","80","Diphenyltellurium dibromide","Dibromodiphenyltellurium","","- C12 H10 Br2 Te -","- C12 H10 Br2 Te -","- C48 H40 Br8 Te4 -","4","0.5","DN6177","Beckmann, Jens; Dakternieks, Dainis; Duthie, Andrew; Mitchell, Cassandra","Dibromodiphenyltellurium(IV)","Acta Crystallographica Section E","2004","60","12","o2511","o2512","10.1107/S1600536804028284","","","0.71073","MoKα","","0.0314","0.0287","","","0.0693","0.07","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204674","13.592","0.003","17.817","0.004","15.066","0.004","90","","100.238","0.003","90","","3590.4","1.5","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[η^6^-2-(2-Methylbenzoyloxy)ethyl methacrylate]bis(η^6^-1,2,4,5-tetramethylbenzene)tri-μ-hydrido-μ~3~-oxo- triruthenium(II)(3 Ru—Ru) tetrafluoroborate","","- C34 H47 B F4 O5 Ru3 -","- C34 H47 B F4 O5 Ru3 -","- C136 H188 B4 F16 O20 Ru12 -","4","1","DN6178","Vieille-Petit, Ludovic; Therrien, Bruno; Buryak, Andrey; Severin, Kay; Süss-Fink, Georg","[η^6^-2-(2-Methylbenzoyloxy)ethyl methacrylate]bis(η^6^-1,2,4,5-tetramethylbenzene)tri-μ-hydrido-μ~3~-oxo-triruthenium(II)(3 <i>Ru{—</i>Ru}) tetrafluoroborate","Acta Crystallographica Section E","2004","60","12","m1909","m1911","10.1107/S1600536804029642","","","0.71073","MoKα","","0.0882","0.0386","","","0.074","0.0868","","","","","","0.902","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204675","8.4613","0.0011","9.8923","0.0013","11.4305","0.0015","91.463","0.002","96.002","0.002","101.119","0.002","932.6","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","N-{3-Cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl}benzamide","","- C18 H9 Cl2 F3 N4 O -","- C18 H9 Cl2 F3 N4 O -","- C36 H18 Cl4 F6 N8 O2 -","2","1","DN6181","Zhong, Ping; Yang, Zhiping; Li, Shuyan; Tang, Riyuan","<i>N</i>-{3-Cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1<i>H</i>-pyrazol-5-yl}benzamide","Acta Crystallographica Section E","2004","60","12","o2395","o2396","10.1107/S1600536804029940","","","0.71073","MoKα","","0.0919","0.0664","","","0.1518","0.168","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204676","7.99","0.007","14.675","0.013","5.707","0.005","90","","104.271","0.013","90","","648.5","1","113","2","113","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[sodium(I)-μ~3~-bis(ethylenedioxy)borato]","","- C4 H8 B Na O4 -","- C4 H8 B Na O4 -","- C16 H32 B4 Na4 O16 -","4","0.5","ER6002","Gainsford, Graeme J.; Kemmitt, Tim","Poly[sodium(I)-μ~3~-bis(ethylenedioxy)borato]","Acta Crystallographica Section E","2004","60","12","m1943","m1944","10.1107/S160053680402999X","","","0.71073","MoKα","","0.0698","0.0491","","","0.1312","0.1405","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204677","8.3099","0.0017","9.896","0.002","16.986","0.003","75.95","0.03","75.93","0.03","87.62","0.03","1314.2","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","aqua[p-phenylenebis(dioxyacetato)-κO]tetrakis(1H-imidazole-κN^3^)nickel(II) monohydrate","","- C22 H28 N8 Ni O8 -","- C22 H28 N8 Ni O8 -","- C44 H56 N16 Ni2 O16 -","2","1","ER6004","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui; Zhao, Jing-Gui","Aqua(benzene-1,3-dioxyacetato-κ<i>O</i>)tetrakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)nickel(II) monohydrate","Acta Crystallographica Section E","2004","60","12","m1754","m1756","10.1107/S1600536804027709","","","0.71073","MoKα","","0.0714","0.046","","","0.1031","0.1116","","","","","","1.029","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204678","10.0255","0.0003","10.1273","0.0004","19.4485","0.0006","90","","91.931","0.002","90","","1973.51","0.12","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-(4-tert-Butylbenzyl)-3-phenylinden-1-one","","- C26 H24 O -","- C26 H24 O -","- C104 H96 O4 -","4","1","ER6005","Karban, James W.; Morgan, Jennifer L.; Dees, Johnna M.; Klausmeyer, Kevin K.","2-(4-<i>tert</i>-Butylbenzyl)-3-phenylinden-1-one","Acta Crystallographica Section E","2004","60","12","o2304","o2305","10.1107/S1600536804028399","","","0.71073","MoKα","","0.0684","0.047","","","0.1252","0.137","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204679","17.7935","0.0004","10.2712","0.0003","32.8924","0.0008","90","","100.002","0.0011","90","","5920.1","0.3","130","2","130","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2,2'-Bipyridyl-2-ium aqua(2,2'-bipyridyl-κ^2^N,N')tetakis(nitrato-κ^2^O,O')praseodymium(III) 2,2'-bipyridyl solvate","","- C50 H46 N18 O26 Pr2 -","- C50 H46 N18 O26 Pr2 -","- C200 H184 N72 O104 Pr8 -","4","0.5","FL6127","Charushnikova, Iraida A.; Den Auwer, Christophe","2,2'-Bipyridyl-2-ium aqua(2,2'-bipyridyl-κ^2^<i>N,N</i>')tetakis(nitrato-κ^2^<i>O,O</i>')praseodymium(III) 2,2'-bipyridyl hemisolvate","Acta Crystallographica Section E","2004","60","12","m1775","m1777","10.1107/S160053680402762X","","","0.71073","MoKα","","0.0357","0.0292","","","0.0649","0.0673","","","","","","1.132","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2204680","6.8202","0.0014","25.024","0.005","6.1958","0.0012","90","","90","","90","","1057.4","0.4","293","2","293","2","","","","","","","","5","P m m n :2","-P 2ab 2a","59","","catena-poly[[aquabis(p-nitrobenzoate-κO)copper(II)]- μ-1,4-diazabicyclo[2.2.2]octane-κ^2^N:N']","","- C20 H22 Cu N4 O9 -","- C20 H22 Cu N4 O9 -","- C40 H44 Cu2 N8 O18 -","2","0.25","FL6130","Zhi-Dong Lin; Lu, Jin-Yu","The infinite one-dimensional polymer <i>catena</i>-poly[[aquabis(<i>p</i>-nitrobenzoato-κ<i>O</i>)copper(II)]-μ-1,4-diazabicyclo[2.2.2]octane-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2004","60","12","m1798","m1800","10.1107/S1600536804027977","","","0.71073","MoKα","","0.0758","0.074","","","0.1635","0.1642","","","","","","1.377","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204681","8.703","0.002","13.791","0.003","19.623","0.004","90","","93.8","0.02","90","","2350","0.9","102","","102","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H27 N3 O8 Zn -","- C20 H27 N3 O8 Zn -","- C80 H108 N12 O32 Zn4 -","4","0.5","FL6131","R. Seth Baker; Richard E. Norman","Bis(acetato-κ<i>O</i>)[bis(2-pyridylmethyl)amine-κ^3^<i>N,N</i>',<i>N</i>'']zinc(II)‒acetic acid (1/2)","Acta Crystallographica Section E","2004","60","12","m1761","m1763","10.1107/S1600536804027618","","","0.7107","MoKα","","0.0765","0.0731","","0.1717","","0.1501","","","0.9898","","","1.0129","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204682","4.9589","0.0012","16.872","0.004","10.711","0.002","90","","94.53","0.005","90","","893.4","0.3","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[4-chloro-2-(2-hydroxyethyliminomethyl)phenolato-κ^2^N,O]copper(II)","","- C18 H18 Cl2 Cu N2 O4 -","- C18 H18 Cl2 Cu N2 O4 -","- C36 H36 Cl4 Cu2 N4 O8 -","2","0.5","FL6134","Huiyan Liu; Haiying Wang; Dezhong Niu; Zaisheng Lu","Bis[4-chloro-2-(2-hydroxyethyliminomethyl)phenolato-κ^2^<i>N,O</i>]copper(II)","Acta Crystallographica Section E","2004","60","12","m1941","m1942","10.1107/S1600536804029733","","","0.7107","MoKα","","0.0326","0.0293","","","0.0688","0.071","","","","","","1.122","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204683","7.7545","0.0002","23.8945","0.0006","9.4462","0.0002","90","","111.644","0.001","90","","1626.88","0.07","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Dichloro(tripyridyldiamine)cadmium(II)","(Tripyridyldiamino) Cadmium(II) chloride","","- C15 H13 Cd Cl2 N5 -","- C15 H13 Cd Cl2 N5 -","- C60 H52 Cd4 Cl8 N20 -","4","1","FL6135","Huang, Ling; Tang, Shi-Hua; Fang, Xiao-Niu; Zeng, Xi-Rui","[2,6-Bis(2-pyridylamino)pyridine]dichlorocadmium(II)","Acta Crystallographica Section E","2004","60","12","m1963","m1965","10.1107/S1600536804030351","","","0.71073","MoKα","","0.0364","0.0256","","","0.061","0.0638","","","","","","1.005","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204684","14.9111","0.0015","8.7445","0.0009","10.4465","0.001","90","","90","","90","","1362.1","0.2","198","2","198","2","","","","","","","","5","P n a 21","P 2c -2n","33","2-Hydroxy-2-phenyl-4,7-dihydroisophosphindolinium chloride","2-hydroxy-2-phenyl-1,3,4,7-tetrahydroisophosphindenium chloride","","- C14 H16 Cl O P -","- C14 H16 Cl O P -","- C56 H64 Cl4 O4 P4 -","4","1","GH6002","Andreas Decken; Erin D. Gill; Frank Bottomley","2-Hydroxy-2-phenyl-4,7-dihydroisophosphindolinium chloride","Acta Crystallographica Section E","2004","60","12","o2221","o2222","10.1107/S1600536804027606","","","0.71073","MoKα","","0.0264","0.0254","","","0.0649","0.0659","","","","","","1.063","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204685","9.452","0.004","9.629","0.005","15.136","0.005","74.051","0.018","79.192","0.012","60.608","0.01","1151.8","0.9","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","Diphenyl 2-(α,α,4-trichlorobenzyl)phenyl phosphate","","- C25 H18 Cl3 O4 P -","- C25 H18 Cl3 O4 P -","- C50 H36 Cl6 O8 P2 -","2","1","GH6003","Pinkus, A. G.; Klausmeyer, Kevin K.; Feazell, Rodney P.; Meng, Lily Y. C.; Chang, Tsung C.","Diphenyl 2-(α,α,4-trichlorobenzyl)phenyl phosphate","Acta Crystallographica Section E","2004","60","12","o2230","o2231","10.1107/S1600536804026066","","","0.71073","MoKα","","0.035","0.0283","","","0.0704","0.0726","","","","","","1.094","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204686","6.8504","0.0008","7.3247","0.0009","9.574","0.0011","87.965","0.002","85.299","0.002","64.705","0.002","432.87","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-(2-Pyridyl)pyrrolidine-2-thione","","- C9 H10 N2 S -","- C9 H10 N2 S -","- C18 H20 N4 S2 -","2","1","GH6004","Datt, Michael S.; Koning, Charles B. de; Fernandes, Manuel A.; Michael, Joseph P.","1-(2-Pyridyl)pyrrolidine-2-thione","Acta Crystallographica Section E","2004","60","12","o2298","o2300","10.1107/S160053680402820X","","","0.71073","MoKα","","0.0556","0.043","","","0.1219","0.1294","","","","","","1.099","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204687","7.3827","0.0009","14.1462","0.0017","18.077","0.002","90","","90","","90","","1887.9","0.4","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Prop-2-ynyl 1,2,3,4-tetra-O-acetyl-β-D-glucopyranuronate","","- C17 H20 O11 -","- C17 H20 O11 -","- C68 H80 O44 -","4","1","GH6005","Temelkoff, David P.; Norris, Peter; Zeller, Matthias","Prop-2-ynyl 1,2,3,4-tetra-<i>O</i>-acetyl-β-<small>D</small>-glucopyranuronate","Acta Crystallographica Section E","2004","60","12","o2273","o2274","10.1107/S1600536804028405","","","0.71073","MoKα","","0.0435","0.043","","","0.1053","0.1056","","","","","","1.191","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204688","8.851","0.002","9.858","0.002","17.255","0.003","90","","94.99","0.03","90","","1499.8","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-Methoxyphenyl)-2-(2-nitrophenoxy)propan-1-one","","- C16 H15 N O5 -","- C16 H15 N O5 -","- C64 H60 N4 O20 -","4","1","GH6006","Vencato, Ivo; Ferri, Pedro H.; Santos, Suzana C.; Santos, Lourivaldo S.; Lariucci, Carlito; Napolitano, Hamilton B.","1-(4-Methoxyphenyl)-2-(2-nitrophenoxy)propan-1-one","Acta Crystallographica Section E","2004","60","12","o2498","o2500","10.1107/S1600536804030260","","","0.71073","MoKα","","0.059","0.042","","","0.118","0.129","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204689","9.354","0.003","6.7787","0.0012","9.566","0.003","90","","102.72","0.005","90","","591.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","N-tert-Butyl-4-chloro-5-methyl-2-nitroaniline","","- C11 H15 Cl N2 O2 -","- C11 H15 Cl N2 O2 -","- C22 H30 Cl2 N4 O4 -","2","0.5","GH6007","Zhang, Ying; Feng, Tian-Yang; Li, Shu-Yi","<i>N</i>-<i>tert</i>-Butyl-4-chloro-5-methyl-2-nitroaniline","Acta Crystallographica Section E","2004","60","12","o2501","o2502","10.1107/S1600536804030570","","","0.71073","MoKα","","0.0634","0.036","","","0.0855","0.0985","","","","","","1.052","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204690","8.4851","0.0002","8.6566","0.0002","13.6425","0.0003","106.36","0.003","91.712","0.002","92.95","0.003","959.19","0.04","293","","293","","","","","","","","","4","P -1","-P 1","2","Trimethoprim hydrogenmalonate","2,4-diamino-5-(3,4,5-trimethoxybenzyl)pyrimidinium hydrogen malonate","","- C17 H22 N4 O7 -","- C17 H22 N4 O7 -","- C34 H44 N8 O14 -","2","1","HB6113","Madhukar Hemamalini; Packianathan Thomas Muthiah; Ray J. Butcher","Trimethoprim‒hydrogen malonate (1/1)","Acta Crystallographica Section E","2004","60","12","o2350","o2352","10.1107/S1600536804028867","","","1.54178","CuKα","","0.0567","0.054","","","0.1503","0.1555","","","","","","1.071","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204691","10.9455","0.0007","12.1212","0.0008","15.5145","0.0011","67.355","0.005","74.854","0.005","74.044","0.005","1798.2","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Bis(1,10-phenanthroline)(pyridine-2,6-dicarboxylato)cadmium(II)‒pyridine-2,6- dicarboxylic acid‒water (1/1/4)","","- C38 H32 Cd N6 O12 -","- C38 H29 Cd N6 O12 -","- C76 H58 Cd2 N12 O24 -","2","1","HB6114","Ramezanipour, Farshid; Aghabozorg, Hossein; Sheshmani, Shabnam; Moghimi, Abolghasem; Stoeckli-Evans, Helen","Bis(1,10-phenanthroline)(pyridine-2,6-dicarboxylato)cadmium(II)‒pyridine‒2,6-dicarboxylic acid‒water (1/1/4)","Acta Crystallographica Section E","2004","60","12","m1803","m1805","10.1107/S160053680402803X","","","0.71073","MoKα","","0.0341","0.0273","","","0.068","0.07","","","","","","1.023","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204692","15.4635","0.0008","24.1703","0.0011","28.5358","0.0011","90","","105.181","0.001","90","","10293.3","0.8","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","tetrakis(tetraphenylphosphonium) dodecacyano-hexahedro-tetratelluriumtetrarhenium(IV) trihydrate","","- C108 H86 N12 O3 P4 Re4 Te4 -","- C108 H80 N12 O3 P4 Re4 Te4 -","- C432 H320 N48 O12 P16 Re16 Te16 -","4","1","HB6116","Efremova, Olga A.; Mironov, Yuri V.; Kuratieva, Natalia V.; Fedorov, Vladimir E.","A new chalcocyanide cubane rhenium salt: tetrakis(tetraphenylphosphonium) dodecacyano-<i>hexahedro</i>-tetratelluriumtetrarhenate(IV) trihydrate","Acta Crystallographica Section E","2004","60","12","m1817","m1818","10.1107/S1600536804028454","","","0.71073","MoKα","","0.1489","0.0524","","","0.087","0.1031","","","","","","0.795","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204693","12.837","0.003","27.526","0.006","8.14","0.002","90","","90","","90","","2876.3","1.2","293","2","293","2","","","","","","","","6","F d d 2","F 2 -2d","43","Bis(pyridine-2-thione)dichlorocadmium(II)","Dichlorobis(pyridinium-2-thiolato)cadmium(II)","","- C10 H10 Cd Cl2 N2 S2 -","- C10 H10 Cd Cl2 N2 S2 -","- C80 H80 Cd8 Cl16 N16 S16 -","8","0.5","HB6120","Xiu-Jian Wang; Qing-Ling Ni; Xian-Shu Bi; Hong-Xia Jian","Dichlorobis(pyridinium-2-thiolato)cadmium(II)","Acta Crystallographica Section E","2004","60","12","m1859","m1860","10.1107/S1600536804029071","","","0.71073","MoKα","","0.0194","0.0183","","","0.0404","0.0407","","","","","","1.022","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204694","8.2685","0.0017","11.949","0.002","17.525","0.004","90","","103.64","0.03","90","","1682.6","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetraaquabis(4-carboxy-1H-imidazole-5-carboxylato-κ^2^N,O)calcium(II) monohydrate","","- C10 H16 Ca N4 O13 -","- C10 H16 Ca N4 O13 -","- C40 H64 Ca4 N16 O52 -","4","0.5","HB6121","Gao, Shan; Zhang, Xian-Fa; Huo, Li-Hua; Zhao, Hui","Tetraaquabis(4-carboxy-1<i>H</i>-imidazole-5-carboxylato-κ^2^<i>N,O</i>)calcium(II) monohydrate","Acta Crystallographica Section E","2004","60","12","m1790","m1792","10.1107/S1600536804028132","","","0.71073","MoKα","","0.041","0.035","","","0.094","0.097","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204695","10.266","0.002","26.359","0.005","13.462","0.003","90","","91.62","0.03","90","","3641.4","1.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(9-hydroxyfluorene-9-carboxylato-κ^2^O,O')tripyridinecadmium(II)","","- C43 H33 Cd N3 O6 -","- C43 H33 Cd N3 O6 -","- C172 H132 Cd4 N12 O24 -","4","1","HB6122","Gao, Shan; Huo, Li-Hua; Lu, Zhen-Zhong; Zhao, Hui","Bis(9-hydroxyfluorene-9-carboxylato-κ^2^<i>O,O</i>')tripyridinecadmium(II)","Acta Crystallographica Section E","2004","60","12","m1793","m1795","10.1107/S1600536804028181","","","0.71073","MoKα","","0.0414","0.0374","","","0.0997","0.1024","","","","","","1.054","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204696","9.4084","0.0019","10.062","0.002","11.13","0.002","108.46","0.03","111.04","0.03","95.46","0.03","906.5","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Poly[[bis(1H-imidazole-κN^3^)cadmium(II)]-μ~3~-benzene-1,3-dioxyacetato]","poly[[bis(1H-imidazole-κN^3^)cadmium(II)]-μ~3~-m-phenylenebis(oxyacetato)]","","- C16 H16 Cd N4 O6 -","- C16 H16 Cd N4 O6 -","- C32 H32 Cd2 N8 O12 -","2","1","HB6123","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui; Zhao, Jing-Gui","Poly[[bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)cadmium(II)]-μ~3~-benzene-1,3-dioxyacetato]","Acta Crystallographica Section E","2004","60","12","m1878","m1880","10.1107/S160053680402923X","","","0.71073","MoKα","","0.03","0.029","","","0.07","0.071","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204697","15.713","0.003","12.798","0.002","13.806","0.003","90","","109.468","0.009","90","","2617.6","0.9","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Aquapentakis(1H-imidazole-κN^3^)cobalt(II) dibromosuccinate","","- C19 H24 Br2 Co N10 O5 -","- C19 H24 Br2 Co N10 O5 -","- C76 H96 Br8 Co4 N40 O20 -","4","0.5","HB6124","Dai-Xi Li; Duan-Jun Xu; Yuan-Zhi Xu","Aquapentakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)cobalt(II) dibromosuccinate","Acta Crystallographica Section E","2004","60","12","m1892","m1894","10.1107/S1600536804029381","","","0.71073","MoKα","","0.055","0.037","","","0.084","0.089","","","","","","1.049","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204698","13.05","0.003","28.521","0.006","8.065","0.002","90","","90","","90","","3001.8","1.2","293","2","293","2","","","","","","","","6","F d d 2","F 2 -2d","43","","Dibromobis(pyridinium-2-thiolato-κS)cadmium(II)","","- C10 H10 Br2 Cd N2 S2 -","- C10 H10 Br2 Cd N2 S2 -","- C80 H80 Br16 Cd8 N16 S16 -","8","0.5","HB6128","Xiu-Jian Wang; Qing-Ling Ni; Zhong-Shu Shen","Dibromobis[pyridine-2(1<i>H</i>)-thione-κ<i>S</i>]cadmium(II)","Acta Crystallographica Section E","2004","60","12","m1918","m1919","10.1107/S1600536804029903","","","0.71073","MoKα","","0.0218","0.0199","","","0.046","0.0465","","","","","","0.993","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204699","11.53","0.002","17.118","0.002","15.285","0.002","90","","90","","90","","3016.8","0.7","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","t-Butyl diphenylphosphinate","","- C16 H19 O2 P -","- C16 H19 O2 P -","- C128 H152 O16 P8 -","8","1","HG6097","I. Darren Grice; Ian D. Jenkins; W. Ken Busfield; Karl A. Byriel; Colin H. L. Kennard","<i>tert</i>-Butyl diphenylphosphinate","Acta Crystallographica Section E","2004","60","12","o2384","o2385","10.1107/S1600536804029435","","","0.71073","MoKα","","0.2419","0.0393","","","0.0872","0.142","","","","","","0.9","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204700","8.49","0.004","13.971","0.002","18.552","0.008","90","","90.15","0.02","90","","2200.5","1.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","trans-1-(1,1,3,3-tetramethyl-2,3-dihydro-1H-isoindol-2-yloxy) 2-dimethoxy-phosphinoyl-1-phenylethene","trans-1-(1,1,3,3-tetramethyl-2,3-dihydro-1H-isoindol-2-yloxy) -2-dimethoxy-phosphinoyl-1-phenylethene","","- C22 H28 N O4 P -","- C22 H28 N O4 P -","- C88 H112 N4 O16 P4 -","4","1","HG6099","I. Darren Grice; Ian D. Jenkins; W. Ken Busfield; Karl A. Byriel; Colin H. L. Kennard","<i>trans</i>-2-(Dimethoxyphosphinoyl)-1-phenyl-1-(1,1,3,3-tetramethyl-2,3-dihydro-1<i>H</i>-isoindol-2-yloxy)ethene","Acta Crystallographica Section E","2004","60","12","o2386","o2387","10.1107/S1600536804029447","","","0.71073","Mokα","","0.0985","0.0569","","","0.1806","0.1997","","","","","","1.368","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204701","9.165","0.002","12.03","0.004","9.812","0.004","90","","98.69","0.03","90","","1069.4","0.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","3-(4-pyridyl)-4-phenyl-4H-1,2,4-triazole","3-(4-pyridyl)-4-phenyl-4H-1,2,4-triazole","","- C13 H10 N4 -","- C13 H10 N4 -","- C52 H40 N16 -","4","1","HG6100","Mazur, Liliana; Koziol, Anna E.; Modzelewska-Banachiewicz, Bozena","C—H···N contacts in 4-phenyl-3-(4-pyridyl)-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2004","60","12","o2287","o2289","10.1107/S1600536804028417","","","1.54178","CuKα","","0.2608","0.0568","","","0.087","0.1257","","","","","","0.955","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204702","7.741","0.002","7.053","0.001","21.945","0.004","90","","96.99","0.03","90","","1189.2","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","4-(4-methylphenyl)-3-(4-pyridyl)-4H-1,2,4-triazole","4-(4-methylphenyl)-3-(4-pyridyl)-4H-1,2,4-triazole","","- C14 H12 N4 -","- C14 H12 N4 -","- C56 H48 N16 -","4","1","HG6101","Mazur, Liliana; Koziol, Anna E.; Modzelewska-Banachiewicz, Bozena","4-(4-Methylphenyl)-3-(4-pyridyl)-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2004","60","12","o2244","o2246","10.1107/S160053680402776X","","","1.54178","CuKα","","0.1617","0.0561","","","0.1274","0.1698","","","","","","0.991","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204703","10.262","0.009","10.767","0.01","13.437","0.012","81.79","0.014","82.515","0.013","84.724","0.014","1453","2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","catena-poly[[[μ-di-4-pyridyldiazene-κ^2^N^4^:N^4'^-bis[(triphenylphosphine- κP)copper(I)]]-μ-pyridine-2-carbaldehyde azine-κN^2^,N:N',N^2'^] bis(tetrafluoroborate)]","","- C58 H48 B2 Cu2 F8 N8 P2 -","- C58 H48 B2 Cu2 F8 N8 P2 -","- C58 H48 B2 Cu2 F8 N8 P2 -","1","0.5","HG6102","Ming-Ming, Yu; Wen-Fu, Fu; Zhan-Xian, Li; Zu-Fu, Yao; Lin-Fang, Jia","<i>catena</i>-Poly[[[μ-di-4-pyridyldiazene-κ^2^<i>N</i>^4^:<i>N</i>^4'^-bis[(triphenylphosphine-κ<i>P</i>)copper(I)]]-μ-pyridine-2-carbaldehyde azine-κ<i>N</i>^2^,<i>N</i>:<i>N</i>',<i>N</i>^2'^] bis(tetrafluoroborate)]","Acta Crystallographica Section E","2004","60","12","m1897","m1899","10.1107/S1600536804029253","","","0.71073","MoKα","","0.0986","0.0669","","","0.1855","0.2102","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204704","10.979","0.005","11.48","0.005","11.694","0.006","90","","103.508","0.008","90","","1433.1","1.2","273","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4-Bis(2-pyridylsulfanyl)butane","","- C14 H16 N2 S2 -","- C14 H16 N2 S2 -","- C56 H64 N8 S8 -","4","1","HG6103","Xie, Ya-Bo; Li, Jian-Rong","1,4-Bis(2-pyridylsulfanyl)butane","Acta Crystallographica Section E","2004","60","12","o2311","o2312","10.1107/S1600536804027230","","","0.71073","MoKα","","0.146","0.0486","","","0.0634","0.0804","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204705","15.4067","0.0015","13.3329","0.0013","7.7173","0.0007","90","","103.117","0.002","90","","1543.9","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6-(2,4-Difluorophenyl)-3-(2-methylphenyl)-7H-1,2,4- triazolo[3,4-b][1,3,4]thiadiazine","","- C17 H12 F2 N4 S -","- C17 H12 F2 N4 S -","- C68 H48 F8 N16 S4 -","4","1","HG6104","Guang-Qi Xiang; Li-Xue Zhang; An-Jiang Zhang; Xiao-Qing Cai; Mao-Lin Hu","6-(2,4-Difluorophenyl)-3-(3-methylphenyl)-7<i>H</i>-1,2,4-triazolo[3,4-<i>b</i>][1,3,4]thiadiazine","Acta Crystallographica Section E","2004","60","12","o2249","o2251","10.1107/S1600536804027771","","","0.71073","MoKα","","0.0958","0.0795","","","0.1801","0.1949","","","","","","1.286","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204706","7.3373","0.0004","9.5498","0.0005","23.9163","0.0012","90","","97.498","0.001","90","","1661.48","0.15","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(η^6^-fluorene)(η^5^-cyclopentadienyl) iron hexafluorophosphate","(η^5^-Cyclopentadienyl)(η^6^-9H-fluorene)iron hexafluorophosphate","","- C18 H15 F6 Fe P -","- C18 H15 F6 Fe P -","- C72 H60 F24 Fe4 P4 -","4","1","HG6105","Andreas Decken","(η^5^-Cyclopentadienyl)(η^6^-9<i>H</i>-fluorene)iron(II) hexafluorophosphate","Acta Crystallographica Section E","2004","60","12","m1796","m1797","10.1107/S1600536804028077","","","0.71073","MoKα","","0.0546","0.0346","","","0.0878","0.0922","","","","","","0.972","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204707","7.646","0.003","8.325","0.003","12.803","0.005","73.321","0.006","79.042","0.007","68.23","0.006","721.8","0.5","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","1-(2,6-Dihydroxyphenyl)ethanone","","- C8 H8 O3 -","- C8 H8 O3 -","- C32 H32 O12 -","4","2","HG6106","Hua-Rong Huang; Xue-Kui Xia; Zhi-Gang She; Yong-Cheng Lin; L. L. P. Vrijmoed; E. B. Gareth Jones","1-(2,6-Dihydroxyphenyl)ethanone","Acta Crystallographica Section E","2004","60","12","o2509","o2510","10.1107/S1600536804030600","","","0.71073","MoKα","","0.0693","0.0413","","","0.1053","0.1217","","","","","","1.029","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204708","8.0662","0.0002","11.0937","0.0002","12.7589","0.0003","101.626","0.0009","90.1675","0.001","103.4","0.0011","1086.37","0.04","150","","150","","","","","","","","","6","P -1","-P 1","2","","Di-μ-chloro-bis[(N-tert-butylimido)chlorobis(pyridine-κN)titanium(IV)] benzene disolvate","","- C40 H38 Cl4 D12 N6 Ti2 -","- C40 H50 Cl4 N6 Ti2 -","- C40 H50 Cl4 N6 Ti2 -","1","0.5","HG6108","Nilay Hazari; Andrew R. Cowley; Philip Mountford","Di-μ-chloro-bis[(<i>N</i>-<i>tert</i>-butylimido)chlorobis(pyridine-κ<i>N</i>)titanium(IV)] perdeuterobenzene disolvate","Acta Crystallographica Section E","2004","60","12","m1844","m1846","10.1107/S160053680402865X","","","0.71073","MoKα","","0.0418","0.0301","","0.0455","0.0365","0.0365","","","","","","1.0289","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204709","7.8474","0.0012","8.466","0.0014","14.033","0.003","90","","90","","90","","932.3","0.3","293","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H11 N O2 -","- C11 H11 N O2 -","- C44 H44 N4 O8 -","4","1","HG6109","Baumer, Vyacheslav N.; Shishkin, Oleg V.; Ukrainets, Igor V.; Sidorenko, Lyudmila V.; Samer A. El Kayal","1-Ethyl-4-hydroxyquinolin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2004","60","12","o2356","o2358","10.1107/S1600536804029241","","","0.71073","MoKα","","","0.036","","","","0.103","","","","","","0.97","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204710","7.0789","0.0006","8.465","0.0006","21.4774","0.0013","90","","96.492","0.005","90","","1278.74","0.16","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-(2-Furyl)-4-(4-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione","","- C13 H11 N3 O2 S -","- C13 H11 N3 O2 S -","- C52 H44 N12 O8 S4 -","4","1","HG6110","Sema Öztürk Yıldırım; Mehmet Akkurt; Metin Koparır; Ahmet Cansız; Memet Şekerci; Frank W. Heinemann","3-(2-Furyl)-4-(4-methoxyphenyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2004","60","12","o2368","o2370","10.1107/S1600536804029423","","","0.71069","MoKα","","0.0505","0.0355","","","0.079","0.084","","","","","","1.024","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204711","4.629","0.0001","5.703","0.0001","21.711","0.0006","87.494","0.001","85.631","0.001","78.312","0.002","559.4","0.02","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","1,4-Bis[2-(6-bromohexyl)-2H-tetrazol-5-yl]benzene","","- C20 H28 Br2 N8 -","- C20 H28 Br2 N8 -","- C20 H28 Br2 N8 -","1","0.5","HG6111","Fleming, Adrienne F. M.; Fintan Kelleher; Mahon, Mary F.; McGinley, John; Molloy, Kieran C.; Prajapati, Vipa","1,4-Bis[2-(6-bromohexyl)-2<i>H</i>-tetrazol-5-yl]benzene","Acta Crystallographica Section E","2004","60","12","o2388","o2389","10.1107/S1600536804029770","","","0.71073","MoKα","","0.0583","0.0478","","","0.1222","0.1307","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204712","17.336","0.002","16.587","0.0019","21.125","0.003","90","","91.127","0.01","90","","6073.4","1.3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[cis-Re(CO)~2~(PPh~3~)(dpkO,OH)].0.5dmso","cis-Tris(carbonyl-κC)(triphenylphosphine-κP)[hydroxytris(2-pyridyl) methanolato-κ^3^N,O,N']rhenium(I)] dimethyl sulfoxide hemisolvate","","- C32 H27 N2 O4.5 P Re S0.5 -","- C32 H27 N2 O4.5 P Re S0.5 -","- C256 H216 N16 O36 P8 Re8 S4 -","8","2","HG6115","Bakir, Mohammed; Hassan, Ishmael","<i>cis</i>-Dicarbonyl(hydroxydi-2-pyridylmethanolato-κ^3^<i>N</i>,<i>O</i>,<i>N</i>')(triphenylphosphine-κ<i>P</i>)rhenium(I) dimethyl sulfoxide hemisolvate","Acta Crystallographica Section E","2004","60","12","m1966","m1969","10.1107/S160053680403034X","","","0.71073","MoKα","","0.047","0.0337","","","0.0745","0.0797","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204713","8.9885","0.0015","5.7445","0.0012","15.471","0.003","90","","98.749","0.015","90","","789.5","0.3","302","","302","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H14 Cl2 N4 O4 -","- C14 H14 Cl2 N4 O4 -","- C28 H28 Cl4 N8 O8 -","2","0.5","HG6117","Hiroyuki Ishida","Bis(3-methylpyrazolium) chloranilate","Acta Crystallographica Section E","2004","60","12","o2506","o2508","10.1107/S1600536804030648","","","0.71073","MoKα","","0.101","0.043","","","0.089","0.103","","","","","","1.04","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204714","8.8828","0.0017","10.271","0.002","14.408","0.003","90","","104.306","0.017","90","","1273.8","0.4","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","(cis-syn-cis-Dicyclohexano-18-crown-6)potassium chlorochromate","cis-syn-cis- icosahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecin)potassium chlorochromate","","- C20 H36 Cl Cr K O9 -","- C20 H36 Cl Cr K O9 -","- C40 H72 Cl2 Cr2 K2 O18 -","2","1","IS6008","Kotlyar, Sergey A.; Zubatyuk, Roman I.; Zhigalko, Marina V.; Shishkin, Oleg V.; Chuprin, Gennady N.; Kiriyak, Andrey V.; Kamalov, Gerbert L.","(<i>cis</i>-<i>syn</i>-<i>cis</i>-Dicyclohexano-18-crown-6)potassium chlorochromate","Acta Crystallographica Section E","2004","60","12","m1847","m1848","10.1107/S1600536804028090","","","0.71073","MoKα","","0.0714","0.0376","","","0.0852","0.0906","","","","","","0.928","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204715","6.215","0.007","7.491","0.007","14.461","0.015","90","","98.68","0.08","90","","665.5","1.2","95","2","95","2","","","","","","","","3","P 1 21 1","P 2yb","4","Hyperolactone C","(5S,9S)-9-methyl-2-phenyl-9-vinyl-1,7-dioxaspiro[4.4]non-2-ene-4,6-dione","","- C16 H14 O4 -","- C16 H14 O4 -","- C32 H28 O8 -","2","1","IS6009","Sara L. Crockett; Wolfgang Schühly; Ferdinand Belaj; Ikhlas A. Khan","Hyperolactone C","Acta Crystallographica Section E","2004","60","12","o2174","o2176","10.1107/S1600536804026819","","","0.71069","MoKα","","0.0992","0.0677","","","0.1363","0.1535","","","","","","1.08","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204716","6.359","0.002","21.158","0.005","15.374","0.005","90","","95.43","0.02","90","","2059.2","1.1","173.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","tert-butoxycarbonyl-L-allo-isoleucyl-N-α-methyl-L-valine","","- C17 H32 N2 O5 -","- C17 H32 N2 O5 -","- C68 H128 N8 O20 -","4","2","IS6011","Oku, Hiroyuki; Naito, Ryo; Yamada, Keiichi; Katakai, Ryoichi","A synthetic fragment of a cyclic depsipeptide, aureobasidine A: <i>tert</i>-butoxycarbonyl-<small>L</small>-<i>allo</i>-isoleucyl-<i>N</i>-methyl-<small>L</small>-valine (Boc-<small>L</small>-<i>allo</i>-Ile-<small>L</small>-MeVal-OH)","Acta Crystallographica Section E","2004","60","12","o2261","o2263","10.1107/S1600536804028089","","","1.5418","CuKα","","","0.058","","","","0.116","","","","","","1.017","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204717","10.1833","0.0009","21.535","0.0016","11.5029","0.0011","90","","107.725","0.007","90","","2402.8","0.4","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,2,4,5-Tetrakis(2-tert-butyl-4-methylphenoxymethyl)benzene","","- C54 H70 O4 -","- C54 H70 O4 -","- C108 H140 O8 -","2","0.5","IS6012","Burcu Arslan; Canan Kazak; Nesuhi Akdemir; Cihan Kantar; Erbil Aǧar","1,2,4,5-Tetrakis(2-<i>tert</i>-butyl-4-methylphenoxymethyl)benzene","Acta Crystallographica Section E","2004","60","12","o2378","o2379","10.1107/S1600536804029617","","","0.71073","MoKα","","0.1357","0.0721","","","0.1382","0.161","","","","","","1.04","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204718","9.833","0.008","18.994","0.017","6.713","0.008","90","","90","","90","","1254","2","173.1","","","","","","","","","","","4","P 21 21 2","P 2 2ab","18","","(2R)-2-N-(tert-Butoxycarbonyl)-Amino-3-Methyl-1,3-Butanediol","","- C10 H21 N O4 -","- C10 H21 N O4 -","- C40 H84 N4 O16 -","4","1","IS6014","Oku, Hiroyuki; Naito, Ryo; Yamada, Keiichi; Katakai, Ryoichi","A synthetic intermediate of enantiopure <i>N</i>-protected β-hydroxyvaline, (2<i>R</i>)-2-[<i>N</i>-(<i>tert</i>-butoxycarbonyl)amino]-3-methylbutane-1,3-diol","Acta Crystallographica Section E","2004","60","12","o2462","o2464","10.1107/S1600536804030363","","","1.5418","CuKα","","","0.085","","","","0.244","","","","","","1.067","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2204719","10.36","0.002","9.6427","0.0019","14.352","0.003","90","","91.36","0.03","90","","1433.3","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[(1,10-phenanthroline-κ^2^N,N')copper(II)]-μ- 4-carboxyimidazole-5-carboxylato(2-)-κ^4^N,O:N,O']","","- C17 H10 Cu N4 O4 -","- C17 H10 Cu N4 O4 -","- C68 H40 Cu4 N16 O16 -","4","1","IS6015","Gu, Chang-Sheng; Gao, Shan; Huo, Li-Hua; Zhao, Hui; Zhao, Jing-Gui","<i>catena</i>-Poly[[(1,10-phenanthroline-κ^2^<i>N,N</i>')copper(II)]-μ-4-carboxyimidazole-5-carboxylato(2‒)-κ^4^<i>N</i>,<i>O</i>:<i>N</i>',<i>O</i>']","Acta Crystallographica Section E","2004","60","12","m1852","m1854","10.1107/S1600536804029149","","","0.71073","MoKα","","0.1115","0.055","","","0.1038","0.1235","","","","","","1.015","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204720","7.842","0.002","11.324","0.003","14.84","0.004","90","","90","","90","","1317.8","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-Amino-4-(2,5-dichlorophenyl)-5-(1H-1,2,4-triazol-1-yl)-1,3-thiazole","","- C11 H7 Cl2 N5 S -","- C11 H7 Cl2 N5 S -","- C44 H28 Cl8 N20 S4 -","4","1","IS6016","Shao, ling; Jin, Zhong; Liu, Jian-Bing; Zhou, Xin; Zhang, Qing; Hu, Yan; Fang, Jian-Xin","2-Amino-4-(2,5-dichlorophenyl)-5-(1<i>H</i>-1,2,4-triazol-1-yl)-1,3-thiazole","Acta Crystallographica Section E","2004","60","12","o2517","o2519","10.1107/S160053680403079X","","","0.71073","MoKα","","0.0335","0.0264","","","0.0587","0.0625","","","","","","1.074","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204721","10.0472","0.0004","11.309","0.0005","14.9321","0.0005","90","","90","","90","","1696.64","0.12","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","catena-Poly[[[diaquacobalt(II)]-μ-tartarato-κ^4^O,O':O'',O'''] monohydrate]","","- C4 H10 Co O9 -","- C4 H10 Co O9 -","- C32 H80 Co8 O72 -","8","1","IS6017","Dai-Xi Li; Duan-Jun Xu; Yuan-Zhi Xu","<i>catena</i>-Poly[[[diaquacobalt(II)]-μ-tartrato-κ^4^<i>O,O</i>':<i>O</i>'',<i>O</i>'''] monohydrate]","Acta Crystallographica Section E","2004","60","12","m1982","m1984","10.1107/S1600536804030806","","","0.71073","MoKα","","0.035","0.03","","","0.072","0.074","","","","","","1.138","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204722","9.4614","0.0008","10.0012","0.0009","8.4042","0.0007","90","","93.028","0.002","90","","794.14","0.12","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis[chloro(4-amino-1,2,4-triazole-5-thione)]copper(II) dihydrate","","- C6 H16 Cl2 Cu N8 O2 S2 -","- C6 H16 Cl2 Cu N8 O2 S2 -","- C12 H32 Cl4 Cu2 N16 O4 S4 -","2","0.5","IS6019","Xiao-Qing Cai; Li-Xue Zhang; Guang-qi Xiang; An-Jiang Zhang; Mao-Lin Hu","Bis[4-amino-3-methyl-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione]dichlorocopper(II) dihydrate","Acta Crystallographica Section E","2004","60","12","m1980","m1981","10.1107/S1600536804030818","","","0.71073","MoKα","","0.0265","0.0252","","","0.0657","0.0665","","","","","","1.115","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204723","14.606","0.002","5.8056","0.0006","27.037","0.004","90","","99.032","0.011","90","","2264.2","0.5","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-(4-Fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile","","- C15 H10 F N O -","- C15 H10 F N O -","- C120 H80 F8 N8 O8 -","8","2","KP6010","Yathirajan, Hemmige S.; Nagaraj, Basavegowda; Gaonkar, Santhosh L.; Narasegowda, Rajenahally S.; Nagaraja, Padmarajaiah; Bolte, Michael","1-(4-Fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile","Acta Crystallographica Section E","2004","60","12","o2225","o2227","10.1107/S1600536804027485","","","0.71073","MoKα","","0.0622","0.0391","","","0.0888","0.0969","","","","","","0.879","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204724","12.3571","0.0001","12.3571","0.0001","38.6211","0.0006","90","","90","","90","","5897.36","0.11","180","2","180","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Bis(2,2':6',2''-terpyridyl-κ^3^N)manganese(II) bis(nitrate) dihydrate","","- C30 H26 Mn N8 O8 -","- C30 H26 Mn N8 O8 -","- C240 H208 Mn8 N64 O64 -","8","0.5","KP6011","Rompel, Annette; Bond, Andrew D.; McKenzie, Christine J.","Bis(2,2':6',2''-terpyridyl-κ^3^<i>N</i>)manganese(II) dinitrate dihydrate","Acta Crystallographica Section E","2004","60","12","m1759","m1760","10.1107/S1600536804027643","","","0.71073","MoKα","","0.0703","0.0495","","","0.1398","0.1528","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204725","16.1111","0.0006","13.7316","0.0005","20.1356","0.001","90","","111.277","0.001","90","","4151","0.3","180","2","180","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","μ-oxo-bis(μ-2-furancarboxylato)bis(N-methyl-N,N-bis(2-pyridylmethyl)amine) diiron(III) bis(perchlorate) methanol solvate","","- C37 H40 Cl2 Fe2 N6 O16 -","- C37 H40 Cl2 Fe2 N6 O16 -","- C148 H160 Cl8 Fe8 N24 O64 -","4","0.5","KP6012","Nielsen, Anne.; Bond, Andrew D.; McKenzie, Christine J.","μ-Oxo-bis(μ-2-furancarboxylato)bis{[<i>N</i>-methyl-<i>N</i>,<i>N</i>-bis(2-pyridylmethyl)amine]iron(III)} bis(perchlorate) methanol solvate","Acta Crystallographica Section E","2004","60","12","m1959","m1960","10.1107/S1600536804030375","","","0.71073","MoKα","","0.07","0.0434","","","0.1072","0.12","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204726","18.627","0.0003","7.316","0.0001","21.234","0.0005","90","","93.184","0.0007","90","","2889.2","0.09","150","1","150","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,3,5-Trichloro-1λ^6^,2,4,6-thiatriazin-1-one","","- C2 Cl3 N3 O S -","- C2 Cl3 N3 O S -","- C32 Cl48 N48 O16 S16 -","16","4","KP6013","Clark, Timothy J.; Lough, Alan J.; Chivers, Tristram; Manners, Ian","1,3,5-Trichloro-1λ^6^,2,4,6-thiatriazin-1-one","Acta Crystallographica Section E","2004","60","12","o2402","o2403","10.1107/S160053680402971X","","","0.71073","MoKα","","0.0504","0.0324","","","0.0684","0.0749","","","","","","1.017","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204727","17.877","0.0007","7.4072","0.0003","16.4214","0.0006","90","","94.187","0.004","90","","2168.69","0.15","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6-Benzylamino-2-(2-hydroxyethylamino)-9-methylpurin-1,7-ium diperchlorate monohydrate","","- C15 H22 Cl2 N6 O10 -","- C15 H22 Cl2 N6 O10 -","- C60 H88 Cl8 N24 O40 -","4","1","KP6016","Trávníček, Zdeněk; Kryštof, Vladimír","6-Benzylamino-2-(2-hydroxyethylamino)-9-methylpurine-1,7-diium bis(perchlorate) monohydrate","Acta Crystallographica Section E","2004","60","12","o2324","o2327","10.1107/S160053680402896X","","","0.71073","MoKα","","0.0476","0.0456","","","0.1181","0.12","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204728","15.291","0.004","18.973","0.004","9.831","0.002","90","","97.92","0.018","90","","2824.9","1.1","100","1","100","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis(1,3-diphenyl-1,3-propanedionato-κ^2^O,O')oxo(pyridine-κN)vanadium(IV)","","- C35 H27 N O5 V -","- C35 H27 N O5 V -","- C140 H108 N4 O20 V4 -","4","1","KP6017","Meštrović, Ernest; Bučar, Dejan-Krešimir; Halasz, Ivan; Stilinović, Vladimir","The first adduct of bis(1,3-diphenyl-1,3-propanedionato)oxovanadium(IV)","Acta Crystallographica Section E","2004","60","12","m1920","m1922","10.1107/S1600536804029915","","","0.71073","MoKα","","0.0646","0.0379","","","0.0726","0.0805","","","","","","0.943","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204729","13.031","0.001","11.0503","0.0009","17.358","0.001","90","","104.654","0.001","90","","2418.2","0.3","120","0.2","120","0.2","","","","","","","","5","P 1 21 1","P 2yb","4","asc9o","ascidiacyclamide analogue No.9 cyclo(Ile-D-aThr(3R)-D-Val-Thz-Ile-D-Oxz(3S)-D-Val-Thz) isoleucyl-D-","","- C42 H68 N10 O9 S2 -","- C42 H68 N10 O9 S2 -","- C84 H136 N20 O18 S4 -","2","1","KP6018","Akiko Asano; Mitsunobu Doi","Turn-over of an oxazoline ring induced by chiral change of a folded ascidiacyclamide analogue: cyclo(Ile-<small>D</small>‒aThr‒<small>D</small>-Val‒Thz‒Ile‒<small>D</small>-Oxz‒<small>D</small>-Val‒Thz) <i>N,N</i>-dimethylformamide disolvate","Acta Crystallographica Section E","2004","60","12","o2449","o2451","10.1107/S1600536804030247","","","0.71073","MoKα","","0.063","0.0522","","","0.1386","0.1479","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204730","16.324","0.002","9.478","0.001","11.062","0.002","90","","103.69","0.01","90","","1662.9","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","ethyl [(Z)-2-(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidenemethyl)- 1-methyl-3-oxo-but-1-enylamino]acetate","","- C16 H21 N O7 -","- C16 H21 N O7 -","- C64 H84 N4 O28 -","4","1","KP6019","Vencato, Ivo; Cunha, Silvio; Ferrari, Jailton; Napolitano, Hamilton B.; Lariucci, Carlito","The polyfunctionalized enaminone ethyl [(<i>Z</i>)-2-(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidenemethyl)-1-methyl-3-oxo-but-1-enylamino]acetate","Acta Crystallographica Section E","2004","60","12","o2479","o2481","10.1107/S1600536804030211","","","1.5418","CuKα","","0.0759","0.0561","","","0.1475","0.1625","","","","","","1.073","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204731","7.905","0.002","9.441","0.002","10.974","0.003","76.37","0.02","101.29","0.03","105.96","0.03","757.7","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C6 H24 N4 O8 P2 -","- C6 H24 N4 O8 P2 -","- C12 H48 N8 O16 P4 -","2","1","LH6292","Amel Dakhlaoui; Leila Samia Smiri; Ahmed Driss","A new amine phosphate templated by tris(2-aminoethyl)amine","Acta Crystallographica Section E","2004","60","12","o2241","o2243","10.1107/S1600536804027540","","","0.71073","MoKα","","0.0445","0.0351","","","0.0973","0.1033","","","","","","1.049","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204732","6.963","0.0014","7.2888","0.0015","8.0319","0.0016","80.3","0.03","77.48","0.03","70.66","0.03","373.41","0.15","293","2","293","2","","","","","","","","4","P -1","-P 1","2","pyridazinic dicarboxylic acid","pyridazine-3,6-dicarboxylic acid monohydrate","","- C6 H6 N2 O5 -","- C6 H6 N2 O5 -","- C12 H12 N4 O10 -","2","1","LH6293","Starosta Wojciech; Leciejewicz Janusz","Pyridazine-3,6-dicarboxylic acid monohydrate","Acta Crystallographica Section E","2004","60","12","o2219","o2220","10.1107/S1600536804027527","","","0.71073","MoKα","","0.0525","0.0461","","","0.1264","0.1314","","","","","","1.051","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204733","6.706","0.003","6.706","0.003","21.834","0.016","90","","90","","90","","981.9","1","298","2","298","2","","","","","","","","5","P 43","P 4cw","78","","catena-Poly[[aquanitritosilver(I)]μ-1,4-diazabicyclo[2,2,2]octane-κ^2^N:N']","","- C6 H14 Ag N3 O3 -","- C6 H14 Ag N3 O3 -","- C24 H56 Ag4 N12 O12 -","4","1","LH6294","You, Zhong-Lu; Zhu, Hai-Liang; Liu, Wei-Sheng","<i>catena</i>-Poly[[aquanitritosilver(I)]-μ-1,4-diazabicyclo[2,2,2]octane-κ^2^<i>N:N</i>']","Acta Crystallographica Section E","2004","60","12","m1744","m1746","10.1107/S1600536804026650","","","0.71073","MoKα","","0.0409","0.0404","","","0.0953","0.0957","","","","","","1.285","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204734","27.387","0.002","5.504","0.003","17.879","0.002","90","","103.63","0.002","90","","2619.1","1.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(μ-4-chlorobenzoato-κ^2^O:O')bis[(2-aminopyridine-κN)silver(I)](Ag—Ag) monohydrate","","- C24 H22 Ag2 Cl2 N4 O5 -","- C24 H22 Ag2 Cl2 N4 O5 -","- C96 H88 Ag8 Cl8 N16 O20 -","4","0.5","LH6295","You, Zhong-Lu; Zhu, Hai-Liang; Liu, Wei-Sheng","Bis(μ-4-chlorobenzoato-κ^2^<i>O</i>:<i>O</i>')bis[(2-aminopyridine-κ<i>N</i>)silver(I)](<i>Ag{—</i>Ag}) monohydrate","Acta Crystallographica Section E","2004","60","12","m1863","m1865","10.1107/S1600536804029101","","","0.71073","MoKα","","0.0588","0.053","","","0.1158","0.1191","","","","","","1.232","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204735","9.193","0.009","16.726","0.017","12.729","0.013","90","","95.314","0.018","90","","1949","3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","di-μ-acetato-1:2κ^2^O:O';2:3κ^2^O:O'-bis{2,2'-[1,4- butanediylbis(nitrilomethylidyne)]diphenolato}- 1:2κ^6^O,N,N,O':O,O';2,3κ^6^O,O':O,N,N,O'-tricobalt(II)","","- C40 H42 Co3 N4 O8 -","- C40 H42 Co3 N4 O8 -","- C80 H84 Co6 N8 O16 -","2","0.5","LH6297","You, Zhong-Lu; Zhu, Hai-Liang; Liu, Wei-Sheng","A linear trinuclear Co^II^‒Co^II^‒Co^II^ complex with μ-acetate bridges: di-μ-acetato-bis[μ-<i>N,N</i>'-bis(salicylidene)-1,4-butanediaminato]tricobalt(II)","Acta Crystallographica Section E","2004","60","12","m1900","m1902","10.1107/S1600536804029605","","","0.71073","MoKα","","0.1097","0.0695","","","0.1516","0.171","","","","","","0.909","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204736","5.922","0.0008","24.946","0.003","11.1751","0.0014","90","","97.761","0.002","90","","1635.8","0.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(μ-Biphenyl-4,4'-dicarboxylato)bis[(2-aminopyridine)silver(I)]","","- C34 H32 Ag2 N8 O4 -","- C34 H32 Ag2 N8 O4 -","- C68 H64 Ag4 N16 O8 -","2","0.5","LH6298","Liu, Zhao-Di; Zhu, Hai-Liang","(μ-Biphenyl-4,4'-dicarboxylato)bis[(2-aminopyridine)silver(I)]","Acta Crystallographica Section E","2004","60","12","m1866","m1868","10.1107/S1600536804028624","","","0.71073","MoKα","","0.0587","0.0464","","","0.1204","0.1286","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204737","18.8439","0.0013","16.3922","0.0009","10.8561","0.0007","90","","90","","90","","3353.4","0.4","296","2","296","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","N,N,N-Tris(3-methylphenyl)amine","","- C21 H21 N -","- C21 H21 N -","- C168 H168 N8 -","8","1","LH6300","Manifar, Touraj; Rohani, Sohrab; Jennings, Michael, C.","<i>N,N,N</i>-Tris(3-methylphenyl)amine","Acta Crystallographica Section E","2004","60","12","o2301","o2303","10.1107/S1600536804028247","","","0.71073","MoKα","","0.1799","0.0655","","","0.162","0.2203","","","","","","0.996","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204738","11.1715","0.0007","24.1173","0.001","23.0286","0.0009","90","","95.19","0.004","90","","6179.1","0.5","297","1","297","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","rac-bis[2,2'-bis(1-ethyl-1H-benzimidazol-2-yl)biphenyl]copper(I) trifluoromethanesulfonate toluene solvate dihydrate","","- C68 H64 Cu F3 N8 O5 S -","- C68 H62 Cu F3 N8 O4 S -","- C272 H248 Cu4 F12 N32 O16 S4 -","4","1","LH6301","Robert T. Stibrany; Harvey J. Schugar; Joseph A. Potenza","The sterically crowded four-coordinate copper(I) complex <i>rac</i>-bis[2,2'-bis(1-ethyl-1<i>H</i>-benzimidazol-2-yl)biphenyl]copper(I) trifluoromethanesulfonate toluene solvate dihydrate","Acta Crystallographica Section E","2004","60","12","m1836","m1840","10.1107/S1600536804028259","","","0.71073","MoKα","","0.0849","0.0591","","","0.1568","0.1713","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204739","8.7755","0.0002","7.6452","0.0002","12.2232","0.0003","90","","106.966","0.0011","90","","784.37","0.03","120","","120","","","","","","","","","4","P 1 21 1","P 2yb","4","","3-Azido-3-deoxy-2,2':5,6-di-O-isopropylidene-2-C-hydroxmethyl-D- gulono-1,4-lactone","","- C13 H19 N3 O6 -","- C13 H19 N3 O6 -","- C26 H38 N6 O12 -","2","1","LH6302","Christopher C. Harding; Howard Shallard-Brown; David J. Watkin; Raquel Soengas; George W. J. Fleet","3-Azido-3-deoxy-2,2':5,6-di-<i>O</i>-isopropylidene-2-<i>C</i>-hydroxmethyl-<small>D</small>-gulono-1,4-lactone","Acta Crystallographica Section E","2004","60","12","o2334","o2336","10.1107/S1600536804029113","","","0.71073","MoKα","","0.0518","0.0448","","0.1085","0.1051","0.1085","","","","","","0.9324","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204740","11.2238","0.0003","14.7826","0.0005","19.9333","0.0007","99.08","0.0012","99.966","0.002","101.187","0.002","3132.16","0.18","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","Bis(tetraphenylarsonium) tris(2-thioxo-1,3-dithiole-4,5-dithiolato)stannate(IV) acetone solvate","","- C60 H46 As2 O S15 Sn -","- C60 H46 As2 O S15 Sn -","- C120 H92 As4 O2 S30 Sn2 -","2","1","LH6303","Comerlato, Nadia M.; Ferreira, Glaucio B.; Howie, R. Alan; Wardell, James L.","Bis(tetraphenylarsonium) tris(2-thioxo-1,3-dithiole-4,5-dithiolato)stannate(IV) acetone solvate at 120K","Acta Crystallographica Section E","2004","60","12","m1781","m1783","10.1107/S1600536804027424","","","0.71073","MoKα","","0.1074","0.0453","","","0.0668","0.0793","","","","","","0.927","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204741","9.868","0.001","9.868","0.001","12.801","0.002","90","","90","","90","","1246.6","0.3","213","2","213","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","TERPYRIDINE TRIOXIDE","2,2':6',2''-Terpyridine N,N',N''-trioxide","","- C15 H11 N3 O3 -","- C15 H11 N3 O3 -","- C60 H44 N12 O12 -","4","0.5","LH6304","McKay, Scott E.; Wheeler, Kraig A.; Blackstock, Silas C.","2,2':6',2''-Terpyridine N,N',N''-trioxide","Acta Crystallographica, Section E","2004","60","12","2258","2260","10.1107/S160053680402793X","","","0.71073","MoKα","","0.0359","0.0326","","","0.0805","0.0822","","","","","","1.07","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2204742","20.886","0.004","10.959","0.002","11.263","0.002","90","","115.09","0.03","90","","2334.7","0.9","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","bis(4-hydroxyphenyl) disulfide","4,4'-Dithiodiphenol","","- C12 H10 O2 S2 -","- C12 H10 O2 S2 -","- C96 H80 O16 S16 -","8","1","LH6305","Qing-ling Ni; Xiu-Jian Wang; Jian-Qiang Zeng; Hong-Xia Jian","4,4'-Dithiodiphenol: a chain of rings generated by two pairs of O—H···O hydrogen bonds","Acta Crystallographica Section E","2004","60","12","o2318","o2320","10.1107/S1600536804028636","","","0.71073","MoKα","","0.0409","0.0329","","","0.0885","0.0939","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204743","35.646","0.0006","5.2036","0.0001","19.1402","0.0003","90","","116.094","0.0008","90","","3188.39","0.1","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4,5-Bis(benzoylsulfanyl)-1,3-dithiol-2-one","","- C17 H10 O3 S4 -","- C17 H10 O3 S4 -","- C136 H80 O24 S32 -","8","1","LH6308","Nadia M. Comerlato; Gláucio B. Ferreira; Janet M. S. Skakle; James L. Wardell","4,5-Bis(benzoylsulfanyl)-1,3-dithiol-2-one","Acta Crystallographica Section E","2004","60","12","o2284","o2286","10.1107/S1600536804028387","","","0.71073","MoKα","","0.0314","0.0251","","","0.0618","0.0652","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204744","9.997","0.002","16.422","0.003","10.857","0.002","90","","98.2","0.03","90","","1764.2","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(μ-3-carboxylatophenoxyacetato)bis[(1H-imidazole)copper(II)] dihydrate","","- C30 H32 Cu2 N8 O12 -","- C30 H32 Cu2 N8 O12 -","- C60 H64 Cu4 N16 O24 -","2","0.5","LH6310","Gao, Shan; Gu, Chang-Sheng; Huo, Li-Hua; Liu, Ji-Wei; Zhao, Jing-Gui","Bis(μ-3-carboxylatophenoxyacetato)bis[(1<i>H</i>-imidazole)copper(II)] dihydrate","Acta Crystallographica Section E","2004","60","12","m1933","m1935","10.1107/S1600536804029976","","","0.71073","MoKα","","0.0477","0.0382","","","0.0949","0.0994","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204745","11.8742","0.0004","10.0738","0.0003","13.355","0.0004","90","","96.375","0.001","90","","1587.62","0.09","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3'-Isopropyl-8',8'-dimethyl-2-benzofuran-1-spiro-7'-bicyclo[4.2.0]octa- 1'(6'),2',4'-trien-3-one","","- C20 H20 O2 -","- C20 H20 O2 -","- C80 H80 O8 -","4","1","LH6311","Singh, Pradeep N. D.; Pika, Jana; Krause Bauer, Jeanette A.; Gudmundsdóttir, Anna D.","3'-Isopropyl-8',8'-dimethyl-2-benzofuran-1-spiro-7'-bicyclo[4.2.0]octa-1'(6'),2',4'-trien-3-one","Acta Crystallographica Section E","2004","60","12","o2390","o2392","10.1107/S160053680402940X","","","0.71073","MoKα","","0.0732","0.0597","","","0.1248","0.1299","","","","","","1.122","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204746","5.192","0.0003","10.685","0.0006","13.5535","0.0008","90","","90","","90","","751.9","0.08","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","cis-bis(glycinato)copper(II)monohydrate","cis-aquabis(glycinatoκ^2^N,O)copper(II)","","- C4 H10 Cu N2 O5 -","- C4 H10 Cu N2 O5 -","- C16 H40 Cu4 N8 O20 -","4","1","LH6313","Casari, Barbara M.; Mahmoudkhani, Amir H.; Langer, Vratislav","A redetermination of <i>cis</i>-aquabis(glycinato-κ^2^<i>N,O</i>)copper(II)","Acta Crystallographica Section E","2004","60","12","m1949","m1951","10.1107/S1600536804030041","","","0.71073","MoKα","","0.077","0.046","","","0.085","0.097","","","","","","1.011","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204747","8.776","0.003","11.78","0.005","10.645","0.004","90","","90","","90","","1100.5","0.7","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","Acetamiprid","(E)-N^1^-[(6-Chloropyridin-3-yl)methyl]-N^2^-cyano-N^1^-methylacetamidine","","- C10 H11 Cl N4 -","- C10 H11 Cl N4 -","- C40 H44 Cl4 N16 -","4","1","LH6316","Chopra, Deepak; Mohan, T. P.; Rao, K. S.; Guru Row, T. N.","(<i>E</i>)-<i>N</i>^1^-[(6-Chloropyridin-3-yl)methyl]-<i>N</i>^2^-cyano-<i>N</i>^1^-methylacetamidine","Acta Crystallographica Section E","2004","60","12","o2374","o2375","10.1107/S1600536804029411","","","0.71073","MoKα","","0.0606","0.0484","","","0.108","0.1139","","","","","","1.17","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204748","11.0671","0.001","14.0481","0.001","14.8625","0.0012","90","","90","","90","","2310.7","0.3","294","2","294","2","","","","","","","","5","C m c 21","C 2c -2","36","","Aqua(pyridine N-oxide-κO)[tris(2-hydroxyaminopropyl)amine-κ^4^N]nickel(II) dinitrate","","- C14 H25 N7 Ni O11 -","- C14 H25 N7 Ni O11 -","- C56 H100 N28 Ni4 O44 -","4","0.5","LH6317","Edison, Sara E.; Krause Bauer, Jeanette A.; Baldwin, Michael J.","Aqua(pyridine <i>N</i>-oxide-κ<i>O</i>)[tris(2-hydroxyaminopropyl)amine-κ^4^<i>N</i>]nickel(II) dinitrate","Acta Crystallographica Section E","2004","60","12","m1930","m1932","10.1107/S160053680403003X","","","0.71073","MoKα","","0.0322","0.0299","","","0.0702","0.0712","","","","","","1.091","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204749","3.9015","0.0006","12.324","0.002","13.503","0.002","90","","90.57","0.01","90","","649.22","0.17","290","2","290","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","pyridine hydrogen nitrate","pyridinium nitrate","","- C5 H6 N2 O3 -","- C5 H6 N2 O3 -","- C20 H24 N8 O12 -","4","1","LH6318","Batsanov, Andrei S.","Pyridinium nitrate at 290K","Acta Crystallographica Section E","2004","60","12","o2424","o2425","10.1107/S1600536804030168","","","0.71073","MoKα","","0.0803","0.0496","","","0.1408","0.1574","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204750","3.7756","0.0009","12.336","0.003","13.353","0.003","90","","88.6","0.01","90","","621.7","0.3","120","1","120","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","pyridine hydrogen nitrate","pyridinium nitrate","","- C5 H6 N2 O3 -","- C5 H6 N2 O3 -","- C20 H24 N8 O12 -","4","1","LH6319","Batsanov, Andrei S.","Pyridinium nitrate at 120K","Acta Crystallographica Section E","2004","60","12","o2426","o2428","10.1107/S160053680403017X","","","0.71073","MoKα","","0.079","0.0494","","","0.1119","0.128","","","","","","1.044","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204751","7.1985","0.0005","16.372","0.0014","17.244","0.002","90","","90","","90","","2032.3","0.3","150","2","150","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","[1-methylimidazole-2(3H)-thione-2κS]dioxo-1κ^2^O-di-μ-sulfido-1:2κ^4^S:S- copper(I)tungstate(VI)","","- C12 H26 Cu N3 O2 S3 W -","- C12 H26 Cu N3 O2 S3 W -","- C48 H104 Cu4 N12 O8 S12 W4 -","4","1","LH6320","Beheshti, Azizolla; Brooks, Neil R.; Clegg, William; Khorrmdin, Rahman","Tetraethylammonium [1-methylimidazole-2(3<i>H</i>)-thione]copper(I)-di-μ-sulfido-dioxotungstate(VI)","Acta Crystallographica Section E","2004","60","12","m1923","m1926","10.1107/S1600536804030132","","","0.71073","MoKα","","0.0961","0.0924","","","0.2311","0.2329","","","","","","1.237","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204752","13.3652","0.0005","13.3652","0.0005","13.668","0.002","90","","90","","90","","2441.5","0.4","150","2","150","2","","","","","","","","7","P 4/n :2","-P 4a","85","","Bis(tetra-n-butylammonium) tetrakis[chloro(μ~3~-sulfido)copper(I)]tungstate(VI)","","- C32 H72 Cl4 Cu4 N2 S4 W -","- C32 H72 Cl4 Cu4 N2 S4 W -","- C64 H144 Cl8 Cu8 N4 S8 W2 -","2","0.25","LH6324","Hossaini Sadr, Moayad; Seyed Ahmadian, Seyed Masoud; Brooks, Neil R.; Clegg, William","Bis(tetra-<i>n</i>-butylammonium) tetrakis[chloro(μ~3~-sulfido)copper(I)]tungstate(VI): a second polymorph","Acta Crystallographica Section E","2004","60","12","m1952","m1954","10.1107/S1600536804030582","","","0.71073","MoKα","","0.0304","0.0216","","","0.0501","0.0558","","","","","","1.11","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204753","8.5942","0.0012","42.288","0.006","13.8795","0.0019","90","","101.839","0.003","90","","4936.9","1.2","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,4'-bis[(2,2':6',2''-terpyridin-4-yl)ethynyl]-2,2'- (3,6,9-trioxaundecane-1,11-diyldioxy)-1,1'-biphenyl ethyl acetate solvate","","- C58 H50 N6 O7 -","- C58 H50 N6 O7 -","- C232 H200 N24 O28 -","4","1","LH6325","Benniston, Andrew C.; Clegg, William; Harrington, Ross W.; Li, Peiyi","A sterically constrained bis(2,2':6',2''-terpyridine) ligand","Acta Crystallographica Section E","2004","60","12","o2452","o2454","10.1107/S1600536804030594","","","0.6948","synchrotron","","0.0596","0.0514","","","0.13","0.138","","","","","","1.017","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204754","6.087","0.0014","9.529","0.002","12.021","0.003","93.682","0.004","96.977","0.004","103.543","0.004","669.7","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","N-Cyclohexyl-2-oxo-2H-1-benzopyran-3-carboxamide","","- C16 H17 N O3 -","- C16 H17 N O3 -","- C32 H34 N2 O6 -","2","1","NC6004","Nancy E. Magaña-Vergara; Francisco J. Martínez-Martínez; Itzia I. Padilla-Martínez; Herbert Höpfl; Efrén V. García-Báez","<i>N</i>-Cyclohexyl-2-oxo-2<i>H</i>-1-benzopyran-3-carboxamide","Acta Crystallographica Section E","2004","60","12","o2306","o2308","10.1107/S160053680402851X","","","0.71073","MoKα","","0.066","0.056","","","0.1351","0.1421","","","","","","1.095","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204755","13.279","0.013","10.857","0.009","14.061","0.012","90","","101.02","0.07","90","","1990","3","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Pentacarbonyl(3,3',4,4'-tetramethyl-1,1'-diphosphaferrocene-κP)tungsten(0)","","- C17 H16 Fe O5 P2 W -","- C17 H16 Fe O5 P2 W -","- C68 H64 Fe4 O20 P8 W4 -","4","1","NC6008","Sieroń, Lesław; Tosik, Anita","Pentacarbonyl(3,3',4,4'-tetramethyl-1,1'-diphosphaferrocene-κ<i>P</i>)tungsten(0)","Acta Crystallographica Section E","2004","60","12","m1828","m1829","10.1107/S1600536804028910","","","0.71073","MoKα","","0.0358","0.0257","","","0.0571","0.0593","","","","","","1.026","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204756","11.921","0.0011","6.6042","0.0006","12.9122","0.0012","90","","108.951","0.001","90","","961.46","0.15","298","2","298","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","4,4'-Bipyridinium hexaaquacobalt(II) disulfate","","- C10 H22 Co N2 O14 S2 -","- C10 H22 Co N2 O14 S2 -","- C20 H44 Co2 N4 O28 S4 -","2","0.25","NG6056","Xin-Hua Li; Qian Miao; Hong-Ping Xiao; Mao-Lin Hu","4,4'-Bipyridinium hexaaquacobalt(II) disulfate","Acta Crystallographica Section E","2004","60","12","m1784","m1785","10.1107/S1600536804027783","","","0.71073","MoKα","","0.0344","0.0336","","","0.0893","0.09","","","","","","1.193","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2204757","13.121","0.005","8.731","0.003","16.205","0.006","90","","97.56","0.006","90","","1840.3","1.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H16 Br2 Cu N6 -","- C16 H16 Br2 Cu N6 -","- C64 H64 Br8 Cu4 N24 -","4","1","NG6059","Feng-Yi Xia; Xin-Hua Li; Xin-Xiang Lei","(2,2'-Bipyridine)bromodiimidazolecopper(II) bromide","Acta Crystallographica Section E","2004","60","12","m1955","m1956","10.1107/S1600536804030284","","","0.71073","MoKα","","0.0475","0.0343","","","0.0909","0.1084","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204758","12.486","0.003","12.904","0.003","6.8131","0.0014","90","","99.21","0.03","90","","1083.6","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Hexaaquamagnesium(II) bis[(4-oxo-4H-pyridin-1-yl)acetate] dihydrate","","- C14 H28 Mg N2 O14 -","- C14 H28 Mg N2 O14 -","- C28 H56 Mg2 N4 O28 -","2","0.5","NG6065","Zhao, Jing-Gui; Zhang, Zhu-Yan; Huo, Li-Hua; Gao, Shan","Hexaaquamagnesium(II) bis[(4-oxo-4<i>H</i>-pyridin-1-yl)acetate] dihydrate","Acta Crystallographica Section E","2004","60","12","m1987","m1988","10.1107/S1600536804031113","","","0.71073","MoKα","","0.0604","0.0549","","","0.1726","0.1769","","","","","","1.083","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204759","12.472","0.003","13.003","0.003","13.62","0.003","99.799","0.004","95.399","0.004","104.785","0.005","2082.5","0.8","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","2-Amino-4-(4-methoxyphenyl)-5-oxo-4H,5H-pyrano[3,2-c]chromene-3-carbonitrile N,N-dimethylformamide solvate","","- C23 H21 N3 O5 -","- C23 H21 N3 O5 -","- C92 H84 N12 O20 -","4","2","OB6421","Daqing Shi; Nan Wu; Qiya Zhuang; Yong Zhang","2-Amino-4-(4-methoxyphenyl)-5-oxo-4<i>H</i>,5<i>H</i>-pyrano[3,2-<i>c</i>]chromene-3-carbonitrile <i>N,N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2004","60","12","o2359","o2361","10.1107/S1600536804029356","","","0.7107","MoKα","","0.0627","0.0489","","","0.1112","0.1189","","","","","","1.103","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204760","10.72","0.004","8.934","0.003","18.167","0.006","90","","94.636","0.007","90","","1734.2","1","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-amino-4-(4-methoxyphenyl)-7-methyl-5-oxopyrano[3,2-c]pyran-3-carboxylate","","- C19 H19 N O6 -","- C19 H14 N O6 -","- C76 H56 N4 O24 -","4","1","OB6422","Daqing Shi; Lihui Niu; Xiangshan Wang; Qiya Zhuang; Yong Zhang","Ethyl 2-amino-4-(4-methoxyphenyl)-7-methyl-5-oxopyrano[3,2-<i>c</i>]pyran-3-carboxylate","Acta Crystallographica Section E","2004","60","12","o2362","o2364","10.1107/S1600536804029332","","","0.7107","MoKα","","0.0652","0.0594","","","0.1582","0.1634","","","","","","1.084","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204761","10.598","0.002","6.2646","0.001","14.153","0.003","90","","102.06","0.02","90","","918.9","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(Z)-3,6-Diethynyl-3,6-dihydroxycyclohexa-1,4-diene","","- C10 H8 O2 -","- C10 H8 O2 -","- C40 H32 O8 -","4","1","OB6423","Arkasish Bandyopadhyay; Babu Varghese; Sankararaman, Sethuraman","(<i>Z</i>)-3,6-Diethynyl-3,6-dihydroxycyclohexa-1,4-diene","Acta Crystallographica Section E","2004","60","12","o2247","o2248","10.1107/S1600536804027631","","","0.71073","MoKα","","0.1702","0.0592","","","0.121","0.1538","","","","","","0.998","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204762","14.4742","0.0007","9.5767","0.0007","11.2075","0.0006","90","","90","","90","","1553.53","0.16","296","1","","","","","","","","","","4","C m c 21","C 2c -2","36","","","","- C18 H19 O P -","- C18 H19 O P -","- C72 H76 O4 P4 -","4","0.5","OB6424","Jian-Ming Gu; Mao-Sheng Xu; Xiu-Rong Hu","1-(Diphenylphosphinoyl)-3,3-dimethylbut-1-yne","Acta Crystallographica Section E","2004","60","12","o2177","o2178","10.1107/S1600536804027217","","","0.7107","MoKα","","","0.036","","","","0.088","","","","","","1.002","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204763","6.7513","0.0018","11.01","0.003","13.74","0.004","107.117","0.005","93.142","0.003","104.813","0.005","934.2","0.4","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","2-Amino-7-methyl-4-(3,4-methylenedioxyphenyl)-5-oxopyrano[3,2-c]pyran-3- carbonitrile N,N-dimethylformamide solvate","","- C20 H19 N3 O6 -","- C20 H19 N3 O6 -","- C40 H38 N6 O12 -","2","1","OB6426","Daqing Shi; Lihui Niu; Xiangshan Wang; Qiya Zhuang; Yong Zhang","2-Amino-7-methyl-4-(3,4-methylenedioxyphenyl)-5-oxopyrano[3,2-<i>c</i>]pyran-3-carbonitrile <i>N,N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2004","60","12","o2371","o2373","10.1107/S1600536804029289","","","0.7107","MoKα","","0.0446","0.0392","","","0.0974","0.1018","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204764","28.126","0.006","7.8824","0.0013","22.096","0.005","90","","122.493","0.003","90","","4131.8","1.5","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","2-Amino-4-(3,4-dichlorophenyl)-4H-pyrano[3,2-c]coumarin-3-carbonitrile N,N-dimethylformamide solvate","2-amino-4-(3,4-dichlorophenyl)-5-oxo-4H,5H-pyrano[3,2-c]chromene-3-carbonitrile N,N-dimethylformamide solvate","","- C22 H17 Cl2 N3 O4 -","- C22 H17 Cl2 N3 O4 -","- C176 H136 Cl16 N24 O32 -","8","1","OB6427","Daqing Shi; Nan Wu; Qiya Zhuang; Yong Zhang","2-Amino-4-(3,4-dichlorophenyl)-4<i>H</i>-pyrano[3,2-<i>c</i>]coumarin-3-carbonitrile <i>N,N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2004","60","12","o2339","o2341","10.1107/S1600536804028995","","","0.7107","MoKα","","0.0426","0.0387","","","0.0916","0.0938","","","","","","1.109","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204765","12.9","0.003","7.8312","0.0019","14.722","0.004","90","","90","","90","","1487.3","0.6","293","2","293","2","","","","","","","","6","I b a m","-I 2 2c","72","","Poly[[terachlorogold(III)potassium(I)(Au—K)]-μ-4,4'-bipyridine]","","- C10 H8 Au Cl4 K N2 -","- C10 H8 Au Cl4 K N2 -","- C40 H32 Au4 Cl16 K4 N8 -","4","0.25","OB6430","Song, Cheng; Li, Yi-Zhi; Chen, Ya-Qing; Xiao, Shou-Jun; You, Xiao-Zeng","Poly[[terachlorogold(III)potassium(I)(<i>Au{—</i>K})]-μ-4,4'-bipyridine]","Acta Crystallographica Section E","2004","60","12","m1741","m1743","10.1107/S1600536804026996","","","0.71073","MoKα","","0.0653","0.0399","","","0.0942","0.0994","","","","","","1.086","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204766","9.268","0.002","14.595","0.002","14.466","0.002","90","","90.09","0.01","90","","1956.8","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","9-[Ethoxy(quinolin-8-ylamino)methyl]anthracene","","- C26 H22 N2 O -","- C26 H22 N2 O -","- C104 H88 N8 O4 -","4","1","OB6431","Huang, Bin; Li, Yi-Zhi; Zhou, Jian-Hao; Chen, Xue-Tai; Liu, Shan-Hui","9-[Ethoxy(8-quinolylamino)methyl]anthracene","Acta Crystallographica Section E","2004","60","12","o2365","o2367","10.1107/S1600536804029307","","","0.71073","MoKα","","0.0704","0.0497","","","0.1404","0.152","","","","","","1.069","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204767","9.978","0.005","9.918","0.004","15.426","0.007","90","","102.31","0.007","90","","1491.5","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","cis-Diaquamalonato(1,10-phenanthroline)manganese(II)","","- C15 H14 Mn N2 O6 -","- C15 H14 Mn N2 O6 -","- C60 H56 Mn4 N8 O24 -","4","1","OB6432","Zhang, Quan-Zheng; Lu, Can-Zhong","<i>cis</i>-Diaquamalonato(1,10-phenanthroline)manganese(II)","Acta Crystallographica Section E","2004","60","12","m1778","m1780","10.1107/S1600536804027953","","","0.71073","MoKα","","0.0283","0.0265","","","0.0697","0.0709","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204768","4.77","0.001","5.797","0.002","22.923","0.007","83.65","0.02","84.16","0.01","84.92","0.01","624.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Poly[triaqua(μ-benzene-1,3-dioxyacetato)manganese(II)]","Poly[triaqua[μ-m-phenylenebis(oxyacetato)]manganese(II)]","","- C10 H14 Mn O9 -","- C10 H14 Mn O9 -","- C20 H28 Mn2 O18 -","2","1","OB6433","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui; Zhao, Jing-Gui","Poly[triaqua(μ-benzene-1,3-dioxyacetato)manganese(II)]: a two-dimensional manganese(II) coordination polymer","Acta Crystallographica Section E","2004","60","12","m1849","m1851","10.1107/S1600536804029137","","","0.71073","MoKα","","0.059","0.043","","","0.121","0.133","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204769","8.2104","0.0016","5.9881","0.0012","19.473","0.004","90","","90.21","0.03","90","","957.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Poly[cadmium(II)-μ~4~-benzene-1,3-dioxyacetato]","poly[cadmium(II)-μ~4~-m-phenylenebis(oxyacetato)]","","- C10 H8 Cd O6 -","- C10 H8 Cd O6 -","- C40 H32 Cd4 O24 -","4","1","OB6434","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui; Zhao, Jing-Gui","Poly[cadmium(II)-μ~4~-benzene-1,3-dioxyacetato]: a two-dimensional layer cadmium(II) coordination polymer","Acta Crystallographica Section E","2004","60","12","m1875","m1877","10.1107/S1600536804029265","","","0.71073","MoKα","","0.024","0.023","","","0.064","0.064","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204770","14.234","0.003","13.21","0.003","19.522","0.004","90","","104.56","0.03","90","","3552.9","1.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[aqua(2,2'-bipyridine-κ^2^N,N')zinc(II)]-μ-4- carboxylatophenoxyacetato-κ^3^O,O':O'']","","- C19 H16 N2 O6 Zn -","- C19 H16 N2 O6 Zn -","- C152 H128 N16 O48 Zn8 -","8","1","OB6435","Gao, Shan; Gu, Chang-Sheng; Huo, Li-Hua; Liu, Ji-Wei; Zhao, Jing-Gui","<i>catena</i>-Poly[[aqua(2,2'-bipyridine-κ^2^<i>N,N</i>')zinc(II)]-μ-4-carboxylatophenoxyacetato-κ^3^<i>O,O</i>':<i>O</i>'']","Acta Crystallographica Section E","2004","60","12","m1906","m1908","10.1107/S1600536804029654","","","0.71073","MoKα","","0.0703","0.0442","","","0.0903","0.0985","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204771","14.175","0.003","5.0634","0.0009","19.912","0.003","90","","102.794","0.004","90","","1393.7","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-(3-fluorophenyl)-9H-xanthen-9-ylideneamine","","- C19 H12 F N O -","- C19 H12 F N O -","- C76 H48 F4 N4 O4 -","4","1","OB6436","Chopra, Deepak; Nagarajan, K.; Guru Row, T. N.","<i>N</i>-(3-Fluorophenyl)-9<i>H</i>-xanthen-9-ylideneamine","Acta Crystallographica Section E","2004","60","12","o2376","o2377","10.1107/S1600536804029666","","","0.71073","MoKa","","0.1557","0.0819","","","0.1346","0.157","","","","","","1.117","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204772","20.052","0.004","10.3835","0.0019","7.5229","0.0014","90","","99.375","0.003","90","","1545.4","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N-[(9E)-2-Chloro-9-thia-9H-xanthen-9-ylidene]-N-(4-fluorophenyl)amine","","- C19 H11 Cl F N S -","- C19 H11 Cl F N S -","- C76 H44 Cl4 F4 N4 S4 -","4","1","OB6437","Chopra, Deepak; Nagarajan, K.; Guru Row, T. N.","<i>N</i>-[(9<i>E</i>)-2-Chloro-9-thia-9<i>H</i>-xanthen-9-ylidene]-<i>N</i>-(4-fluorophenyl)amine","Acta Crystallographica Section E","2004","60","12","o2408","o2409","10.1107/S1600536804029794","","","0.71073","MoKα","","0.135","0.0922","","","0.2175","0.244","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204773","10.895","0.006","11.006","0.006","13.595","0.008","90","","106.526","0.009","90","","1562.8","1.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)hexan-2-ol","","- C14 H17 Cl2 N3 O -","- C14 H17 Cl2 N3 O -","- C56 H68 Cl8 N12 O4 -","4","1","OB6438","Chopra, Deepak; Mohan, T. P.; Rao, K. S.; Guru Row, T. N.","2-(2,4-Dichlorophenyl)-1-(1<i>H</i>-1,2,4-triazol-1-yl)hexan-2-ol (hexaconazole)","Acta Crystallographica Section E","2004","60","12","o2410","o2412","10.1107/S1600536804029800","","","0.71073","MoKα","","0.0431","0.0376","","","0.0959","0.1001","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204774","6.493","0.005","28.74","0.02","6.812","0.005","90","","105.486","0.012","90","","1225","1.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Thiamethaxam","(4E)-3-[(2-Chloro-4,5-dihydro-1,3-thiazol-5-yl)methyl]-5-methyl-N-nitro- 1,3,5-oxadiazinan-4-imine","","- C8 H10 Cl N5 O3 S -","- C8 H10 Cl N5 O3 S -","- C32 H40 Cl4 N20 O12 S4 -","4","1","OB6439","Chopra, Deepak; Mohan, T. P.; Rao, K. S.; Guru Row, T. N.","(4<i>E</i>)-3-[(2-Chloro-4,5-dihydro-1,3-thiazol-5-yl)methyl]-5-methyl-<i>N</i>-nitro-1,3,5-oxadiazinan-4-imine (thiamethaxam)","Acta Crystallographica Section E","2004","60","12","o2413","o2414","10.1107/S1600536804029812","","","0.71073","MoKα","","0.0768","0.0655","","","0.1693","0.1763","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204775","19.29","0.008","4.839","0.002","11.784","0.005","90","","99.22","0.006","90","","1085.8","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Imidachloprid","(2E)-1-[(6-Chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine (imidachloprid)","","- C9 H10 Cl N5 O2 -","- C9 H10 Cl N5 O2 -","- C36 H40 Cl4 N20 O8 -","4","1","OB6440","Chopra, Deepak; Mohan, T. P.; Rao, K. S.; Guru Row, T. N.","(2<i>E</i>)-1-[(6-Chloropyridin-3-yl)methyl]-<i>N</i>-nitroimidazolidin-2-imine (imidachloprid)","Acta Crystallographica Section E","2004","60","12","o2415","o2417","10.1107/S1600536804029824","","","0.71073","MoKα","","0.0765","0.0584","","","0.1513","0.1619","","","","","","1.121","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204776","9.263","0.003","14.038","0.004","15.137","0.005","90","","105.294","0.005","90","","1898.6","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","pyrazosulfuron-ethyl","Ethyl 5-[(4,6-dimethoxypyrimidin-2-yl)ureidosulfonyl]-1-methyl-1H-pyrazole- 4-carboxylate","","- C14 H18 N6 O7 S -","- C14 H18 N6 O7 S -","- C56 H72 N24 O28 S4 -","4","1","OB6441","Chopra, Deepak; Mohan, T. P.; Rao, K. S.; Guru Row, T. N.","Ethyl 5-[(4,6-dimethoxypyrimidin-2-yl)ureidosulfonyl]-1-methyl-1<i>H</i>-pyrazole-4-carboxylate","Acta Crystallographica Section E","2004","60","12","o2418","o2420","10.1107/S1600536804029836","","","0.71073","MoKα","","0.0585","0.0489","","","0.1457","0.1587","","","","","","0.838","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204777","16.843","0.016","15.48","0.014","13.728","0.013","90","","114.337","0.014","90","","3261","5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","kresoxim methyl","Methyl 2(E)-methoxyimino-2-[2-(2-methylphenoxymethyl)phenyl]acetate","","- C18 H19 N O4 -","- C18 H19 N O4 -","- C144 H152 N8 O32 -","8","1","OB6442","Chopra, Deepak; Mohan, T. P.; Rao, K. S.; Guru Row, T. N.","Methyl 2(<i>E</i>)-methoxyimino-2-[2-(2-methylphenoxymethyl)phenyl]acetate","Acta Crystallographica Section E","2004","60","12","o2421","o2423","10.1107/S1600536804029848","","","0.71073","MoKα","","0.0748","0.0498","","","0.1316","0.1489","","","","","","1.018","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204778","10.738","0.005","19.953","0.01","19.498","0.009","90","","91.863","0.005","90","","4175","3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Tetra-n-butlyammonium μ-bromo-di-μ-cyclohexanethiolato-bis[tricarbonylmolybdenum(I)]","","- C34 H58 Br Mo2 N O6 S2 -","- C34 H58 Br Mo2 N O6 S2 -","- C136 H232 Br4 Mo8 N4 O24 S8 -","4","1","RN6026","Zhang-Feng Zhou; Yong-Qin Wei; Bo-Tao Zhuang; Ke-Chen Wu; Chao-Yong Mang; Tao Hong; Ming-Xi Zhang","Tetra-<i>n</i>-butylammonium μ-bromo-di-μ-cyclohexanethiolato-bis[tricarbonylmolybdenum(I)]","Acta Crystallographica Section E","2004","60","12","m1857","m1858","10.1107/S1600536804029010","","","0.71073","MoKα","","0.0312","0.0282","","","0.0725","0.0746","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204779","9.0034","0.001","19.4609","0.0019","12.7448","0.0013","90","","93.005","0.005","90","","2230","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","catena-Poly[[[aqua(1,10-phenanthroline-κ^2^N,N')copper(II)]- μ-benzene-1,3-dioxyacetato-κ^2^O:O'] dihydrate]","catena-poly[[[aqua(1,10-phenanthroline-κ^2^N,N')copper(II)]- μ-phenylenebis(oxyacetato)-κ^2^O:O'] dihydrate]","","- C22 H22 Cu N2 O9 -","- C22 H22 Cu N2 O9 -","- C88 H88 Cu4 N8 O36 -","4","1","RN6028","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui; Zhao, Jing-Gui","<i>catena</i>-Poly[[[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)]-μ-benzene-1,3-dioxyacetato-κ^2^<i>O</i>:<i>O</i>'] dihydrate]","Acta Crystallographica Section E","2004","60","12","m1769","m1771","10.1107/S1600536804027758","","","0.71073","MoKα","","0.048","0.04","","","0.101","0.105","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204780","8.047","0.003","14.384","0.005","14.386","0.005","90","","98.311","0.005","90","","1647.7","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Chloro{2-[(5-nitrosalicylidene)aminoethyl]-1H-benzimidazole}copper(II)","","- C16 H13 Cl Cu N4 O3 -","- C16 H13 Cl Cu N4 O3 -","- C64 H52 Cl4 Cu4 N16 O12 -","4","1","RN6029","Xiao-Hang, Qiu; Hong-Yan, Wu","Chloro{2-[(5-nitrosalicylidene)aminoethyl]-1<i>H</i>-benzimidazole}copper(II)","Acta Crystallographica Section E","2004","60","12","m1855","m1856","10.1107/S1600536804029034","","","0.71073","MoKα","","0.068","0.038","","","0.078","0.088","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204781","6.1452","0.0014","9.731","0.002","14.69","0.003","98.711","0.004","93.971","0.004","104.444","0.004","835.6","0.3","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","1-(2-Morpholinoethyl)-3-(3-phenylacryloyl)thiourea","","- C16 H21 N3 O2 S -","- C16 H21 N3 O2 S -","- C32 H42 N6 O4 S2 -","2","1","RN6031","Yamin, Bohari M.; Hassan, Ibrahim N.","1-(2-Morpholinoethyl)-3-(3-phenylacryloyl)thiourea","Acta Crystallographica Section E","2004","60","12","o2513","o2514","10.1107/S1600536804030831","","","0.71073","MoKα","","0.065","0.053","","","0.125","0.131","","","","","","1.15","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204782","10.2015","0.0017","10.621","0.0013","14.872","0.002","90","","106.838","0.008","90","","1542.3","0.4","130","2","130","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","μ-4,4'-Bipyridine-bis[aqua(N-salicylideneaspartato)copper(II)]","","- C32 H30 Cu2 N4 O12 -","- C32 H30 Cu2 N4 O12 -","- C64 H60 Cu4 N8 O24 -","2","0.5","RN6032","Lou, Ben-Yong; Yuan, Da-Qiang; Wu, Ben-Lai; Hong, Mao-Chun","μ-4,4'-Bipyridine-bis[aqua(<i>N</i>-salicylideneaspartato)copper(II)]","Acta Crystallographica Section E","2004","60","12","m1976","m1977","10.1107/S1600536804030855","","","0.71073","MoKα","","0.055","0.0445","","","0.1041","0.1129","","","","","","1.085","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204783","9.1248","0.0007","12.0366","0.001","14.2666","0.0011","90","","90","","90","","1566.9","0.2","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","p-tolyl 2,3-anhydro-5,6-O-isopropylidene-1-thio-β-D-talofuranoside","","- C16 H20 O4 S -","- C16 H20 O4 S -","- C64 H80 O16 S4 -","4","1","RZ6011","Bai, Yu; Lowary, Todd L.; Ferguson, Michael J.","<i>p</i>-Tolyl 2,3-anhydro-5,6-<i>O</i>-isopropylidene-1-thio-β-<small>D</small>-gulofuranoside","Acta Crystallographica Section E","2004","60","12","o2201","o2203","10.1107/S1600536804027266","","","0.71073","MoKα","","0.0414","0.0327","","","0.0753","0.0795","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204784","5.3003","0.0003","10.354","0.0005","8.5137","0.0004","90","","96.127","0.001","90","","464.56","0.04","183","2","183","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(3aS,8aS,9R,9aS)-9-Hydroxy-2,3,3a,7,8,8a,9,9a-octahydrofuro[3,2-f]indolizin- 6(4H)-one","","- C10 H15 N O3 -","- C10 H15 N O3 -","- C20 H30 N2 O6 -","2","1","RZ6013","Vrábel, Viktor; Kožíšek, Jozef; Langer, Vratislav; Marchalín, Štefan; Szemes, Fridrich","(3a<i>S</i>,8a<i>S</i>,9<i>R</i>,9a<i>S</i>)-9-Hydroxy-2,3,3a,7,8,8a,9,9a-octahydrofuro[3,2-<i>f</i>]indolizin-6(4<i>H</i>)-one","Acta Crystallographica Section E","2004","60","12","o2211","o2213","10.1107/S1600536804027515","","","0.71073","MoKα","","0.0924","0.0674","","","0.152","0.1664","","","","","","1.003","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204785","8.303","0.0017","10.334","0.002","13.251","0.003","83.74","0.03","86.98","0.03","69.58","0.03","1059","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Diazidobis(2,2'-bipyridine)zinc(II) monohydrate","","- C20 H18 N10 O Zn -","- C20 H18 N10 O Zn -","- C40 H36 N20 O2 Zn2 -","2","1","RZ6014","Fangfang Jian; Chunlei Li; Pingping Sun; Hailian Xiao","Diazidobis(2,2'-bipyridine)zinc(II) monohydrate","Acta Crystallographica Section E","2004","60","12","m1811","m1812","10.1107/S1600536804028466","","","0.71073","MoKα","","0.0709","0.0392","","","0.0749","0.0845","","","","","","1.017","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204786","9.748","0.002","19.923","0.004","14.598","0.003","90","","95.92","0.03","90","","2819.9","1","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[tris(pyridine-κN)cadmium(II)]-μ-{2-[3-(1-carboxylatomethyl)- 4-nitrophenyl]propionato-κ^2^O,O'} dihydrate]","","- C26 H28 Cd N4 O8 -","- C26 H28 Cd N4 O8 -","- C104 H112 Cd4 N16 O32 -","4","1","RZ6015","Gao, Shan; Huo, Li-Hua; Zhang, Xian-Fa; Ng, Seik Weng","<i>catena</i>-Poly[[[tris(pyridine-κ<i>N</i>)cadmium(II)]-μ-{2-[3-(1-carboxylatomethyl)-4-nitrophenyl]propionato-κ^2^<i>O,O</i>'}] dihydrate]","Acta Crystallographica Section E","2004","60","12","m1788","m1789","10.1107/S1600536804027795","","","0.71073","MoKα","","0.053","0.037","","","0.088","0.094","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204787","6.3388","0.0013","12.79","0.003","10.196","0.002","90","","103.74","0.03","90","","803","0.3","301","2","301","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Dichloro[(4S,4'S)-4,4'-diisopropyl-2,2'-bi-1,3-oxazoline]palladium(II)","","- C12 H20 Cl2 N2 O2 Pd -","- C12 H20 Cl2 N2 O2 Pd -","- C24 H40 Cl4 N4 O4 Pd2 -","2","1","RZ6016","Kožíšek, Jozef; Fronc, Marek; Svoboda, Ingrid; Kapitán, Peter; Gracza, Tibor","Dichloro[(4<i>S</i>,4'<i>S</i>)-4,4'-diisopropyl-2,2'-bi-1,3-oxazoline]palladium(II)","Acta Crystallographica Section E","2004","60","12","m1895","m1896","10.1107/S1600536804029290","","","0.71073","MoKα","","0.0266","0.0255","","","0.0589","0.0599","","","1.082","","","1.082","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204788","9.2662","0.0019","9.6794","0.0016","10.854","0.002","90","","90.061","0.017","90","","973.5","0.3","291","2","291","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Urotropinium perchlorate","3,5,7-Triaza-1-azoniatricyclo[3.3.1.1^3,7^]decane perchlorate","","- C6 H13 Cl N4 O4 -","- C6 H13 Cl N4 O4 -","- C24 H52 Cl4 N16 O16 -","4","1","RZ6017","Kruszynski, Rafal; Trzesowska, Agata","3,5,7-Triaza-1-azoniatricyclo[3.3.1.1^3,7^]decane perchlorate","Acta Crystallographica, Section E","2004","60","12","o2347","o2349","10.1107/S1600536804029320","","","0.71073","MoKα","","0.0818","0.0764","","","0.1932","0.2016","","","","","","1.11","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204789","19.651","0.006","5.6123","0.0011","17.187","0.003","90","","103.76","0.03","90","","1841.1","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H17 F N4 O S -","- C19 H17 F N4 O S -","- C76 H68 F4 N16 O4 S4 -","4","1","RZ6019","Liangzhong Xu; Chongyi Zhu; Guodong Si; Yongqi Qin; Kai Li","3-Anilino-1-(2-fluoro-5-methylphenyl)-3-(methylsulfanyl)-2-(1<i>H</i>-1,2,4-triazol-1-yl)prop-2-en-1-one","Acta Crystallographica Section E","2004","60","12","o2471","o2472","10.1107/S160053680403048X","","","0.71073","MoKα","","0.0651","0.0424","","","0.1068","0.1246","","","","","","1.015","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204790","7.888","0.0016","16.006","0.003","11.579","0.004","90","","115.38","0.02","90","","1320.8","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H14 Fe O2 -","- C17 H14 Fe O2 -","- C68 H56 Fe4 O8 -","4","1","RZ6020","Fangfang Jian; Huaibo Ma; Pingping Sun; Hailian Xiao","Ferrocenylbenzoic acid","Acta Crystallographica Section E","2004","60","12","m1961","m1962","10.1107/S1600536804030491","","","0.71073","MoKα","","0.1722","0.055","","","0.1142","0.15","","","","","","0.961","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204791","27.3044","0.0005","27.3044","0.0005","8.3804","0.0002","90","","90","","120","","5410.79","0.19","150","2","150","2","","","","","","","","5","R -3 :H","-R 3","148","","[1,5-Dimethyl-6-oxo-1,2,4,5-tetrazinan-3-yl]imidazolium chloride","","- C7 H13 Cl N6 O -","- C7 H13 Cl N6 O -","- C126 H234 Cl18 N108 O18 -","18","1","RZ6022","Mills, Allison M.; Wu, Jian-Zhong; Bouwman, Elisabeth; Reedijk, Jan; Spek, Anthony L.","(1,5-Dimethyl-6-oxo-1,2,4,5-tetrazinan-3-yl)imidazolium chloride","Acta Crystallographica Section E","2004","60","12","o2482","o2484","10.1107/S1600536804030545","","","0.71073","MoKα","","0.0597","0.0403","","","0.1003","0.1061","","","","","","1.057","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204792","7.6861","0.0003","10.8182","0.0004","7.8238","0.0003","90","","91.469","0.0016","90","","650.33","0.04","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,5-Dimethyl-1,2,4,5-tetrazinane-3,6-dione","","- C4 H8 N4 O2 -","- C4 H8 N4 O2 -","- C16 H32 N16 O8 -","4","1","RZ6023","Mills, Allison M.; Wu, Jian-Zhong; Bouwman, Elisabeth; Reedijk, Jan; Spek, Anthony L.","1,5-Dimethyl-1,2,4,5-tetrazinane-3,6-dione","Acta Crystallographica Section E","2004","60","12","o2485","o2487","10.1107/S1600536804030557","","","0.71073","MoKα","","0.0549","0.0384","","","0.0995","0.1098","","","","","","1.046","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204793","6.2289","0.0006","10.024","0.001","7.8351","0.0008","90","","97.987","0.002","90","","484.47","0.08","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1,1'-Dibromoferrocene","","- C10 H8 Br2 Fe -","- C10 H8 Br2 Fe -","- C20 H16 Br4 Fe2 -","2","1","SJ6016","Hnetinka, Chrissy A.; Hunter, Allen D.; Zeller, Matthias; Lesley, M. J. Gerald","1,1'-Dibromoferrocene","Acta Crystallographica Section E","2004","60","12","m1806","m1807","10.1107/S1600536804028429","","","0.71073","MoKα","","0.037","0.0367","","","0.0943","0.0945","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204794","9.9739","0.0014","20.116","0.002","17.033","0.004","90","","90.86","0.016","90","","3417","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(tetraethylammonium) bis(2-thioxo-1,3-dithiole-4,5-dithiolato)cadmium(II)","","- C22 H40 Cd N2 S10 -","- C22 H40 Cd N2 S10 -","- C88 H160 Cd4 N8 S40 -","4","1","SJ6018","Li, Ting Bin; Yu, Wen Tao; Xu, Dong; Wang, Xin Qiang; Zhang, Guang Hui","Bis(tetraethylammonium) bis(2-thioxo-1,3-dithiole-4,5-dithiolato)cadmium(II)","Acta Crystallographica Section E","2004","60","12","m1886","m1888","10.1107/S1600536804029277","","","0.71073","MoKα","","0.0555","0.0376","","","0.0874","0.0949","","","","","","1.015","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204795","7.646","0.003","11.07","0.004","13.815","0.004","90","","90","","90","","1169.3","0.7","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","4-(1,3-dioxoisoindolin-2-yl)benzaldehyde","","- C15 H9 N O3 -","- C15 H9 N O3 -","- C60 H36 N4 O12 -","4","1","SJ6020","Liu, Xin-Gang; Feng, Ya-Qing; Wu, Peng; Chen, Xue; Li, Fei","4-(1,3-Dioxoisoindolin-2-yl)benzaldehyde","Acta Crystallographica Section E","2004","60","12","o2293","o2294","10.1107/S1600536804028272","","","0.71073","MoKα","","0.0591","0.0372","","","","0.0915","","","","","","1.094","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204796","8.842","0.003","9.519","0.003","11.996","0.003","99.095","0.019","103.42","0.02","90.85","0.02","968.4","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","bis{μ-1-[4-(carbodiimido)phenyl]tetrazolato-κ^2^N:C^5^} bis[bis(trimethylphosphine-κP)palladium(II)]","","- C28 H44 N12 P4 Pd2 -","- C28 H44 N12 P4 Pd2 -","- C28 H44 N12 P4 Pd2 -","1","0.5","SJ6022","Han, Won Seok; Lee, Hee Keun; Kim, Yong-Joo; Lee, Soon W.","A cyclic dipalladium compound formed by concomitant N‒C coupling and [2+3]-cycloaddition: bis{μ-1-[4-(carbodiimido)phenyl]tetrazolato-κ^2^<i>N</i>:<i>C</i>^5^}bis[bis(trimethylphosphine-κ<i>P</i>)palladium(II)]","Acta Crystallographica Section E","2004","60","12","m1813","m1814","10.1107/S1600536804028260","","","0.71073","MoKα","","0.0393","0.0348","","","0.0903","0.0939","","","","","","1.034","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204797","7.559","0.0015","10.862","0.002","13.144","0.003","72.12","0.03","80.82","0.03","84.33","0.03","1012.5","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[[diaquabis(3-hydroxypyridine-κN)cobalt(II)]-μ- (4-carboxylatophenoxyacetato-κ^2^O:O'] monohydrate]","","- C19 H22 Co N2 O10 -","- C19 H22 Co N2 O10 -","- C38 H44 Co2 N4 O20 -","2","1","SJ6024","Gao, Shan; Gu, Chang-Sheng; Huo, Li-Hua; Liu, Ji-Wei; Zhao, Jing-Gui","<i>catena</i>-Poly[[[diaquabis(3-hydroxypyridine-κ<i>N</i>)cobalt(II)]-μ-(4-carboxylatophenoxy)acetato-κ^2^<i>O</i>:<i>O</i>'] monohydrate]","Acta Crystallographica Section E","2004","60","12","m1830","m1832","10.1107/S1600536804028673","","","0.71073","MoKα","","0.043","0.0387","","","0.1023","0.105","","","","","","1.029","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204798","8.769","0.006","11.178","0.008","12.418","0.009","71.074","0.009","77.684","0.009","88.014","0.009","1124.1","1.4","163","2","163","2","","","","","","","","4","P -1","-P 1","2","6-Isopropoxy-5-isopropyl-1H-pyrimidine-2,4-dione","6-Isopropoxy-5-isopropylpyrimidine-2,4(1H,3H)-dione","","- C10 H16 N2 O3 -","- C10 H16 N2 O3 -","- C40 H64 N8 O12 -","4","2","SJ6029","Lewis, William; McKeown, Robert H.; Robinson, Ward T.","6-Isopropoxy-5-isopropylpyrimidine-2,4(1<i>H</i>,3<i>H</i>)-dione","Acta Crystallographica Section E","2004","60","12","o2429","o2431","10.1107/S1600536804030077","","","0.71073","MoKα","","0.1251","0.0769","","","0.1828","0.1979","","","","","","0.912","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204799","7.5678","0.0008","14.4964","0.0016","5.9874","0.0005","90","","108.607","0.006","90","","622.52","0.11","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-dinitrodibenzyl","","- C14 H12 N2 O4 -","- C14 H12 N2 O4 -","- C28 H24 N4 O8 -","2","0.5","SJ6030","Hemmige S. Yathirajan; Basavegowda Nagaraj; Padmarajaiah Nagaraja; Daniel E. Lynch","2,2'-Dinitrodibenzyl","Acta Crystallographica Section E","2004","60","12","o2455","o2456","10.1107/S1600536804030326","","","0.71073","MoKα","","0.1084","0.0606","","","0.1432","0.1652","","","","","","1.029","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204800","5.9572","0.0004","12.9894","0.0009","12.1234","0.0009","90","","98.169","0.001","90","","928.6","0.11","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate","","- C9 H9 N O2 S -","- C9 H9 N O2 S -","- C36 H36 N4 O8 S4 -","4","1","SJ6031","Chantson, Janine T; Liles, David C","Ethyl 4<i>H</i>-thieno[3,2-<i>b</i>]pyrrole-5-carboxylate","Acta Crystallographica Section E","2004","60","12","o2493","o2494","10.1107/S1600536804030569","","","0.71073","MoKα","","0.0438","0.0395","","","0.106","0.1133","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204801","9.642","0.002","11.103","0.002","13.272","0.003","90","","91.01","0.03","90","","1420.6","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","bis(dimethylammonium) terephtalate","","- C12 H20 N2 O4 -","- C12 H20 N2 O4 -","- C48 H80 N8 O16 -","4","1","TK6190","Karpova, Elena V.; Zakharov, Maxim A.; Gutnikov, Sergey I.; Alekseyev, Roman S.","Bis(dimethylammonium) terephthalate","Acta Crystallographica Section E","2004","60","12","o2491","o2492","10.1107/S1600536804028685","","","0.71073","MoKα","","0.097","0.053","","","0.121","0.134","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204802","13.27","0.003","12.861","0.003","8.77","0.002","90","","115.791","0.004","90","","1347.6","0.5","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Bis(3,5-dimethyl-1,2,4-triazolato-κN^4^)bis(pivalic acid-κO)copper(II) dihydrate","","- C18 H36 Cu N6 O6 -","- C18 H36 Cu N6 O6 -","- C36 H72 Cu2 N12 O12 -","2","0.25","TK6192","Zhou, Jian-Hao; Li, Yi-Zhi; Huang, Bin; Chen, Xue-Tai","Bis(3,5-dimethyl-1,2,4-triazolato-κ<i>N</i>^4^)bis(pivalic acid-κ<i>O</i>)copper(II) dihydrate","Acta Crystallographica Section E","2004","60","12","m1889","m1891","10.1107/S1600536804028697","","","0.71073","MoKα","","0.07","0.062","","","0.161","0.164","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204803","14.4124","0.0006","12.583","0.0006","17.9361","0.0008","90","","104.833","0.001","90","","3144.3","0.2","295","2","295","2","","","","","","","","5","C 1 2 1","C 2y","5","","μ-3,4,5,6-Tetrafluorophthalato-bis[tris(2-methyl-2-phenylpropyl)tin(IV)]","","- C68 H78 F4 O4 Sn2 -","- C68 H78 F4 O4 Sn2 -","- C136 H156 F8 O8 Sn4 -","2","0.5","TK6194","Tian, Lai-Jin; Sun, Yu-Xi; Ng, Seik Weng","μ-3,4,5,6-Tetrafluorophthalato-bis[tris(2-methyl-2-phenylpropyl)tin(IV)]","Acta Crystallographica Section E","2004","60","12","m1752","m1753","10.1107/S1600536804027229","","","0.71073","MoKα","","0.032","0.028","","","0.065","0.068","","","","","","0.99","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204804","16.541","0.002","16.541","","25.154","0.007","90","","90","","120","","5960.2","1.8","295","2","295","2","","","","","","","","6","R -3 m :H","-R 3 2""","166","","tris(dimethylammonium) dodecamolybdophosphate","","- C6 H24 Mo12 N3 O40 P -","- C6 H24 Mo12 N3 O40 P -","- C36 H144 Mo72 N18 O240 P6 -","6","0.166667","TK6195","Ng, Seik Weng","Rerefinement of tris(dimethylammonium) dodecamolybdophosphate in the space group <i>R</i>øverline 3<i>m</i>","Acta Crystallographica Section E","2004","60","12","m1786","m1787","10.1107/S1600536804027941","","","0.71073","MoKα","","0.033","0.027","","","0.067","0.069","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204805","5.9624","0.0001","10.5889","0.0002","10.7089","0.0002","90","","90","","90","","676.11","0.02","190","","190","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1R,5S,8R)-1,8-Dihydroxy-6-oxa-3-azabicyclo[3.2.1]octan-2-one","","- C6 H9 N O4 -","- C6 H9 N O4 -","- C24 H36 N4 O16 -","4","1","TK6196","Punzo, Francesco; Watkin, David J.; Iezzi Simone, Michela; Fleet, George W. J.","(1<i>R</i>,5<i>S</i>,8<i>R</i>)-1,8-Dihydroxy-6-oxa-3-azabicyclo[3.2.1]octan-2-one","Acta Crystallographica Section E","2004","60","12","o2315","o2317","10.1107/S1600536804028983","","","0.71073","MoKα","","0.028","0.028","","0.069","0.069","0.069","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204806","11.824","0.001","6.9357","0.0006","14.4896","0.0012","90","","90.423","0.002","90","","1188.23","0.17","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","bis(2-pyrimidinyl)disulfide dihydrate","Bis(2-pyrimidinyl) disulfide dihydrate","","- C8 H10 N4 O2 S2 -","- C8 H10 N4 O2 S2 -","- C32 H40 N16 O8 S8 -","4","1","TK6197","Jensen, Gayleen B.; Smith, Graham; Sagatys, Dalius S.; Healy, Peter C.; White, Jonathan M.","Bis(2-pyrimidinyl) disulfide dihydrate: a redetermination","Acta Crystallographica Section E","2004","60","12","o2438","o2440","10.1107/S1600536804029782","","","0.71069","MoKα","","0.044","0.037","","","0.098","0.103","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204807","29.0545","0.0014","42.7251","0.0015","4.784","0.001","90","","90","","90","","5938.6","1.3","293","2","293","2","","","","","","","","5","F d d 2","F 2 -2d","43","","poly[[(1H-benzimidazole-κN^3^)copper(II)]-μ~3~-(3-carboxylatophenoxyacetato- κ^4^O,O':O'':O''')]","","- C16 H12 Cu N2 O5 -","- C16 H12 Cu N2 O5 -","- C256 H192 Cu16 N32 O80 -","16","1","TK6198","Gao, Shan; Gu, Chang-Sheng; Huo, Li-Hua; Liu, Ji-Wei; Zhao, Jing-Gui","A two-dimensional coordination polymer containing copper(II): poly[[(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)copper(II)]-μ~3~-3-carboxylatophenoxyacetato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'':<i>O</i>''']","Acta Crystallographica Section E","2004","60","12","m1936","m1938","10.1107/S1600536804030065","","","0.71073","MoKα","","0.052","0.041","","","0.095","0.102","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204808","8.3007","0.0005","12.2295","0.0006","16.5605","0.001","103.42","0.004","95.561","0.003","106.758","0.003","1541.35","0.16","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","2-Butyl-4-chloro-1-(4-nitrobenzyl)-1H-imidazole-5-carboxaldehyde","","- C15 H16 Cl N3 O3 -","- C15 H16 Cl N3 O3 -","- C60 H64 Cl4 N12 O12 -","4","2","TK6201","Gaonkar, Santhosh L.; Yathirajan, Hemmige S.; Nagaraj, Basavegowda; Narasegowda, Rajenahally S.; Lynch, Daniel E.","2-Butyl-4-chloro-1-(4-nitrobenzyl)-1<i>H</i>-imidazole-5-carboxaldehyde","Acta Crystallographica Section E","2004","60","12","o2520","o2521","10.1107/S1600536804031162","","","0.71073","MoKα","","0.121","0.057","","","0.114","0.139","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204809","12.6214","0.0006","6.2949","0.0002","9.3973","0.0004","90","","98.254","0.002","90","","738.89","0.05","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Pentafluoroboronic acid","","- C6 H2 B F5 O2 -","- C6 H2 B F5 O2 -","- C24 H8 B4 F20 O8 -","4","1","WK6027","Horton, Peter N.; Hursthouse, Michael B.; Beckett, Michael A.; Rugen-Hankey, Martin P.","Pentafluorophenylboronic acid","Acta Crystallographica Section E","2004","60","12","o2204","o2206","10.1107/S1600536804022408","","","0.71073","MoKα","","0.073","0.044","","","0.102","0.116","","","","","","1.029","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204810","13.302","0.003","11.707","0.002","14.412","0.003","90","","91.76","0.03","90","","2243.3","0.8","85","2","85","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","substituted isoxazole carboxylic acid ethyl ester","Ethyl 5-(5-oxo-2,3-dihydro-5H-oxazolo[2,3-a]isoindol-9b-ylmethyl)-4-(2,5,5-trimethyl- 1,3-dioxan-2-yl)isoxazole-3-carboxylate","","- C24 H28 N2 O7 -","- C24 H28 N2 O7 -","- C96 H112 N8 O28 -","4","1","WK6034","Nelson, Jared; Twamley, Brendan; Natale, Nicholas R.","Ethyl 5-(5-oxo-2,3-dihydro-5<i>H</i>-oxazolo[2,3-<i>a</i>]isoindol-9b-ylmethyl)-4-(2,5,5-trimethyl-1,3-dioxan-2-yl)isoxazole-3-carboxylate: the product of a novel synthetic method","Acta Crystallographica Section E","2004","60","12","o2255","o2257","10.1107/S1600536804027655","","","0.71073","MoKα","","0.07","0.048","","","0.107","0.117","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204811","28.352","0.004","9.1532","0.0011","12.1556","0.0015","90","","102.178","0.002","90","","3083.5","0.7","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","(pabtp)Ni","{4,4'-Di-tert-butyl-6,6'-bis(dimethoxymethyl)-2,2'-[propane-1,3- diylbis(nitrilomethylidyne)]bis(thiophenolato)-κ^4^S,N,N',S'}nickel(II)","","- C31 H44 N2 Ni O4 S2 -","- C31 H44 N2 Ni O4 S2 -","- C124 H176 N8 Ni4 O16 S8 -","4","0.5","WK6035","Bjernemose, Jens K.; McKenzie, Christine J.; Raithby, Paul R.; Teat, Simon J.","{4,4'-Di-<i>tert</i>-butyl-6,6'-bis(dimethoxymethyl)-2,2'-[propane-1,3-diylbis(nitrilomethylidyne)]bis(thiophenolato)-κ^4^<i>S,N,N</i>',<i>S</i>'}nickel(II)","Acta Crystallographica Section E","2004","60","12","m1841","m1843","10.1107/S1600536804028879","","","0.6881","Synchrotron","","0.098","0.084","","","0.213","0.228","","","","","","1.038","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204812","9.2004","0.0018","8","0.0016","12.735","0.003","90","","92.95","0.03","90","","936.1","0.3","150","2","150","2","","","","","","","","1","P 1 21/c 1","-P 2ybc","14","","beta-monoclinic cyclooctaselenium","","- Se8 -","- Se8 -","- Se32 -","4","1","WM6031","Tiina Maaninen; Jari Konu; Risto S. Laitinen","A low-temperature redetermination of the monoclinic β-form of cyclooctaselenium","Acta Crystallographica Section E","2004","60","12","o2235","o2237","10.1107/S1600536804024055","","","0.71073","MoKα","","0.0584","0.04","","","0.0874","0.0954","","","","","","1.091","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204813","24.392","0.008","9.278","0.003","28.403","0.01","90","","94.979","0.007","90","","6404","4","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Monopotassium octapyridinium tris[hexachlorobismuthate(III)]","","- C40 H48 Bi3 Cl18 K N8 -","- C40 H48 Bi3 Cl18 K N8 -","- C160 H192 Bi12 Cl72 K4 N32 -","4","1","WM6037","Zhang, Hui; Fang, Liang","Monopotassium octapyridinium tris[hexachlorobismuthate(III)]","Acta Crystallographica Section E","2004","60","12","m1819","m1821","10.1107/S1600536804028521","","","0.71073","MoKα","","0.0516","0.032","","","0.064","0.0782","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204814","17.6404","0.0003","6.70735","0.00008","6.99525","0.00008","90","","109.157","0.001","90","","781.846","0.019","295","","295","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Gallium borophosphate","gallium catena-[monohydrogenborate-dihydrogenborate-bis(monohydrogenphosphate)]","","- B2 Ga H5 O12 P2 -","- B2 Ga O12 P2 -","- B8 Ga4 O48 P8 -","4","0.5","WM6038","Shao-Yu Mao; Jin-Xiao Mi; Liev G. Akselrud; Ya-Xi Huang; Jing-Tai Zhao; Rüdiger Kniep","The layered gallium borophosphate Ga[B~2~P~2~O~7~(OH)~5~] refined from X-ray powder data","Acta Crystallographica Section E","2004","60","12","i149","i151","10.1107/S1600536804029150","","","1.5406","CuKα~1~","","0.033","","","","","","","","","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204815","13.122","0.003","13.122","0.003","9.0964","0.0018","90","","90","","120","","1356.4","0.5","293","2","293","2","","","","","","","","3","P 63/m c m","-P 6c 2","193","","dicerium triruthenium pentadecaaluminium","","- Al15 Ce2 Ru3 -","- Al15 Ce2 Ru3 -","- Al60 Ce8 Ru12 -","4","0.166667","WM6039","Tursina, Anna I.; Nesterenko, Sergei N.; Murashova, Elena V.; Chernyshev, Ilia V.; Noël, Henri; Seropegin, Yuri D.","Ce~2~Ru~3~Al~15~, an intermetallic compound of a new structure type","Acta Crystallographica Section E","2004","60","12","i145","i146","10.1107/S1600536804030119","","","0.71073","MoKα","","0.0958","0.0294","","","0.082","0.1268","","","","","","0.74","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204816","9.9205","0.0008","11.507","0.001","9.9406","0.0009","90","","90","","90","","1134.77","0.17","153","2","153","2","","","","","","","","3","P n m a","-P 2ac 2n","62","Tricesium tantalum tetrasulfide","Tricesium tantalum tetrasulfide","","- Cs3 S4 Ta -","- Cs3 S4 Ta -","- Cs12 S16 Ta4 -","4","0.5","WM6040","Deng, Bin; Ibers, James A.","Cs~3~TaS~4~","Acta Crystallographica Section E","2004","60","12","i147","i148","10.1107/S1600536804029927","","","0.71073","MoKα","","0.0257","0.0255","","","0.0705","0.0707","","","","","","1.198","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204817","11.6509","0.001","18.0743","0.0017","16.5092","0.0016","90","","128.36","0.002","90","","2726","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Chloro[2-(1-ethyl-1H-benzoimidazol-2-yl)phenol-κN]o[2-(1-ethyl-1H- benzoimidazol-2-yl)phenolato-κ^2^N^3^,O]zinc(II)","","- C30 H27 Cl N4 O2 Zn -","- C30 H27 Cl N4 O2 Zn -","- C120 H108 Cl4 N16 O8 Zn4 -","4","1","WN6291","Tong, Yi-Ping; Ye, Bao-Hui","Chloro[2-(1-ethyl-1<i>H</i>-benzimidazol-2-yl)phenol-κ<i>N</i>^3^][2-(1-ethyl-1<i>H</i>-benzimidazol-2-yl)phenolato-κ^2^<i>N</i>^3^,<i>O</i>]zinc(II)","Acta Crystallographica Section E","2004","60","12","m1927","m1929","10.1107/S1600536804028880","","","0.71073","MoKα","","0.1239","0.0628","","","0.1375","0.1625","","","","","","1.005","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204818","7.8909","0.001","10.2693","0.0014","13.2831","0.0018","86.49","0.002","72.899","0.002","78.974","0.003","1009.8","0.2","190","2","190","2","","","","","","","","4","P -1","-P 1","2","","[2-(Dimethylamino)benzyl][(N‒B)-2-(dimethylammonio)benzyl]phenylborate","","- C24 H29 B N2 -","- C24 H29 B N2 -","- C48 H58 B2 N4 -","2","1","WN6293","Tong, Hong-Bo; Wei, Xue-Hong; Liu, Dian-Sheng; Huang, Shu-Ping","[2-(Dimethylamino)benzyl][(<i>N</i>‒<i>B</i>)-2-(dimethylammonio)benzyl]phenylborate","Acta Crystallographica Section E","2004","60","12","o2270","o2272","10.1107/S1600536804028065","","","0.71073","MoKα","","0.1205","0.0871","","","0.1607","0.1759","","","","","","1.16","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204819","7.3236","0.001","7.6535","0.001","18.761","0.003","90","","100.312","0.002","90","","1034.6","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-[(4-Bromo-2-thienyl)methylenehydrazinocarboxyl]-1H-1,2,4-triazole","","- C8 H6 Br N5 O S -","- C8 H6 Br N5 O S -","- C32 H24 Br4 N20 O4 S4 -","4","1","WN6294","Jian-Guo Yang; Fu-You Pan","3-[(4-Bromo-2-thienyl)methylenehydrazinocarbonyl]-1<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2004","60","12","o2342","o2344","10.1107/S1600536804026613","","","0.71073","MoKα","","0.0604","0.0483","","","0.1243","0.1281","","","","","","0.967","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204820","9.8626","0.0008","10.4697","0.0009","12.5629","0.0011","114.049","0.001","103.946","0.001","92.633","0.002","1134.39","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1'-Methyl-2''-phenylcyclohexane-1-spiro-4'-[acenapthene-1-spiro-2'- pyrrolidine-3'-spiro-4''-[1,3]oxazole]-2,5''-dione","","- C29 H26 N2 O3 -","- C29 H26 N2 O3 -","- C58 H52 N4 O6 -","2","1","WN6300","S. Selvanayagam; D. Velmurugan; K. Ravikumar; J. Jayashankaran; R. Rathna Durga; R. Raghunathan","1'-Methyl-2''-phenylcyclohexane-1-spiro-4'-[acenaphthene-1-spiro-2'-pyrrolidine-3'-spiro-4''(5''<i>H</i>)-[1,3]oxazole]-2,5''-dione","Acta Crystallographica Section E","2004","60","12","o2216","o2218","10.1107/S1600536804027503","","","0.71073","MoKα","","0.0498","0.0437","","","0.1267","0.1339","","","","","","1.002","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204821","10.071","0.002","12.016","0.002","12.966","0.003","102.92","0.03","98.52","0.03","113.49","0.03","1352.3","0.7","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","(N-Benzoyl-N-phenylhydroxlaminato-κ^2^O,O')oxo(salicylaldehyde isonicotinoylhydrazonato-κ^3^O,N,N')vanadium(IV) hexane hemisolvate","","- C29 H27 N4 O5 V -","- C29 H27 N4 O5 V -","- C58 H54 N8 O10 V2 -","2","1","WN6302","Gao, Shan; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","(<i>N</i>-Benzoyl-<i>N</i>-phenylhydroxaminato-κ^2^<i>O,O</i>')(salicylaldehyde isonicotinoylhydrazonato-κ^3^<i>O,N,N</i>')vanadium(IV) hexane hemisolvate","Acta Crystallographica Section E","2004","60","12","m1757","m1758","10.1107/S1600536804027497","","","0.71073","MoKα","","0.1083","0.0578","","","0.1241","0.141","","","","","","1.011","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204822","10.553","0.012","8.948","0.01","30.84","0.03","90","","90","","90","","2912","5","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","9-Chloro-10-(dimethoxymethyl)anthracene","","- C17 H15 Cl O2 -","- C17 H15 Cl O2 -","- C136 H120 Cl8 O16 -","8","1","WN6305","Wen-Bing Yuan; Lan Yan; Ru-Dong Yang","9-Chloro-10-(dimethoxymethyl)anthracene","Acta Crystallographica Section E","2004","60","12","o2447","o2448","10.1107/S1600536804030028","","","0.71073","MoKα","","0.1627","0.0713","","","0.1891","0.255","","","","","","0.952","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204823","10.455","0.0009","7.8954","0.0004","14.796","0.0012","90","","93.724","0.007","90","","1218.78","0.16","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-(2-Chlorobenzoyl)-1,3-benzoxazol-2(3H)-one","","- C14 H8 Cl N O3 -","- C14 H8 Cl N O3 -","- C56 H32 Cl4 N4 O12 -","4","1","WN6306","Şamil Işık; Yavuz Köysal; Metin Yavuz; Merç Köksal; Hakkı Erdog̃an","5-(2-Chlorobenzoyl)-1,3-benzoxazol-2(3<i>H</i>)-one","Acta Crystallographica Section E","2004","60","12","o2321","o2323","10.1107/S1600536804029162","","","0.71073","MoKα","","0.057","0.0417","","","0.117","0.1254","","","","","","1.063","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204824","19.712","0.003","9.823","0.003","15.805","0.002","90","","90","","90","","3060.3","1.1","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","3-[2-Methoxy-5-(1-phenylethyl)phenyl]-2,5-diphenyl tetrahydro-4-isoxazolyl(2-thienyl)methanone","3-[2-Methoxy-5-(1-phenylethyl)phenyl]-2,5-diphenyl tetrahydro-4-isoxazolyl(2-thienyl)methanone","","- C36 H33 N O3 S -","- C36 H33 N O3 S -","- C144 H132 N4 O12 S4 -","4","1","WN6307","Sridharan, V.; Pon Saravanakumar, S.; Muthusubramanian, S.; Anitha, K.; Sridhar, B.","{3-[2-Methoxy-5-(1-methyl-1-phenylethyl)phenyl]-2,5-diphenyl-1,2,3,4-tetrahydro-4-isoxazol-4-yl}(2-thienyl)methanone","Acta Crystallographica Section E","2004","60","12","o2503","o2505","10.1107/S1600536804030296","","","0.71073","MoKα","","0.1105","0.0378","","","0.0828","0.1043","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204825","12.7169","0.0017","7.5317","0.0013","11.2959","0.0012","90","","93.381","0.012","90","","1080","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(p-Nitrophenylsulfonyl)-1H-pyrrole","","- C10 H8 N2 O4 S -","- C10 H8 N2 O4 S -","- C40 H32 N8 O16 S4 -","4","1","WN6310","Gültekin, Zeynep; Frey, Wolfgang; Hökelek, Tuncer","<i>N</i>-(<i>p</i>-Nitrophenylsulfonyl)-1<i>H</i>-pyrrole","Acta Crystallographica Section E","2004","60","12","o2488","o2490","10.1107/S1600536804030867","","","0.71073","MoKα","","0.0726","0.0534","","","0.1376","0.1525","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204826","8.248","0.003","10.097","0.003","14.786","0.005","79.404","0.005","74.292","0.005","75.089","0.004","1136.8","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1,1,1-tris[(4-cyanophenoxy)methyl]ethane","","- C26 H21 N3 O3 -","- C26 H21 N3 O3 -","- C52 H42 N6 O6 -","2","1","WW6294","Wei Xu; Zhen-Guang Zou; Peng Guo; Yin-Xiang Lu","Conformational chirality of chemically symmetric molecules and a superlattice through enantioselective self-assembly: 1,1,1-tris[(4-cyanophenoxy)methyl]ethane","Acta Crystallographica Section E","2004","60","12","o2434","o2437","10.1107/S1600536804029939","","","0.71073","MoKα","","0.0625","0.0523","","","0.1264","0.1338","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204827","6.886","0.001","10.017","0.002","11.272","0.002","89.258","0.009","84.168","0.008","85.447","0.008","771","0.2","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","7-Chloro-2,2-dimethyl-3-(4-methylphenyl)-1,2-dihydroquinazolin-4(3H)-one","","- C17 H17 Cl N2 O -","- C17 H17 Cl N2 O -","- C34 H34 Cl2 N4 O2 -","2","1","WW6303","Shi, Daqing; Shi, Chunling; Zhuang, Qiya; Zhang, Yong","7-Chloro-2,2-dimethyl-3-(4-methylphenyl)-1,2-dihydroquinazolin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2004","60","12","o2495","o2497","10.1107/S1600536804030661","","","0.7107","MoKα","","0.0774","0.0512","","","0.1203","0.1373","","","","","","1.066","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204828","5.4595","0.0005","10.1947","0.0014","15.8862","0.0015","90","","93.979","0.008","90","","882.06","0.17","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,6-Dimethyl-4H-1-benzopyran-4-one","","- C11 H10 O2 -","- C11 H10 O2 -","- C44 H40 O8 -","4","1","YA6220","Burcu Arslan; Canan Kazak; Hakan Göker","2,6-Dimethyl-4<i>H</i>-1-benzopyran-4-one","Acta Crystallographica Section E","2004","60","12","o2238","o2240","10.1107/S1600536804027989","","","0.71073","MoKα","","0.066","0.054","","","0.175","0.184","","","","","","1.11","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204829","11.513","0.003","6.783","0.0017","12.176","0.003","90","","102.94","0.02","90","","926.7","0.4","293","2","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","4-(Dimethylamino)pyridinium 2-butoxy-3-dicyanomethylene-4-oxocyclobut-1-en-1-olate","","- C18 H20 N4 O3 -","- C18 H20 N4 O3 -","- C36 H40 N8 O6 -","2","0.5","YA6225","Roman I. Zubatyuk; Vyacheslav N. Baumer; Anatoliy L. Tatarets; Leonid D. Patsenker; Oleg V. Shishkin","4-(Dimethylamino)pyridinium 2-butoxy-3-dicyanomethylene-4-oxocyclobut-1-en-1-olate","Acta Crystallographica Section E","2004","60","12","o2252","o2254","10.1107/S1600536804027965","","","0.71073","MoKα","","","0.04","","","","0.101","","","","","","0.82","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204830","8.743","0.001","17.0087","0.0019","16.3138","0.0017","90","","98.982","0.003","90","","2396.2","0.5","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tris(ethylenediamine-κ^2^N,N')zinc(II) bis(1,2-dicyanoethylenedithiolato-κ^2^S,S')nickelate(II)","","- C14 H24 N10 Ni S4 Zn -","- C14 H24 N10 Ni S4 Zn -","- C56 H96 N40 Ni4 S16 Zn4 -","4","0.5","YA6227","Ai-Yun Fu; Da-Qi Wang; Yu, Tao","Tris(ethylenediamine-κ^2^<i>N,N</i>')zinc(II) bis(1,2-dicyanoethylenedithiolato-κ^2^<i>S,S</i>')nickelate(II)","Acta Crystallographica Section E","2004","60","12","m1939","m1940","10.1107/S1600536804029629","","","0.71073","MoKα","","0.114","0.049","","","0.064","0.07","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204831","10.038","0.003","11.559","0.004","12.74","0.004","103.203","0.006","90.14","0.006","102.247","0.006","1404.4","0.8","150","2","150","2","","","","","","","","4","P -1","-P 1","2","Isonicotinamide‒propionic acid (1:2)","Isonicotinamide‒propionic acid (1:2)","","- C12 H18 N2 O5 -","- C12 H18 N2 O5 -","- C48 H72 N8 O20 -","4","2","YA6228","Iain D.H. Oswald; W. D. Sam Motherwell; Simon Parsons","A 1:2 co-crystal of isonicotinamide and propionic acid","Acta Crystallographica Section E","2004","60","12","o2380","o2383","10.1107/S1600536804028776","","","0.71073","MoKα","","0.174","0.088","","","0.164","0.198","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204832","8.6898","0.0006","30.008","0.002","8.1262","0.0006","90","","103.622","0.001","90","","2059.4","0.2","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[4'-(2-Pyridyl)-2,2':6',2''-terpyridine-κ^3^N,N',N'']thiocyanatocopper(II) thiocynate","","- C22 H14 Cu N6 S2 -","- C22 H14 Cu N6 S2 -","- C88 H56 Cu4 N24 S8 -","4","1","AC6136","Hou, Lei; Li, Dan; Yin, Ye-Gao; Ng, Seik Weng","[4'-(2-Pyridyl)-2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']isothiocyanatocopper(II) thiocyanate","Acta Crystallographica Section E","2005","61","1","m21","m22","10.1107/S1600536804031460","","","0.71073","MoKα","","0.067","0.051","","","0.122","0.134","","","","","","1.04","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2204833","7.872","0.002","17.463","0.003","5.754","0.002","90","","90","","90","","791","0.4","293","2","293","2","","","","","","","","3","P n a 21","P 2c -2n","33","2,7-dihydroxynaphthalene","Naphthalene-2,7-diol","","- C10 H8 O2 -","- C10 H8 O2 -","- C40 H32 O8 -","4","1","AC6141","Rozycka-Sokolowska, Ewa; Marciniak, Bernard; Pavlyuk, Volodymyr","Naphthalene-2,7-diol","Acta Crystallographica Section E","2005","61","1","o114","o115","10.1107/S1600536804032453","","","0.71069","MoKα","","0.0494","0.0375","","","0.1178","0.1212","","","","","","1.196","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204834","7.0974","0.0005","12.6169","0.0008","14.0477","0.0009","115.397","0.001","90.959","0.001","102.666","0.001","1099.92","0.13","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","(η^6^-N,N-Dimethylaniline)tricarbonylchromium","","- C11 H11 Cr N O3 -","- C11 H11 Cr N O3 -","- C44 H44 Cr4 N4 O12 -","4","2","AC6142","Zeller, Matthias; Hunter, Allen D.","Tricarbonyl(η^6^-<i>N,N</i>-dimethylaniline)chromium(0)","Acta Crystallographica Section E","2005","61","1","m23","m24","10.1107/S1600536804031484","","","0.71073","MoKα","","0.0471","0.0424","","","0.0974","0.0997","","","","","","1.182","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204835","13.2146","0.0017","6.9739","0.0009","16.21","0.002","90","","91.49","0.002","90","","1493.4","0.3","273","2","273","2","","","","","","","","5","P 1 21 1","P 2yb","4","N,N,N-trimethyl-l-phenylalaninol bromide triydrate","[(R)-(+)-(1-hydroxy-3-phenylpropan-2-yl)trimethylammonium bromide] sesquihydrate","","- C12 H23 Br N O2.5 -","- C12 H23 Br N O2.5 -","- C48 H92 Br4 N4 O10 -","4","2","AC6143","Fan Chen; Zhi-Min Jin; Mao-Lin Hu","(<i>R</i>)-(+)-(1-Hydroxy-3-phenylpropan-2-yl)trimethylammonium bromide sesquihydrate","Acta Crystallographica Section E","2005","61","1","o72","o74","10.1107/S1600536804031708","","","0.71073","MoKα","","0.0541","0.0401","","","0.091","0.1021","","","","","","0.988","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2204836","7.1843","0.0009","8.7554","0.0011","21.31","0.003","90","","90","","90","","1340.4","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","8β-Hydroxy-2,6,6-trimethyl-5βH,10βH-eudesma-1,7(11)-dien-12,8-olide","","- C15 H20 O3 -","- C15 H20 O3 -","- C60 H80 O12 -","4","1","AC6144","Guang-Wen Zhang; Cheng-Zhu Liao; Xiang-Quan Ma; Cui-Xian Zhang; Hiroshi Kurihara; Xin-Sheng Yao; Jing-Yu Su; Long-Mei Zeng","8β-Hydroxy-2,6,6-trimethyl-5β<i>H</i>,10β<i>H</i>-eudesma-1,7(11)-dien-12,8-olide","Acta Crystallographica Section E","2005","61","1","o172","o173","10.1107/S1600536804032465","","","0.71073","MoKα","","0.0371","0.0352","","","0.0926","0.0947","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204837","8.2382","0.0002","10.0125","0.0003","7.8277","0.0002","90","","111.998","0.001","90","","598.66","0.03","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(ethylenediamine)nickel(II) dinitrate","","- C4 H16 N6 Ni O6 -","- C4 H16 N6 Ni O6 -","- C8 H32 N12 Ni2 O12 -","2","0.5","AC6145","Krause Bauer, Jeanette A.; Edison, Sara E.; Baldwin, Michael J.","Bis(ethylenediamine)nickel(II) dinitrate","Acta Crystallographica Section E","2005","61","1","m82","m84","10.1107/S1600536804032052","","","1.54178","CuKα","","0.0345","0.0314","","","0.0893","0.0915","","","","","","1.084","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204838","7.4189","0.0018","25.667","0.006","5.9653","0.0015","90","","90","","90","","1135.9","0.5","174","2","174","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","","4,4'-diiodobiphenyl","","- C12 H8 I2 -","- C12 H8 I2 -","- C48 H32 I8 -","4","0.5","AC6147","Britton, Doyle","4,4'-Diiodobiphenyl","Acta Crystallographica Section E","2005","61","1","o187","o188","10.1107/S1600536804033331","","","0.71073","MoKα","","0.022","0.02","","","0.042","0.042","","","","","","1.23","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204839","8.2533","0.0011","8.7907","0.0015","11.3643","0.0014","87.199","0.015","84.592","0.014","73.62","0.011","787.3","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(Acetato-κ^2^O,O')(di-2-pyridylamine-κN)(trifluoroacetato-κO)copper(II)","","- C14 H12 Cu F3 N3 O4 -","- C14 H12 Cu F3 N3 O4 -","- C28 H24 Cu2 F6 N6 O8 -","2","1","BR6170","Zeng, Xi-Rui; Huang, Lin; Lei, Liang-Ping; Tang, Shi-Hua; Peng, Shie-Ming; Lee, Gene-Hsiang","(Acetato-κ^2^<i>O,O</i>')(di-2-pyridylamine-κ<i>N</i>)(trifluoroacetato-κ<i>O</i>)copper(II)","Acta Crystallographica Section E","2005","61","1","m57","m59","10.1107/S1600536804031514","","","0.71073","MoKα","","0.0477","0.0371","","","0.1162","0.1252","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204840","11.779","0.011","7.363","0.007","12.025","0.011","90","","103.359","0.012","90","","1014.7","1.6","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H7 O7 Rb S -","- C7 H7 O7 Rb S -","- C28 H28 O28 Rb4 S4 -","4","1","BR6173","Mancheng Hu; Yanping Du; Shuni Li; Yucheng Jiang; Zhihong Liu; Chunyu Geng","Rubidium 3-carboxy-4-hydroxybenzenesulfonate monohydrate","Acta Crystallographica Section E","2005","61","1","m15","m17","10.1107/S1600536804031290","","","0.71073","MoKα","","0.0589","0.0454","","","0.1298","0.1413","","","","","","0.977","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204841","13.5565","0.0009","10.2568","0.0007","8.1885","0.0005","90","","99.524","0.001","90","","1122.89","0.13","296","2","296","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Hexaaquamanganese(II) bis[5-(4-cyanophenyl)-2H-tetrazolate]","","- C16 H20 Mn N10 O6 -","- C16 H20 Mn N10 O6 -","- C32 H40 Mn2 N20 O12 -","2","0.25","BR6174","Ma,Zhijie; Tao, Jun; Huang, Rong-Bin; Zhang, Lan-Sun","Hexaaquamanganese(II) bis[5-(4-cyanophenyl)-2<i>H</i>-tetrazolate]","Acta Crystallographica Section E","2005","61","1","m1","m2","10.1107/S160053680403106X","","","0.71073","MoKα","","0.0437","0.0432","","","0.1097","0.1102","","","","","","1.154","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204842","14.74","0.003","10.883","0.002","14.075","0.003","90","","96.91","0.03","90","","2241.4","0.8","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(2-hydroxypyridinium) naphthalene-1,5-disulfonate dihydrate","","- C20 H22 N2 O10 S2 -","- C20 H22 N2 O10 S2 -","- C80 H88 N8 O40 S8 -","4","1","BT6557","Gao, Shan; Huo, Li-Hua; Ng, Seik Weng","Bis(2-hydroxypyridinium) naphthalene-1,5-disulfonate dihydrate","Acta Crystallographica Section E","2005","61","1","o98","o99","10.1107/S1600536804032313","","","0.71073","MoKα","","0.066","0.044","","","0.113","0.123","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204843","7.683","0.004","11.341","0.008","11.344","0.005","82.12","0.02","71.01","0.02","79.56","0.03","915.9","0.9","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","diaquabis(μ~4~-benzene-1,2,4-tricarboxylato)bis(2,2'-bipyridine)tricadmium(II)","","- C38 H26 Cd3 N4 O14 -","- C38 H26 Cd3 N4 O14 -","- C38 H26 Cd3 N4 O14 -","1","0.5","BT6564","Wang, Xiu-Li; Liu, Fu-Chen; Li, Jian-Rong; Ng, Seik Weng","Polymeric diaquabis(μ~4~-benzene-1,2,4-tricarboxylato)bis(2,2'-bipyridine)tricadmium(II)","Acta Crystallographica Section E","2005","61","1","m123","m125","10.1107/S1600536804032520","","","0.71073","MoKα","","0.026","0.023","","","0.09","0.091","","","","","","1.29","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204844","7.683","0.001","8.549","0.001","9.382","0.001","76.249","0.002","70.14","0.002","72.355","0.002","546.04","0.11","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2,2'-Dipropylmalonic acid","","- C9 H16 O4 -","- C9 H16 O4 -","- C18 H32 O8 -","2","1","BT6565","Mondal, S.; Narasegowda, R. S.; Nagaraj, B.; Yathirajan, H. S.; Narasimhamurthy, T.; Rathore, Ravindranath S.","2,2'-Dipropylmalonic acid: intermolecular association <i>via</i> strong O—H···O hydrogen bonds","Acta Crystallographica Section E","2005","61","1","o151","o153","10.1107/S1600536804033045","","","0.71073","MoKα","","0.0628","0.0505","","","0.14","0.1503","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204845","7.0046","0.0008","13.1146","0.0014","8.4316","0.0009","90","","109.753","0.002","90","","728.97","0.14","273","2","273","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(3R,6S,6aR,9S,9aS)-6,6a,9-Trihydroxy-3,6,9a- trimethylperhydroazuleno[1,2-b]furan-2-one","","- C15 H24 O5 -","- C15 H24 O5 -","- C30 H48 O10 -","2","1","BT6566","G. Y. S. K. Swamy; K. Ravikumar; Biswanath Das; G. Mahender","(3<i>R</i>*,6<i>S</i>*,6<i>aR</i>*,9<i>S</i>*,9<i>aS</i>*)-6,6a,9-Trihydroxy-3,6,9a-trimethylperhydroazuleno[1,2-<i>b</i>]furan-2-one","Acta Crystallographica Section E","2005","61","1","o121","o123","10.1107/S1600536804032532","","","0.71073","MoKα","","0.0374","0.0368","","","0.0871","0.0874","","","","","","1.157","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204846","22.563","0.005","5.464","0.001","17.901","0.004","90","","126.02","0.03","90","","1785","0.9","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Trisodium [hydrogen bis(5-sulfonatosalicylate)] monohydrate","","- C14 H11 Na3 O13 S2 -","- C14 H11 Na3 O13 S2 -","- C56 H44 Na12 O52 S8 -","4","0.5","BT6571","Zhu, Zhi-Biao; Gao, Shan; Huo, Li-Hua; Ng, Seik Weng","Hydrogen trisodium bis(5-sulfonatosalicylate) monohydrate","Acta Crystallographica Section E","2005","61","1","m192","m194","10.1107/S1600536804033604","","","0.71073","MoKα","","0.032","0.03","","","0.087","0.089","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204847","25.152","0.005","9.76","0.002","15.557","0.003","90","","123.01","0.03","90","","3202.5","1.6","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","N-(2-Hydroxy-1-naphthalidene)phenylalanine","(2-carboxy-1-phenylethyl)iminiomethylene-1-naphth-2-olate","","- C20 H17 N O3 -","- C20 H17 N O3 -","- C160 H136 N8 O24 -","8","1","BT6572","Gao, Shan; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","1-[(2-Carboxy-1-phenylethyl)iminiomethylene]naphth-2-olate","Acta Crystallographica Section E","2005","61","1","o192","o194","10.1107/S1600536804033616","","","0.71073","MoKα","","0.075","0.048","","","0.115","0.127","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204848","5.8699","0.0005","9.1235","0.0008","9.3113","0.0008","86.746","0.002","77.125","0.002","87.728","0.002","485.15","0.07","120","2","120","2","","","","","","","","6","P -1","-P 1","2","Sodium pamidronate monohydrate","sodium 3-ammonium-1-hydroxypropylidene-1,1-bisphosphonate monohydrate","","- C3 H12 N Na O8 P2 -","- C3 H12 N Na O8 P2 -","- C6 H24 N2 Na2 O16 P4 -","2","1","BV6006","Stahl, Kenny; Treppendahl, Svend P.; Preikschat, Herbert; Fischer, Erik","Sodium 3-ammonio-1-hydroxypropylidene-1,1-bisphosphonate monohydrate","Acta Crystallographica Section E","2005","61","1","m132","m134","10.1107/S1600536804032568","","","0.71073","MoKα","","0.0497","0.0449","","","0.108","0.1112","","","","","","1.103","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204849","12.8062","0.0007","8.1242","0.0004","12.4333","0.0008","90","","100.61","0.002","90","","1271.45","0.12","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H32 Cl2 N8 Ni -","- C24 H32 Cl2 N8 Ni -","- C48 H64 Cl4 N16 Ni2 -","2","0.5","BV6007","W. G. Piyal Ariyananda; Richard E. Norman","Tetrakis(1,2-diaminobenzene)-κ^2^<i>N</i>;κ^4^<i>N,N</i>'-nickel(II) dichloride","Acta Crystallographica Section E","2005","61","1","m187","m189","10.1107/S1600536804033574","","","0.7107","MoKα","","0.0681","0.0625","","0.1258","","0.1097","","","0.9827","","","1.0224","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204850","13.047","0.002","11.6893","0.0014","7.8244","0.0012","90","","109.954","0.017","90","","1121.7","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Poly[[[triaquaerbium(III)]-μ~3~-succinato] chloride dihydrate]","Poly[[[triaquaerbium(III)]-μ~3~-succinato] chloride dihydrate]","","- C4 H14 Cl Er O9 -","- C4 H14 Cl Er O9 -","- C16 H56 Cl4 Er4 O36 -","4","0.5","CF6390","Nika, Wassiliki; Pantenburg, Ingo; Meyer, Gerd","Poly[[[triaquaerbium(III)]-μ~3~-succinato] chloride dihydrate]","Acta Crystallographica Section E","2005","61","1","m138","m140","10.1107/S1600536804032635","","","0.71073","MoKα","","0.0237","0.0202","","","0.0504","0.0511","","","","","","1.118","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204851","7.7315","0.0003","6.2859","0.0003","10.4209","0.0006","90","","102.102","0.0017","90","","495.19","0.04","190","","190","","","","","","","","","3","P 1 21 1","P 2yb","4","","3,4-O-Isoprpylidene-D-arabinono-1,5-lactone","","- C9 H14 O5 -","- C9 H14 O5 -","- C18 H28 O10 -","2","1","CF6391","Punzo, Francesco; Watkin, David J.; Jenkinson, Sarah F.; Fleet, George W. J.","3,4-<i>O</i>-Isopropylidene-2-<i>C</i>-methyl-<small>D</small>-arabinono-1,5-lactone","Acta Crystallographica Section E","2005","61","1","o127","o129","10.1107/S1600536804032659","","","0.71073","MoKα","","0.0326","0.0306","","0.0784","0.0769","0.0784","","","","","","0.9927","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204852","19.395","0.003","7.5786","0.0011","7.393","0.0011","90","","98.607","0.003","90","","1074.4","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-[(2-Chlorophenyl)methylenehydrazinocarbonyl]-1H-1,2,4-triazole","","- C10 H8 Cl N5 O -","- C10 H8 Cl N5 O -","- C40 H32 Cl4 N20 O4 -","4","1","CI6470","Fu-You Pan; Jian-Guo Yang","3-[(2-Chlorophenyl)methylenehydrazinocarbonyl]-1<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2005","61","1","o63","o64","10.1107/S1600536804027151","","","0.71073","MoKα","","0.095","0.0597","","","0.1228","0.1378","","","","","","0.995","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204853","9.985","0.0008","13.644","0.0011","16.3425","0.0014","90","","101.292","0.001","90","","2183.3","0.3","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N-(2-Chlorophenyl)-2-((1E)-[4-(dimethylamino)phenyl]methyleneamino)-4,7- dihydro-1-benzothiophene-3-carboxamide","","- C24 H22 Cl N3 O S -","- C24 H22 Cl N3 O S -","- C96 H88 Cl4 N12 O4 S4 -","4","1","CI6479","G. N. Anil Kumar; M .K. Kokila; Puttaraja; S.Mohan; K. S. Majunath shetty; Manohar V. Kulkarni","<i>N</i>-(2-Chlorophenyl)-2-{(1<i>E</i>)-[4-(dimethylamino)phenyl]methyleneamino}-4,7-dihydro-1-benzothiophene-3-carboxamide","Acta Crystallographica Section E","2005","61","1","o69","o71","10.1107/S1600536804031988","","","0.71073","MoKα","","0.0815","0.0692","","","0.1515","0.1577","","","","","","1.239","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204854","11.28","0.005","11.884","0.005","10.657","0.005","90","","114.169","0.005","90","","1303.4","1","150","","150","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","3-Hydroxy-1,3-di-p-tolylpropenone","","- C17 H16 O2 -","- C17 H16 O2 -","- C68 H64 O8 -","4","0.5","CI6484","Dege, Necmi; Yıldım, İsmail; Güldeste, Ayhan; İnaç, Hasan; Koca, İrfan; Nermin, Kahveci; Özyetiş, Ahmet; Büyükgüngör, Orhan","3-Hydroxy-1,3-di-<i>p</i>-tolylpropenone","Acta Crystallographica Section E","2005","61","1","o60","o62","10.1107/S1600536804030107","","","0.71073","MoKα","","0.0473","0.039","","","0.112","0.1167","","","","","","1.09","","","","has coordinates","198748","2020-10-21","18:00:00",""
"2204855","13.532","0.002","13.532","0.002","6.746","0.002","90","","90","","90","","1235.3","0.4","295","2","295","2","","","","","","","","3","I -4","I -4","82","","Tetrakis(phenylethynyl)germanium(IV)","","- C32 H20 Ge -","- C32 H20 Ge -","- C64 H40 Ge2 -","2","0.25","CI6492","Churakov, Andrei V.; Karlov, Sergey S.; Yakubova, Elmira Kh.; Selina, Anastasia A.; Zaitseva, Galina S.","Tetrakis(phenylethynyl)germanium(IV)","Acta Crystallographica Section E","2005","61","1","m52","m54","10.1107/S1600536804031241","","","0.71073","MoKα","","0.0309","0.0276","","","0.0642","0.0654","","","","","","1.149","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204856","10.352","0.002","8.7608","0.0018","13.811","0.003","90","","90","","90","","1252.5","0.4","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","catena-Poly[[silver(I)-μ-tris(2-aminoethyl)amine-κ^4^N,N',N'':N'''] perchlorate]","","- C6 H18 Ag Cl N4 O4 -","- C6 H18 Ag Cl N4 O4 -","- C24 H72 Ag4 Cl4 N16 O16 -","4","1","CI6493","Liu, Zhao-Di; Zhu, Hai-Liang","<i>catena</i>-Poly[[silver(I)-μ-tris(2-aminoethyl)amine-κ^4^<i>N</i>,<i>N</i>',<i>N</i>'':<i>N</i>'''] perchlorate]","Acta Crystallographica Section E","2005","61","1","m44","m46","10.1107/S160053680403168X","","","0.71073","MoKα","","0.0487","0.0362","","","0.0864","0.0919","","","","","","0.948","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204857","9.837","0.0007","10.1922","0.0008","10.9181","0.0008","94.327","0.001","92.633","0.001","97.719","0.001","1079.9","0.14","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N,N'-Bis(p-methoxyphenyl)-2,2'-(p-phenylenedioxy)diacetamide","","- C24 H24 N2 O6 -","- C24 H24 N2 O6 -","- C48 H48 N4 O12 -","2","1","CI6494","Wen, Yong-Hong; Zhang, Shu-Sheng; Liang, Juan; Li, Xue-Mei","<i>N</i>,<i>N</i>'-Bis(<i>p</i>-methoxyphenyl)-2,2'-(<i>p</i>-phenylenedioxy)diacetamide","Acta Crystallographica Section E","2005","61","1","o96","o97","10.1107/S1600536804032180","","","0.71073","MoKα","","0.0883","0.0676","","","0.1698","0.1849","","","","","","1.043","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204858","5.2957","0.0003","16.2732","0.0009","13.9411","0.0008","90","","93.2","0.001","90","","1199.54","0.12","150","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,4-Bis(benzimidazol-1-ylmethyl)-2,3,5,6-tetramethylbenzene methanol disolvate","","- C28 H34 N4 O2 -","- C28 H34 N4 O2 -","- C56 H68 N8 O4 -","2","0.5","CI6495","Ai-Miao Qin; Xiang-Dong Pi; Cheng-Yong Su","1,4-Bis(benzimidazol-1-ylmethyl)-2,3,5,6-tetramethylbenzene methanol disolvate","Acta Crystallographica Section E","2005","61","1","o137","o138","10.1107/S1600536804032684","","","0.71073","MoKα","","","0.0405","","","","0.1034","","","","","","1.079","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204859","14.271","0.0006","14.9228","0.0006","29.8597","0.0012","90","","90","","90","","6359","0.4","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","1,4,10,16,21-Pentaaza-7,13,24-triazoniabicyclo[8.8.8]hexacosane monohydrate clathrate trichloride hexahydrate","","- C18 H59 Cl3 N8 O7 -","- C18 H59 Cl3 N8 O7 -","- C144 H472 Cl24 N64 O56 -","8","1","CI6496","Farrell, David; McKee, Vickie; Nelson, Jane","1,4,10,16,21-Pentaaza-7,13,24-triazoniabicyclo[8.8.8]hexacosane monohydrate clathrate trichloride hexahydrate","Acta Crystallographica Section E","2005","61","1","o81","o83","10.1107/S1600536804032088","","","0.71073","MoKα","","0.0554","0.0376","","","0.0897","0.1023","","","","","","1.034","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204860","12.872","0.002","9.282","0.003","24.761","0.007","90","","90","","90","","2958.4","1.4","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4-(5-Methyl-3-phenylisoxazol-4-yl)benzenesulfonamide","","- C16 H14 N2 O3 S -","- C16 H14 N2 O3 S -","- C128 H112 N16 O24 S8 -","8","1","CI6497","S. M. Malathy Sony; P. Charles; M. N. Ponnuswamy; H. S. Yathirajan","Valdecoxib, a non-steroidal anti-inflammatory drug","Acta Crystallographica Section E","2005","61","1","o108","o110","10.1107/S1600536804032118","","","0.71073","MoKα","","0.1534","0.0554","","","0.1378","0.1788","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204861","8.493","0.003","9.446","0.003","12.144","0.004","91.367","0.005","109.463","0.007","100.148","0.005","900.6","0.5","193","2","193","2","","","","","","","","3","P -1","-P 1","2","","6-Amino-4-[4-(dimethylamino)phenyl]-3-methyl-1-phenylpyrazolo[3,4-b]pyridine- 5-carbonitrile","","- C22 H20 N6 -","- C22 H20 N6 -","- C44 H40 N12 -","2","1","CI6499","Zhu, Song-Lei; Tu, Shu-Jiang; Zou, Xiang; Li, Tuan-Jie","6-Amino-4-[4-(dimethylamino)phenyl]-3-methyl-1-phenylpyrazolo[3,4-<i>b</i>]pyridine-5-carbonitrile","Acta Crystallographica Section E","2005","61","1","o29","o30","10.1107/S1600536804031642","","","0.7107","MoKα","","0.0495","0.0414","","","0.0983","0.1031","","","","","","1.074","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204862","6.833","0.0006","10.3313","0.001","16.1635","0.0015","90","","94.486","0.002","90","","1137.55","0.18","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2-Pivaloyl-2-amino-6-hydroxymethylpyridine","N-[6-(Hydroxymethyl)pyridin-2-yl]-2,2-dimethylpropanamide","","- C11 H16 N2 O2 -","- C11 H16 N2 O2 -","- C44 H64 N8 O8 -","4","1","CI6500","Shyamaprosad Goswami; Swapan Dey; Suchada Chantrapromma; Hoong-Kun Fun","<i>N</i>-[6-(Hydroxymethyl)pyridin-2-yl]-2,2-dimethylpropanamide","Acta Crystallographica Section E","2005","61","1","o105","o107","10.1107/S1600536804032398","","","0.71073","MoKα","","0.0727","0.0528","","","0.131","0.1461","","","","","","1.083","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204863","10.98","0.004","12.499","0.004","12.865","0.004","90","","90","","90","","1765.6","1","123.1","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C23 H28 O2 -","- C23 H28 O2 -","- C92 H112 O8 -","4","1","CI6502","Masataka Watanabe; Taisuke Matsumoto; Shuntaro Mataka; Thies Thiemann","3-Methoxy-19-norpentara-1,3,5(10),17(20)-tetraen-21-one","Acta Crystallographica Section E","2005","61","1","o169","o171","10.1107/S160053680403363X","","","0.7107","MoKα","","","0.034","","","","0.073","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204864","6.8829","0.0014","23.589","0.005","7.7372","0.0015","90","","95.66","0.03","90","","1250.1","0.4","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-(Hydroxyimino)butan-2-one (4-methoxybenzoyl)hydrazone","","- C12 H15 N3 O3 -","- C12 H15 N3 O3 -","- C48 H60 N12 O12 -","4","1","CI6504","Shan Gao; Zhao-Peng Deng; Li-Hua Huo; Hui Zhao","3-(Hydroxyimino)butan-2-one 4-methoxybenzoylhydrazone","Acta Crystallographica Section E","2005","61","1","o124","o126","10.1107/S1600536804032672","","","0.71073","MoKα","","0.059","0.0428","","","0.124","0.1334","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204865","9.4212","0.0006","12.8792","0.0009","10.0568","0.0007","90","","105.609","0.001","90","","1175.26","0.14","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","trans-2,2-Dimethyl-6-phenyltetrahydropyran-3-ol","trans-2,2-Dimethyl-6-phenyl-3,4,5,6-tetrahydro-2H-pyran-3-ol","","- C13 H18 O2 -","- C13 H18 O2 -","- C52 H72 O8 -","4","1","CV6413","Hartung, Jens; Svoboda, Ingrid; Schmidt, Philipp; Murso, Alexander","<i>trans</i>-2,2-Dimethyl-6-phenyl-3,4,5,6-tetrahydro-2<i>H</i>-pyran-3-ol","Acta Crystallographica Section E","2005","61","1","o33","o34","10.1107/S1600536804031551","","","0.71073","MoKα","","0.0714","0.0685","","","0.1389","0.1404","","","","","","1.281","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204866","14.001","0.0002","7.0811","0.0001","15.6584","0.0003","90","","106.213","0.001","90","","1490.67","0.04","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4,4',5,5'-Tetrakis(methylsulfanyl)tetrathiafulvalene","","- C10 H12 S8 -","- C10 H12 S8 -","- C40 H48 S32 -","4","1","CV6415","Lei Wang; Jing-Ping Zhang; Bin Zhang","4,4',5,5'-Tetrakis(methylsulfanyl)tetrathiafulvalene","Acta Crystallographica Section E","2005","61","1","o65","o66","10.1107/S1600536804031769","","","0.71073","MoKα","","0.0541","0.0309","","","0.0739","0.0793","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204867","13.8829","0.0009","7.2027","0.0005","15.4632","0.001","90","","92.142","0.002","90","","1545.15","0.18","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","1-Chloro-2,2-dimethyl-1,3-diphenylpent-4-ene","1-Chloro-2,2-dimethyl-1,3-diphenylpent-4-ene","","- C19 H21 Cl -","- C19 H21 Cl -","- C76 H84 Cl4 -","4","1","CV6418","Hartung, Jens; Špehar, Kristina; Murso, Alexander; Svoboda, Ingrid","1-Chloro-2,2-dimethyl-1,3-diphenylpent-4-ene","Acta Crystallographica Section E","2005","61","1","o147","o148","10.1107/S1600536804032386","","","0.71073","MoKα","","0.07","0.0554","","","0.1071","0.1129","","","","","","1.131","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204868","13.269","0.002","16.085","0.002","5.7278","0.0004","90","","90","","90","","1222.5","0.3","173","2","173","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","cis-3-bromo-2,2-dimethyl-5-phenyltetrahydropyran","cis-(3R,5R)-3-Bromo-2,2-dimethyl-5-phenyltetrahydropyran","","- C13 H17 Br O -","- C13 H17 Br O -","- C52 H68 Br4 O4 -","4","1","CV6419","Hartung, Jens; Svoboda, Ingrid; Schmidt, Philipp; Pfeiffer, Matthias","<i>cis</i>-(3<i>R</i>,5<i>R</i>)-3-Bromo-2,2-dimethyl-5-phenyltetrahydropyran","Acta Crystallographica Section E","2005","61","1","o15","o16","10.1107/S1600536804030995","","","0.71073","MoKα","","0.0434","0.0308","","","0.0684","0.0726","","","","","","1.068","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204869","8.8112","0.0009","14.1852","0.0014","9.1367","0.0009","90","","111.867","0.001","90","","1059.82","0.18","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","dichloro (furaldehyde)phenylenediamine copper(II)","Dichloro[2-(2-furyl)-1H-benzimidazole-κN^3^]copper(II)","","- C22 H16 Cl2 Cu N4 O2 -","- C22 H16 Cl2 Cu N4 O2 -","- C44 H32 Cl4 Cu2 N8 O4 -","2","0.5","CV6420","Du, Gui-Xiang; Li, Jun; Zhang, Feng-Xing","Dichloro[2-(2-furyl)-1<i>H</i>-benzimidazole-κ<i>N</i>^3^]copper(II)","Acta Crystallographica Section E","2005","61","1","m119","m120","10.1107/S1600536804031009","","","0.71073","MoKα","","0.0263","0.0235","","","0.0675","0.0685","","","","","","1.109","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204870","9.4088","0.0006","10.2617","0.0008","12.6689","0.0008","90","","90","","90","","1223.19","0.15","193","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1S,2R,4R,5R)-tert-Butyl N-(4-hydroxymethyl-6-oxabicyclo[3.1.0]hex-2-yl)carbamate","","- C11 H19 N O4 -","- C11 H19 N O4 -","- C44 H76 N4 O16 -","4","1","CV6423","von Meltzer, Martin; Marsch, Michael; Carell, Thomas; Harms, Klaus","(1<i>S</i>,2<i>R</i>,4<i>R</i>,5<i>R</i>)-<i>tert</i>-Butyl <i>N</i>-(4-hydroxymethyl-6-oxabicyclo[3.1.0]hex-2-yl)carbamate","Acta Crystallographica Section E","2005","61","1","o23","o24","10.1107/S1600536804031563","","","0.71073","MoKα","","","0.0319","","","","0.0867","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204871","6.3","0.002","7.737","0.002","10.386","0.003","90","","106.712","0.004","90","","484.9","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,2-Bis(1,3-dithiolan-2-ylidene)hydrazine","","- C6 H8 N2 S4 -","- C6 H8 N2 S4 -","- C12 H16 N4 S8 -","2","0.5","CV6424","Liang-zhong Xu; Hai-Zhen Xu; Shuang-Hua Yang; Chun-Li Li; Kai Zhou","1,2-Bis(1,3-dithiolan-2-ylidene)hydrazine","Acta Crystallographica Section E","2005","61","1","o31","o32","10.1107/S1600536804031575","","","0.71073","MoKα","","0.0548","0.0456","","","0.1202","0.1304","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204872","9.5514","0.0004","18.0919","0.0008","35.497","0.002","90","","95.17","0.001","90","","6109","0.5","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","μ-Phthalato-bis[tris(2-methyl-2-phenylpropyl)tin(IV)]","","- C68 H82 O4 Sn2 -","- C68 H82 O4 Sn2 -","- C272 H328 O16 Sn8 -","4","1","CV6425","Tian, Lai-Jin; Sun, Yu-Xi; Yang, Min; Ng, Seik Weng","μ-Phthalato-bis[tris(2-methyl-2-phenylpropyl)tin(IV)]","Acta Crystallographica Section E","2005","61","1","m74","m75","10.1107/S1600536804031952","","","0.71073","MoKα","","0.0866","0.055","","","0.1042","0.1153","","","","","","1.025","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204873","7.015","0.004","7.759","0.004","18.638","0.009","89.456","0.009","84.369","0.009","68.346","0.008","937.9","0.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-Hydroxy-3-methoxybenzaldehyde 2,4-dinitropheylhydrazone dimethylformamide solvate","","- C17 H19 N5 O7 -","- C17 H19 N5 O7 -","- C34 H38 N10 O14 -","2","1","CV6426","Jing, Zuo-Liang; Yu, Ming; Chen, Xin; Diao, Chun-Hua; Deng, Qi-Liang; Fan, Zhi","2-Hydroxy-3-methoxybenzaldehyde 2,4-dinitrophenylhydrazone dimethylformamide solvate","Acta Crystallographica Section E","2005","61","1","o145","o146","10.1107/S1600536804032878","","","0.71073","MoKα","","0.1233","0.0555","","","0.1253","0.165","","","","","","1.032","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204874","11.5299","0.0005","12.9081","0.0005","17.4774","0.0009","90","","94.538","0.004","90","","2593","0.2","153","2","153","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[1,3-Bis(2-pyridylimino)isoindolinato-κ^3^N,N',N'']chloro(1,2-dicyanobenzene- κN)(dimethyl sulfoxide-κS)ruthenium(II)","","- C28 H22 Cl N7 O Ru S -","- C28 H22 Cl N7 O Ru S -","- C112 H88 Cl4 N28 O4 Ru4 S4 -","4","1","CV6427","Tamil Selvi Pitchumony; Helen Stoeckli-Evans","[1,3-Bis(2-pyridylimino)isoindolinato-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']chloro(1,2-dicyanobenzene-κ<i>N</i>)(dimethyl sulfoxide-κ<i>S</i>)ruthenium(II)","Acta Crystallographica Section E","2005","61","1","m69","m71","10.1107/S1600536804031812","","","0.71073","MoKα","","0.0485","0.0406","","","0.0888","0.0942","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204875","21.731","0.002","8.1038","0.0007","15.1428","0.0016","90","","121.595","0.002","90","","2271.4","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(2,2'-Bipyridine)bis(hydrogen isophthalato)zinc(II)","","- C26 H18 N2 O8 Zn -","- C26 H18 N2 O8 Zn -","- C104 H72 N8 O32 Zn4 -","4","0.5","CV6428","You-Fu Zhou; Wan-Juan Lin; Yong-Gui Huang; Mao-Chun Hong","(2,2'-Bipyridine)bis(hydrogen isophthalato)zinc(II)","Acta Crystallographica Section E","2005","61","1","m177","m179","10.1107/S1600536804033318","","","0.71073","MoKα","","","0.0814","","","0.1424","0.1686","","","","","","1.281","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204876","9.238","0.008","11.112","0.011","12.164","0.012","93.904","0.014","100.206","0.013","104.154","0.015","1183.5","1.9","163","2","163","2","","","","","","","","5","P -1","-P 1","2","","N-(4-ferrocenylphenyl)-4-piperidino-1,8-naphthalimide","","- C33 H28 Fe N2 O2 -","- C33 H28 Fe N2 O2 -","- C66 H56 Fe2 N4 O4 -","2","1","CV6430","McAdam, C. John; Robinson, Brian H.; Simpson, Jim","<i>N</i>-(4-Ferrocenylphenyl)-4-piperidino-1,8-naphthalimide","Acta Crystallographica Section E","2005","61","1","m110","m112","10.1107/S1600536804032271","","","0.71073","MoKα","","0.0956","0.045","","","0.0806","0.0905","","","","","","0.89","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204877","8.1984","0.0004","9.7549","0.0005","11.8636","0.0006","70.971","0.001","75.508","0.001","72.077","0.001","841.48","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","di-μ-adipato-κ^6^O,O':O'';O:O',O''-bis[aqua(1,10-phenanthroline- κ^2^N,N')zinc(II)]","","- C36 H36 N4 O10 Zn2 -","- C36 H36 N4 O10 Zn2 -","- C36 H36 N4 O10 Zn2 -","1","0.5","CV6431","Ding, Cai-Feng; Zhang, Shu-Sheng; Zhu, Mei; Li, Xue-Mei; Xu, Hong; Ouyang, Ping-Kai","Di-μ-adipato-κ^6^<i>O</i>,<i>O</i>':<i>O</i>'';<i>O</i>:<i>O</i>',<i>O</i>''-bis[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>)zinc(II)]","Acta Crystallographica Section E","2005","61","1","m147","m148","10.1107/S160053680403288X","","","0.71073","MoKα","","0.025","0.0239","","","0.0646","0.0653","","","","","","1.084","","","","has coordinates,has Fobs","197922","2020-10-21","18:00:00",""
"2204878","12.535","0.003","7.856","0.002","16.253","0.003","90","","90","","90","","1600.5","0.6","293","2","293","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","5-(N,N-Diethylamino)-4,6-diphenyl-1,2,3-triazine","","- C19 H20 N4 -","- C19 H20 N4 -","- C76 H80 N16 -","4","1","DN6169","Rozycka-Sokolowska, Ewa; Girek, Tomasz; Marciniak, Bernard; Pavlyuk, Volodymyr; Drabowicz, Jozef; Matsumoto, Kyoshi","5-(<i>N</i>,<i>N</i>-Diethylamino)-4,6-diphenyl-1,2,3-triazine","Acta Crystallographica Section E","2005","61","1","o93","o95","10.1107/S1600536804032003","","","0.71069","MoKα","","0.0435","0.0346","","","0.0861","0.0875","","","","","","1.057","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204879","13.908","0.0008","13.8441","0.0008","14.4835","0.0009","90","","93.173","0.003","90","","2784.4","0.3","130","","130","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(2,2'-bipyridine)[1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(piperazin-4-ium- 1-yl)quinoline-3-carboxylato]nitratocopper(II) nitrate dihydrate","","- C26 H30 Cu F N7 O11 -","- C26 H30 Cu F N7 O11 -","- C104 H120 Cu4 F4 N28 O44 -","4","1","DN6179","Yong-Qin Wei; Zhang-Feng Zhou; Bo-Tao Zhuang; Ke-Chen Wu; Cai-Ping Liu; Ming-Xi Zhang","The mixed-ligand copper(II) complex (2,2'-bipyridine)[1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(piperazin-4-ium-1-yl)quinoline-3-carboxylato]nitratocopper(II) nitrate dihydrate","Acta Crystallographica Section E","2005","61","1","m66","m68","10.1107/S1600536804031861","","","0.71073","MoKα","","0.038","0.034","","","0.0782","0.0805","","","","","","1.087","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204880","27.158","0.002","9.0145","0.0007","18.1825","0.0015","90","","111.918","0.002","90","","4129.6","0.6","133","2","133","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","catena-poly[[μ-cyano-1:2C:N-[1,3-bis(tetramethylguanidino)propane- 1κ^2^N,N']dicopper(II)]-μ-cyano-2:1'C:N]","","- C15 H30 Cu2 N8 -","- C15 H30 Cu2 N8 -","- C120 H240 Cu16 N64 -","8","1","DN6182","Herres-Pawlis, Sonja; Flörke, Ulrich; Henkel, Gerald","<i>catena</i>-Poly[[μ-cyano-[1,3-bis(tetramethylguanidino)propane]dicopper(I)]-μ-cyano]","Acta Crystallographica Section E","2005","61","1","m79","m81","10.1107/S160053680403199X","","","0.71073","MoKα","","0.0711","0.0391","","","0.0706","0.0778","","","","","","0.844","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204881","12.452","0.002","12.619","0.002","12.654","0.002","90","","96.002","0.001","90","","1977.4","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Poly[silver(I)-μ~2~-2-methylpyrazine-μ~2~-trifluoroacetato], a re-investigation","","- C7 H6 Ag F3 N2 O2 -","- C7 H6 Ag F3 N2 O2 -","- C56 H48 Ag8 F24 N16 O16 -","8","2","DN6183","Zhu, Guang-Jun; You, Zhong-Lu; Zhu, Hai-Liang","Poly[silver(I)-μ~2~-2-methylpyrazine-μ~2~-trifluoroacetato], a reinvestigation","Acta Crystallographica Section E","2005","61","1","m87","m88","10.1107/S160053680403209X","","","0.71073","MoKα","","0.0559","0.0397","","","0.0888","0.0959","","","","","","1.014","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2204882","11.298","0.003","11.841","0.002","12.776","0.003","108.28","0.02","112.84","0.02","98.71","0.02","1420.9","0.7","293","","293","","","","","","","","","5","P -1","-P 1","2","1-Chloro-4-propoxythioxanthone","1-Chloro-4-propoxy-10-thiaanthracen-9-one","","- C16 H13 Cl O2 S -","- C16 H13 Cl O2 S -","- C64 H52 Cl4 O8 S4 -","4","2","DN6184","Xuan-Gan Liu; Wei-Xiao Hu; Guo-Wu Rao","1-Chloro-4-propoxythioxanthone","Acta Crystallographica Section E","2005","61","1","o149","o150","10.1107/S1600536804031770","","","0.71073","MoKα","","0.0837","0.0419","","","0.1087","0.1281","","","","","","1.014","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2204883","10.811","0.002","5.4155","0.0005","20.21","0.005","90","","98.871","0.001","90","","1169.1","0.4","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","5,5-Dimethyl-2-oxo-tetrahydrofuran-3-yl benzoate","2,2-Dimethyl-5-oxo-2,3,4,5-tetrahydrofuran-3-yl benzoate","","- C13 H14 O4 -","- C13 H14 O4 -","- C52 H56 O16 -","4","1","FL6132","Hartung, Jens; Svoboda, Ingrid; Schmidt, Philipp; Pfeiffer, Matthias","2,2-Dimethyl-5-oxo-2,3,4,5-tetrahydrofuran-3-yl benzoate","Acta Crystallographica Section E","2005","61","1","o35","o36","10.1107/S1600536804031587","","","0.71073","MoKα","","0.0566","0.0391","","","0.0877","0.0953","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204884","16.029","0.011","12.985","0.009","21.106","0.014","90","","103.768","0.012","90","","4267","5","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","μ-4,4'-Di-4-pyridyldiazene-κ^2^N:N'- bis{[1,1,1-tris(diphenylphosphinomethyl)ethane-κP^3^]copper(I)} bis(tetrafluoroboride) dichloromethane solvate","","- C93 H88 B2 Cl2 Cu2 F8 N4 P6 -","- C93 H86 B2 Cl2 Cu2 F8 N4 P6 -","- C186 H172 B4 Cl4 Cu4 F16 N8 P12 -","2","0.5","FL6133","Yu, Mingming; Li, Zhanxian; Fu, Wenfu; Zhang, Junfeng","μ-4,4'-Di-4-pyridyldiazene-κ^2^<i>N</i>:<i>N</i>'-bis{[1,1,1-tris(diphenylphosphinomethyl)ethane-κ<i>P</i>^3^]copper(I)} bis(tetrafluoroborate) dichloromethane solvate","Acta Crystallographica Section E","2005","61","1","m98","m100","10.1107/S1600536804031903","","","0.71073","MoKα","","0.0933","0.0483","","","0.1227","0.1457","","","","","","1.049","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204885","9.3546","0.0002","10.7074","0.0002","19.9204","0.0005","90","","90","","90","","1995.3","0.08","160","2","160","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","17-allyl-16,17a-dioxo-17-aza-D-homoestra-1,3,5(10)-trien-3-yl acetate","","- C23 H27 N O4 -","- C23 H27 N O4 -","- C92 H108 N4 O16 -","4","1","FL6136","Hema, R.; Parthasarathi, V.; Ranju Bansal; Linden, Anthony","17-Allyl-16,17a-dioxo-17-aza-<small>D</small>-homoestra-1,3,5(10)-trien-3-yl acetate","Acta Crystallographica Section E","2005","61","1","o160","o162","10.1107/S1600536804033173","","","0.71073","MoKα","","0.0662","0.0467","","","0.1138","0.1279","","","","","","1.063","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204886","5.8718","0.0019","10.202","0.003","10.629","0.003","97.621","0.006","101.621","0.006","93.951","0.006","615.2","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","N,N,N',N'-tetrabenzylethylenediamine","","- C30 H32 N2 -","- C30 H32 N2 -","- C30 H32 N2 -","1","0.5","GH6008","Zhaohui Pan; Mingjie Zhang; Dongyan Yuan; Penggao Ma","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetrabenzylethylenediamine","Acta Crystallographica Section E","2005","61","1","o185","o186","10.1107/S1600536804033215","","","0.71073","MoKα","","0.0882","0.0453","","","0.1357","0.1807","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204887","8.566","0.006","8.807","0.007","18.729","0.017","90","","101.37","","90","","1385.2","1.9","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","catena-Poly[[(dihydrogenphosphato)silver(I)]-μ-4,4'-bipyridine] dihydrate]","","- C10 H14 Ag N2 O6 P -","- C10 H14 Ag N2 O6 P -","- C40 H56 Ag4 N8 O24 P4 -","4","1","HB6097","Wang, Li-Shi; Yang, Shi-Ping; Zhang, Jin-Feng","<i>catena</i>-Poly[[[(dihydrogenphosphato)silver(I)]-μ-4,4'-bipyridine] dihydrate]","Acta Crystallographica Section E","2005","61","1","m25","m26","10.1107/S1600536804031435","","","0.71073","MoKα","","0.1483","0.0908","","","0.2475","0.3281","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204888","8.0952","0.0005","13.957","0.0008","14.1416","0.0008","93.925","0.001","91.488","0.001","103.777","0.001","1546.7","0.16","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[[(4'-phenyl-2,2':6',2''-terpyridine-κ^3^N)copper(II)]- μ-terephthalato-κ^2^O:O'] terephthalic acid]","","- C37 H25 Cu N3 O8 -","- C37 H25 Cu N3 O8 -","- C74 H50 Cu2 N6 O16 -","2","1","HB6119","Tu, Qi-Dong; Yin, Ye-Gao; Li, Dan; Huang, Xiao-Chun; Ng, Seik Weng","<i>catena</i>-Poly[[[(4'-phenyl-2,2':6',2''-terpyridine-κ^3^<i>N</i>)copper(II)]-μ-terephthalato-κ^2^<i>O</i>:<i>O</i>'] terephthalic acid]","Acta Crystallographica Section E","2005","61","1","m103","m105","10.1107/S1600536804031940","","","0.71073","MoKα","","0.054","0.043","","","0.113","0.127","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204889","5.7221","0.0004","10.3906","0.0008","10.4865","0.0008","117.442","0.001","101.677","0.0008","92.951","0.001","534.31","0.07","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(2-amino-4,6-dimethylpyrimidine)(cadmium(II)thiocyante)","catena-Poly[[[diaquacadmium(II)]-di-μ-thiocyanato] bis(2-amino-4,6-dimethylpyrimidine)]","","- C14 H22 Cd N8 O2 S2 -","- C14 H22 Cd N8 O2 S2 -","- C14 H22 Cd N8 O2 S2 -","1","0.5","HB6125","Packianathan Thomas Muthiah; Madhukar Hemamalini; Ray J. Butcher","<i>catena</i>-Poly[[[diaquacadmium(II)]-di-μ-thiocyanato] bis(2-amino-4,6-dimethylpyrimidine)]","Acta Crystallographica Section E","2005","61","1","m63","m65","10.1107/S1600536804031721","","","0.71073","MoKα","","0.0342","0.0326","","","0.0853","0.0863","","","","","","1.061","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204890","14.3214","0.0014","24.855","0.002","29.709","0.003","90","","90","","90","","10575.2","1.7","180","2","180","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Dipotassium hexakis({2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato}nickel(II)) tetracyanonickel(II) methanol hexasolvate dihydrate","","- C106 H112 K2 N16 Ni7 O20 -","- C106 H112 K2 N16 Ni7 O20 -","- C424 H448 K8 N64 Ni28 O80 -","4","0.5","HB6126","Skovgaard, Signe; Bond, Andrew D.; McKenzie, Christine J.","Dipotassium hexakis({2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato}nickel(II)) tetracyanonickelate(II) methanol hexasolvate dihydrate","Acta Crystallographica Section E","2005","61","1","m135","m137","10.1107/S160053680403154X","","","0.7107","MoKα","","0.1476","0.0547","","","0.1138","0.1451","","","","","","0.999","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204891","9.2704","0.0019","11.161","0.002","11.456","0.002","108.72","0.03","106.56","0.03","90.39","0.03","1069.7","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[bis[[tetraaquacobalt(II)]-μ-4,4'-bipyridine-κ^2^N:N']] bis(3-carboxylatophenoxyacetate) dihydrate]","","- C38 H48 Co2 N4 O20 -","- C38 H48 Co2 N4 O20 -","- C38 H48 Co2 N4 O20 -","1","0.5","HB6127","Zhao, Jing-Gui; Gu, Chang-Sheng; Gao, Shan; Huo, Li-Hua; Liu, Ji-Wei","<i>catena</i>-Poly[[[tetraaquacobalt(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] 3-carboxylatophenoxyacetate monohydrate]","Acta Crystallographica Section E","2005","61","1","m33","m35","10.1107/S1600536804031447","","","0.71073","MoKα","","0.0827","0.0453","","","0.0914","0.1014","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204892","11.462","0.004","12.478","0.004","13.23","0.005","95.491","0.006","115.07","0.005","110.291","0.005","1540.6","0.9","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","μ-oxo-bis({2,2-[propane-1,2-diylbis(nitrilomethylidyne)]diphenolato}iron(III))","","- C34 H32 Fe2 N4 O5 -","- C34 H32 Fe2 N4 O5 -","- C68 H64 Fe4 N8 O10 -","2","1","HB6129","You, Zhong-Lu; Tang, Lu-Lu; Zhu, Hai-Liang","A dinuclear oxygen-bridged Schiff base iron(III) complex derived from <i>N</i>,<i>N</i>'-bis(2-hydroxybenzylidene)-1,2-diaminopropane","Acta Crystallographica Section E","2005","61","1","m36","m38","10.1107/S1600536804031368","","","0.71073","MoKα","","0.1124","0.0555","","","0.1315","0.1607","","","","","","0.906","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204893","17.416","0.005","7.624","0.005","17.667","0.005","90","","90","","90","","2345.8","1.8","100","","100","","","","","","","","","6","P c a 21","P 2c -2ac","29","","Dichlorobis[1-(2-ethoxyethyl)-1H-benzimidazole-κN^3^]nickel(II)","","- C22 H28 Cl2 N4 Ni O2 -","- C22 H28 Cl2 N4 Ni O2 -","- C88 H112 Cl8 N16 Ni4 O8 -","4","1","HB6130","Mehmet Akkurt; Selvi Karaca; Hasan Küçükbay; Ersin Orhan; Orhan Büyükgüngör","Dichlorobis[1-(2-ethoxyethyl)-1<i>H</i>-benzimidazole-κ<i>N</i>^3^]nickel(II)","Acta Crystallographica Section E","2005","61","1","m41","m43","10.1107/S1600536804031356","","","0.71073","MoKα","","0.0279","0.0267","","","0.0686","0.0691","","","","","","1.067","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204894","14.509","0.005","6.9285","0.0019","12.806","0.003","90","","95.62","0.04","90","","1281.1","0.6","293","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tricarbonyl(η^5^-cyclopentadienyl)(3-iodopropyl)tungsten(II)","","- C11 H11 I O3 W -","- C11 H11 I O3 W -","- C44 H44 I4 O12 W4 -","4","1","HB6131","Holger B. Friedrich; Martin O. Onani; Melanie Rademeyer","Tricarbonyl(η^5^-cyclopentadienyl)(3-iodopropyl)tungsten(II)","Acta Crystallographica Section E","2005","61","1","m144","m146","10.1107/S1600536804032362","","","0.71073","MoKα","","0.0387","0.0318","","","0.0758","0.0784","","","","","","1.005","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204895","23.5075","0.0013","13.9199","0.001","11.531","0.008","90","","90","","90","","3773","3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-(2,6-Dichlorobenzylamino)-3,5-diphenyl-4H-1,2,4-triazole","","- C21 H16 Cl2 N4 -","- C21 H16 Cl2 N4 -","- C168 H128 Cl16 N32 -","8","1","HG6107","Atalay, Şehriman; Yavuz, Metin; Bekircan, Olcay; Alpay Karaoǧlu, Şengül; Şahinbaş, Esra; Şaşmaz, Selami","4-(2,6-Dichlorobenzylamino)-3,5-diphenyl-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2005","61","1","o90","o92","10.1107/S1600536804032179","","","0.71073","MoKα","","0.0912","0.0356","","","0.0688","0.0791","","","","","","0.752","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204896","8.335","0.003","10.034","0.003","20.017","0.006","90","","91.81","0.006","90","","1673.3","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[5,6:14,15-Dibenzo-1,4,8,12-tetraazacyclopentadeca-7,13-diene- 2,3-dione(2-)]nickel(II) monohydrate","","- C19 H18 N4 Ni O3 -","- C19 H18 N4 Ni O3 -","- C76 H72 N16 Ni4 O12 -","4","1","HG6112","Xiu-Li Wang; Ya-Qiu Sun","[5,6:14,15-Dibenzo-1,4,8,12-tetraazacyclopentadeca-7,13-diene-2,3-dione(2‒)]nickel(II) monohydrate","Acta Crystallographica Section E","2005","61","1","m171","m173","10.1107/S1600536804032969","","","0.71073","MoKα","","0.0436","0.03","","","0.0649","0.0697","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204897","8.595","0.002","8.868","0.002","11.628","0.003","77.197","0.004","79.27","0.004","73.478","0.004","821.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","5,6-Dimethoxy-1-(toluene-4-sulfonyl)benzo[c]isoxazol-3(1H)-one","","- C16 H15 N O6 S -","- C16 H15 N O6 S -","- C32 H30 N2 O12 S2 -","2","1","HG6116","Shang, Zhenhua; Zhao, Kang","5,6-Dimethoxy-1-(4-tolylsulfonyl)benzo[<i>c</i>]isoxazol-3(1<i>H</i>)-one","Acta Crystallographica Section E","2005","61","1","o132","o133","10.1107/S160053680403260X","","","0.71073","MoKα","","0.0699","0.0414","","","","0.1263","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204898","14.1386","0.0002","9.9659","0.0001","18.2523","0.0003","90","","90.2765","0.0005","90","","2571.79","0.06","123","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-(4-Chlorobenzoylamino)-4-(8-chloro-5H-dibenzo[b,e][1,4]diazepin-11-yl)- 1-methylhexahydropyrazin-1-ium dichloromethane solvate","","- C26 H25 Cl4 N5 O -","- C26 H25 Cl4 N5 O -","- C104 H100 Cl16 N20 O4 -","4","1","HG6118","Capuano, Ben; Crosby, Ian T.; Egan, Simon J.; Fallon, Gary D.; Lloyd, Edward J.; Neve, Juliette E.","4-Chloro-<i>N</i>-[4-(8-chloro-5<i>H</i>-dibenzo[<i>b</i>,<i>e</i>][1,4]diazepin-11-yl)-1-methylpiperazinio]benzamidate dichloromethane solvate","Acta Crystallographica Section E","2005","61","1","o20","o22","10.1107/S1600536804031095","","","0.71073","MoKα","","","0.0533","","","","0.1111","","","","","","1.022","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204899","10.0407","0.0016","17.007","0.003","30.197","0.005","90","","90","","90","","5156.5","1.5","273","2","273","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4,4,6-Trimethyl-1-phenyl-3,4-dihydropyrimidine-2(1H)-thione","","- C13 H16 N2 S -","- C13 H16 N2 S -","- C208 H256 N32 S16 -","16","2","IS6010","Yamin, Bohari M.; Kasim, Noor Azilah M.; Hamzah, Noraini","4,4,6-Trimethyl-1-phenyl-3,4-dihydropyrimidine-2(1<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","1","o55","o57","10.1107/S1600536804031320","","","0.71073","MoKα","","0.0641","0.0581","","","0.1598","0.1638","","","","","","1.131","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2204900","6.8297","0.0001","12.097","0.0002","27.8762","0.0004","90","","90","","90","","2303.1","0.06","83","2","83","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1S,2S)-1-{2-[(4-methoxybenzyl)oxy]ethyl}-2-methyl-3-butenyl (1S,4R)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate","","- C25 H34 O6 -","- C25 H34 O6 -","- C100 H136 O24 -","4","1","IS6013","Kai T. Meilert; George R. Clark; Tania Groutso; Margaret A. Brimble","(1<i>S</i>,2<i>S</i>)-1-{2-[(4-Methoxybenzyl)oxy]ethyl}-2-methyl-3-butenyl (1<i>S</i>,4<i>R</i>)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate","Acta Crystallographica Section E","2005","61","1","o6","o7","10.1107/S1600536804030946","","","0.71073","MoKα","","0.0535","0.0412","","","0.0862","0.0918","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204901","22.565","0.007","9.393","0.003","21.052","0.007","90","","115.682","0.008","90","","4021","2","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","16β-Bromo-17α-hydroxypregn-4-ene-3,20-dione","","- C21 H29 Br O3 -","- C21 H29 Br O3 -","- C168 H232 Br8 O24 -","8","2","IS6018","Shi Wang; Yongli Wang; Qiang Nie; Aishuang Xiang; Lina Zhou","16β-Bromo-17α-hydroxypregn-4-ene-3,20-dione","Acta Crystallographica Section E","2005","61","1","o1","o2","10.1107/S1600536804031083","","","0.71073","MoKα","","0.0954","0.0426","","","0.0778","0.0933","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204902","10.4974","0.0008","20.3856","0.0013","13.2263","0.001","90","","95.332","0.002","90","","2818.1","0.4","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[4-trimethylammonio)phenyl] disulfide tetraiodomercurate(II)","","- C18 H26 Hg I4 N2 S2 -","- C18 H26 Hg I4 N2 S2 -","- C72 H104 Hg4 I16 N8 S8 -","4","1","IS6020","Chen, Jin-Xiang; Zhang, Wen-Hua; Ren, Zhi-Gang; Zhang, Yong; Lang, Jian-Ping","Bis[4-(trimethylammonio)phenyl] disulfide tetraiodomercurate(II)","Acta Crystallographica Section E","2005","61","1","m60","m62","10.1107/S1600536804031630","","","0.7107","MoKα","","0.0481","0.0405","","","0.0963","0.1008","","","","","","1.074","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204903","18.4522","0.0009","11.5264","0.0006","11.4079","0.0006","90","","90","","90","","2426.3","0.2","295","2","295","2","","","","","","","","5","P n n a","-P 2a 2bc","52","Tetra-n-butylammonium tetrachloro-iron","Tetrabutylammonium tetrachloroferrate(III)","","- C16 H36 Cl4 Fe N -","- C16 H36 Cl4 Fe N -","- C64 H144 Cl16 Fe4 N4 -","4","0.5","IS6021","Hay, Michael T.; Geib, Steven J.","Tetrabutylammonium tetrachloroferrate(III)","Acta Crystallographica Section E","2005","61","1","m190","m191","10.1107/S1600536804031824","","","0.71073","MoKα","","0.0804","0.0526","","","0.1623","0.1731","","","","","","1.331","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204904","10.281","0.003","10.672","0.004","12.945","0.005","79.209","0.015","67.071","0.012","63.502","0.013","1170.5","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","catena-Poly[[bis(O,O'-dimethyl dithiophosphato-κ^2^S,S')cadmium(II)]-μ-4,4'-bipyridine-N:N']","","- C14 H20 Cd N2 O4 P2 S4 -","- C14 H20 Cd N2 O4 P2 S4 -","- C28 H40 Cd2 N4 O8 P4 S8 -","2","1","IS6023","Tao Li; Zhi-Hua LI; Shao-Wu Du","<i>catena</i>-Poly[[bis(<i>O</i>,<i>O</i>'-dimethyl dithiophosphato-κ^2^<i>S</i>,<i>S</i>')cadmium(II)]-μ-4,4'-bipyridine-<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2005","61","1","m95","m97","10.1107/S1600536804031885","","","0.71073","MoKα","","0.0487","0.0418","","","0.1024","0.1086","","","","","","1.056","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204905","13.345","0.0004","8.016","0.0004","12.378","0.0007","90","","104.391","0.003","90","","1282.57","0.11","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","p-nitrophenyl p-toluenesulfonate","4-Nitrophenyl 4-toluenesulfonate","","- C13 H11 N O5 S -","- C13 H11 N O5 S -","- C52 H44 N4 O20 S4 -","4","1","IS6024","Vadivelu Manivannan; Nagarajan Vembu; Maruthai Nallu; Kandasamy Sivakumar; Fronczek Frank R","4-Nitrophenyl 4-toluenesulfonate: supramolecular aggregation through weak C—H···O, C—H···π and van der Waals interactions","Acta Crystallographica Section E","2005","61","1","o75","o78","10.1107/S1600536804032015","","","0.71073","MoKα","","0.084","0.0372","","","0.0865","0.0915","","","","","","0.876","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204906","7.953","0.001","20.468","0.003","7.945","0.0009","90","","99.516","0.008","90","","1275.5","0.3","150","2","150","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","o-nitrophenyl o-toluenesulfonate","2-Nitrophenyl 4-toluenesulfonate","","- C13 H11 N O5 S -","- C13 H11 N O5 S -","- C52 H44 N4 O20 S4 -","4","1","IS6025","Vadivelu Manivannan; Nagarajan Vembu; Maruthai Nallu; Kandasamy Sivakumar; Fronczek R. Frank","2-Nitrophenyl 4-toluenesulfonate: supramolecular aggregation through weak C—H···O, C—H···π and π‒π interactions","Acta Crystallographica Section E","2005","61","1","o118","o120","10.1107/S1600536804032477","","","0.71073","MoKα","","0.1071","0.0612","","","0.1791","0.1867","","","","","","0.982","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204907","7.535","0.001","7.935","0.001","19.368","0.003","90","","95.03","0.04","90","","1153.6","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[2-mercaptopyridine N-oxide(1-)-κ^2^N,O]platinum(II)","","- C10 H8 N2 O2 Pt S2 -","- C10 H8 N2 O2 Pt S2 -","- C40 H32 N8 O8 Pt4 S8 -","4","1","IS6026","Zhou, Jian-Hao; Li, Yi-Zhi; Liu, Zheng; Chen, Xue-Tai","Bis[2-mercaptopyridine <i>N</i>-oxide(1‒)-κ^2^<i>N,O</i>]platinum(II)","Acta Crystallographica Section E","2005","61","1","m195","m197","10.1107/S1600536804033264","","","0.71073","MoKα","","0.0663","0.0481","","","0.1061","0.1115","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204908","15.465","0.004","9.988","0.002","11.227","0.003","90","","93.554","0.003","90","","1730.8","0.7","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,4-dimethyl-3-oxo-N-phenyl-2-(1H-1,2,4-triazol-1-yl)pentanethioamide monohydrate","","- C15 H20 N4 O2 S -","- C15 H20 N4 O2 S -","- C60 H80 N16 O8 S4 -","4","1","IS6027","Xu, Liang-Zhong; Xu, Hai-Zhen; Yu, Guan-Ping; Yang, Shuang-Hua; Li, Chun-Li","4,4-Dimethyl-3-oxo-<i>N</i>-phenyl-2-(1<i>H</i>-1,2,4-triazol-1-yl)pentanethioamide monohydrate","Acta Crystallographica Section E","2005","61","1","o163","o165","10.1107/S1600536804033276","","","0.71073","MoKα","","0.0876","0.0455","","","0.114","0.132","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204909","12.642","0.002","8.5036","0.0014","16.934","0.003","90","","98.488","0.003","90","","1800.5","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Ethyl 5-amino-3-methylisoxazole-4-carboxylate","","- C7 H10 N2 O3 -","- C7 H10 N2 O3 -","- C56 H80 N16 O24 -","8","1","IS6029","Sony, S. M. Malathy; Charles, P.; Ponnuswamy, M. N.; Yathirajan, H. S.; Nethaji, M.","Ethyl 5-amino-3-methylisoxazole-4-carboxylate","Acta Crystallographica Section E","2005","61","1","o198","o200","10.1107/S1600536804033720","","","0.71073","MoKα","","0.0935","0.0629","","","0.1379","0.1512","","","","","","1.137","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204910","16.6409","0.0011","8.7622","0.0006","13.9279","0.0009","90","","120.288","0.002","90","","1753.6","0.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Poly[[aquaneodymiun(III)]-μ~5~-citrato]","","- C6 H7 Nd O8 -","- C6 H7 Nd O8 -","- C48 H56 Nd8 O64 -","8","1","KP6015","Yuan, Da-Qiang; Xu, Yan-Qing; Wu, Ming-Yan; Hong, Mao-Chun","Poly[[aquaneodymium(III)]-μ~5~-citrato]","Acta Crystallographica Section E","2005","61","1","m108","m109","10.1107/S1600536804032210","","","0.71073","MoKα","","","0.0459","","","0.0976","0.1089","","","","","","1.156","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204911","11.853","0.002","5.052","0.0009","17.641","0.003","90","","102.72","0.009","90","","1030.4","0.3","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","catena-Poly[-diaquazinc(II)]-μ-4-carboxylatophenoxyacetato]","","- C9 H10 O7 Zn -","- C9 H10 O7 Zn -","- C36 H40 O28 Zn4 -","4","0.5","KP6023","Zhao, Jing Gui; Gao, Shan; Huo, Li Hua; Ng, Seik Weng","<i>catena</i>-Poly[[diaquazinc(II)]-μ-4-carboxylatophenoxyacetato]","Acta Crystallographica Section E","2005","61","1","m115","m116","10.1107/S1600536804032222","","","0.71073","MoKα","","0.055","0.045","","","0.11","0.114","","","","","","1.09","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204912","8.42","0.002","13.087","0.003","8.938","0.002","90","","116.45","0.03","90","","881.8","0.4","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2,6-Diaminotoluene-4-sulfonic acid","2-amino-6-ammoniotoluene-4-sulfonate","","- C7 H10 N2 O3 S -","- C7 H10 N2 O3 S -","- C28 H40 N8 O12 S4 -","4","1","KP6024","Huo, Li Hua; Xu, Shi Xiao; Gao, Shan; Zain, Sharifuddin M.; Ng, Seik Weng","6-Amino-2-ammoniotoluene-4-sulfonate","Acta Crystallographica Section E","2005","61","1","o100","o101","10.1107/S1600536804032234","","","0.71073","MoKα","","0.072","0.045","","","0.103","0.115","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204913","5.9958","0.0013","15.891","0.003","13.085","0.003","90","","97.49","0.02","90","","1236.1","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[(2-hexyl-2H-tetrazole-κN^4^)copper(II)]-di-μ-chloro]","","- C7 H14 Cl2 Cu N4 -","- C7 H14 Cl2 Cu N4 -","- C28 H56 Cl8 Cu4 N16 -","4","1","KP6026","Lyakhov, Alexander S.; Gaponik, Pavel N.; Degtyarik, Michail M.; Ivashkevich, Ludmila S.","<i>catena</i>-Poly[[(2-hexyl-2<i>H</i>-tetrazole-κ<i>N</i>^4^)copper(II)]-di-μ-chloro]","Acta Crystallographica Section E","2005","61","1","m183","m186","10.1107/S1600536804033446","","","0.71073","MoKα","","0.0415","0.0327","","","0.0879","0.0948","","","","","","1.046","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204914","8.5896","0.0014","9.3966","0.0015","10.9312","0.0018","96.489","0.002","99.109","0.002","103.805","0.002","835.5","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","Methyl 5-hydroxy-2-(2-hydroxy-6-methoxy-4-methylbenzoyl)-3-methoxybenzoate","","- C18 H18 O7 -","- C18 H18 O7 -","- C36 H36 O14 -","2","1","KP6028","Shu, Ren-Geng; Zhu, Hai-Liang; Tan, Ren-Xiang","Methyl 5-hydroxy-2-(2-hydroxy-6-methoxy-4-methylbenzoyl)-3-methoxybenzoate","Acta Crystallographica Section E","2005","61","1","o189","o191","10.1107/S160053680403346X","","","0.71073","MoKα","","0.0768","0.0633","","","0.1439","0.1505","","","","","","1.156","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204915","8.1027","0.0016","12.668","0.003","13.436","0.003","110.74","0.03","92.41","0.03","103.37","0.03","1243.1","0.6","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","(Acetato-κO)[diacetyl monooxime (4-methoxybenzoyl)hydrazonato- κ^3^O,N,N']bis(pyridine-κN)nickel(II)","","- C24 H27 N5 Ni O5 -","- C24 H27 N5 Ni O5 -","- C48 H54 N10 Ni2 O10 -","2","1","KP6029","Shan Gao; Li-Hua Huo; Zhao-Peng Deng; Hui Zhao","(Acetato-κ<i>O</i>)[diacetyl monooxime (4-methoxybenzoyl)hydrazonato-κ^3^<i>O</i>,<i>N</i>,<i>N</i>']bis(pyridine-κ<i>N</i>)nickel(II)","Acta Crystallographica Section E","2005","61","1","m152","m154","10.1107/S1600536804033495","","","0.71073","MoKα","","0.0641","0.0407","","","0.0906","0.1043","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204916","15.0216","0.0013","9.6464","0.0008","12.6545","0.001","90","","100.708","0.006","90","","1801.8","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-methyl-1-(1,2,3,9-tetrahydro-9-methyl-4-oxo-4H-carbazol-3-ylmethyl)-1H- imidazol-3-ium chloride dihydrate","","- C18 H24 Cl N3 O3 -","- C18 H24 Cl N3 O3 -","- C72 H96 Cl4 N12 O12 -","4","1","LH6309","Bolte, Michael; Yathirajan, Hemmige S.; Nagaraj, B.; Nagaraja, P.","Disorder in ondansetron hydrochloride dihydrate","Acta Crystallographica Section E","2005","61","1","o47","o48","10.1107/S1600536804028971","","","0.71073","MoKα","","0.0455","0.0328","","","0.0842","0.0872","","","","","","0.956","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204917","7.2051","0.0019","12.139","0.003","12.732","0.003","84.319","0.005","82.17","0.005","80.583","0.005","1085","0.5","100","2","273","2","","","","","","","","6","P -1","-P 1","2","","3-Methoxycarbonyl-1-methylpyridinium bis(2-thioxo-1,3-dithiole-4,5-dithiolato)nickelate(II)","","- C14 H10 N Ni O2 S10 -","- C14 H10 N Ni O2 S10 -","- C28 H20 N2 Ni2 O4 S20 -","2","1","LH6312","Tomono, Kazuaki; Sasaki, Yuka; Miyamura, Kazuo","3-Methoxycarbonyl-1-methylpyridinium bis(2-thioxo-1,3-dithiole-4,5-dithiolato)nickelate(II)","Acta Crystallographica Section E","2005","61","1","m18","m20","10.1107/S1600536804031034","","","0.71073","MoKα","","0.0861","0.0639","","","0.1776","0.1847","","","","","","1.067","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204918","7.518","0.003","14.801","0.01","7.678","0.006","90","","91.91","0.05","90","","853.9","0.9","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","4-hydroxy-2,6-dimethoxybenzaldehyde","4-hydroxy-2,6-dimethoxybenzaldehyde","","- C9 H10 O4 -","- C9 H10 O4 -","- C36 H40 O16 -","4","1","LH6314","Wuyts, Cindy; Vande Velde, Christophe M. L.; Geise, Herman J.; Blockhuys, Frank","4-Hydroxy-2,6-dimethoxybenzaldehyde","Acta Crystallographica Section E","2005","61","1","o79","o80","10.1107/S1600536804030053","","","0.71073","MoKα","","0.1294","0.0537","","","0.0964","0.1199","","","","","","0.968","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204919","15.563","0.004","7.2595","0.0017","15.425","0.004","90","","113.412","0.003","90","","1599.2","0.7","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2,3,5,6-tetramethylpyrazine 1,4-dioxide‒diaquadithiocyanatezinc(II) (1/1)","","- C10 H16 N4 O4 S2 Zn -","- C10 H16 N4 O4 S2 Zn -","- C40 H64 N16 O16 S8 Zn4 -","4","1","LH6323","Shi, Jing-Min; Zhang, Xia; Lu, Jian-Jun; Liu, Lian-Dong; Ma, Jian-Ping","The 1:1 adduct of 2,3,5,6-tetramethylpyrazine 1,4-dioxide and diaquabis(thiocyanato-κ<i>N</i>)zinc(II) (ATD)","Acta Crystallographica Section E","2005","61","1","m47","m49","10.1107/S1600536804031599","","","0.71073","MoKα","","0.0435","0.0354","","","0.0921","0.0963","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204920","9.521","0.001","9.41","0.001","17.426","0.002","90","","103.44","0.01","90","","1518.5","0.3","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","perfluoro 6-isopropyl-2,4,5-trimethyl-benzenecarbonitrile","3-fluoro-6-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]-2,4,5- tris(trifluoromethyl)benzonitrile","","- C13 F17 N -","- C13 F17 N -","- C52 F68 N4 -","4","1","LH6327","Batsanov, Andrei S.; Richmond, Paul; Sandford, Graham; Chambers, Richard D.","Perfluorinated 6-isopropyl-2,4,5-trimethylbenzonitrile","Acta Crystallographica Section E","2005","61","1","o45","o46","10.1107/S1600536804031745","","","0.71073","MoKα","","0.1277","0.0574","","","0.1078","0.134","","","","","","1.025","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204921","8.523","0.001","22.678","0.005","7.769","0.002","90","","93.388","0.015","90","","1499","0.5","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(Anthracen-9-ylmethyl)diethylamine at 100K","","- C19 H21 N -","- C19 H21 N -","- C76 H84 N4 -","4","1","LH6328","Howie, R. Alan; Kindness, Andrew; McKay, Michael G.; Maguire, Glenn E. M.","(Anthracen-9-ylmethyl)diethylamine at 100K","Acta Crystallographica Section E","2005","61","1","o52","o54","10.1107/S1600536804031265","","","0.71073","MoKα","","0.0681","0.0476","","","0.1264","0.1367","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204922","12.8111","0.0003","14.8721","0.0004","12.8378","0.0003","90","","91.3964","0.0014","90","","2445.23","0.1","160","1","160","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","cis-Bis(8-hydroxyquinolinato-κ^2^N,O)diphenyltin(IV)","","- C30 H22 N2 O2 Sn -","- C30 H22 N2 O2 Sn -","- C120 H88 N8 O8 Sn4 -","4","1","LH6330","Linden, Anthony; Basu Baul, Tushar S.; Mizar, Archana","<i>cis</i>-Bis(8-hydroxyquinolinato-κ^2^<i>N</i>,<i>O</i>)diphenyltin(IV)","Acta Crystallographica Section E","2005","61","1","m27","m29","10.1107/S1600536804031277","","","0.71073","MoKα","","0.0632","0.0374","","","0.0799","0.0909","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204923","15.815","0.006","15.815","0.006","16.773","0.009","90","","90","","90","","4195","3","110","2","110","2","","","","","","","","6","I 41/a c d :2","-I 4bd 2c","142","","Dichlorotetrapyridinenickel(II) 0.76-hydrate","","- C20 H21.52 Cl2 N4 Ni O0.76 -","- C20 H21.52 Cl2 N4 Ni O0.76 -","- C160 H172.16 Cl16 N32 Ni8 O6.08 -","8","0.25","LH6331","Zhang, Hui; Fang, Liang","Dichlorotetrapyridinenickel(II) 0.76-hydrate","Acta Crystallographica Section E","2005","61","1","m180","m182","10.1107/S1600536804033586","","","0.71073","MoKα","","0.0383","0.022","","","0.047","0.0485","","","","","","0.831","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2204924","8.6851","0.0011","10.6167","0.0009","12.433","0.0012","106.724","0.008","101.049","0.01","107.406","0.008","998.1","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-tert-Butyl-1-(4-chlorophenyl)-7,7-dimethyl-5,6,7,8- tetrahydroimidazo[3,4-b]quinolin-5-one","","- C22 H24 Cl N3 O -","- C22 H24 Cl N3 O -","- C44 H48 Cl2 N6 O2 -","2","1","LH6332","Low, John N.; Cobo, Justo; Mera, Jaime; Quiroga, Jairo; Glidewell, Christopher","3-<i>tert</i>-Butyl-1-(4-chlorophenyl)-7,7-dimethyl-5,6,7,8-tetrahydropyrazolo[3,4-<i>b</i>]quinolin-5-one: centrosymmetric dimers generated by C—H···π(arene) hydrogen bonds","Acta Crystallographica Section E","2005","61","1","o49","o51","10.1107/S1600536804031927","","","0.71073","MoKα","","0.2329","0.0528","","","0.0979","0.1218","","","","","","0.93","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204925","20.829","0.002","8.428","0.001","6.8415","0.0008","90","","108.402","0.002","90","","1139.6","0.2","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Melaminium(2+) di(hydrogen oxalate)","","- C7 H10 N6 O8 -","- C7 H10 N6 O8 -","- C28 H40 N24 O32 -","4","0.5","LH6334","Zhang, Xiu-Lian; Chen, Xiao-Ming; Ng, Seik Weng","Melaminium bis(hydrogen oxalate)","Acta Crystallographica Section E","2005","61","1","o156","o157","10.1107/S1600536804033239","","","0.71073","MoKα","","0.049","0.041","","","0.11","0.116","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204926","7.0522","0.0005","9.9537","0.0008","9.9895","0.0007","83.607","0.006","80.386","0.006","89.477","0.006","687.04","0.09","100","","100","","","","","","","","","5","P -1","-P 1","2","","1-[2-(5-Nitrobenzimidazol-1-yl)ethyl]morpholinium chloride","","- C13 H17 Cl N4 O3 -","- C13 H17 Cl N4 O3 -","- C26 H34 Cl2 N8 O6 -","2","1","LH6336","Mehmet Akkurt; Sevim Türktekin; Hasan Küçükbay; Ülkü Yılmaz; Orhan Büyükgüngör","1-[2-(5-Nitro-1<i>H</i>-benzimidazol-1-yl)ethyl]morpholinium chloride","Acta Crystallographica Section E","2005","61","1","o166","o168","10.1107/S1600536804033240","","","0.71073","MoKα","","0.0304","0.0269","","","0.0678","0.0693","","","","","","1.056","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204927","15.405","0.003","8.886","0.0018","11.105","0.002","90","","100.75","0.03","90","","1493.5","0.5","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","Bis(methylenedithio)tetrathiafulvalene dichloride","4,5:4',5'-Bis(methylenedithio)tetrathiafulvalenium dichloride","","- C8 H4 Cl2 S8 -","- C8 H4 Cl2 S8 -","- C32 H16 Cl8 S32 -","4","0.5","NC6006","Xun-Wen Xiao; Wei Xu; Hai Xu; De-Qing Zhang; Dao-Ben Zhu","4,5:4',5'-Bis(methylenedithio)tetrathiafulvalenium dichloride","Acta Crystallographica Section E","2005","61","1","o111","o113","10.1107/S1600536804032350","","","0.71073","MoKα","","0.0978","0.0603","","","0.164","0.1766","","","","","","0.934","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204928","7.0561","0.0014","7.5531","0.0015","7.6261","0.0015","90","","117.36","0.03","90","","360.97","0.16","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Poly[aquamanganese(II)-μ~3~-1H-imidazole-4,5-dicarboxylato]","","- C5 H4 Mn N2 O5 -","- C5 H4 Mn N2 O5 -","- C10 H8 Mn2 N4 O10 -","2","1","NC6009","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui","Poly[aquamanganese(II)-μ~3~-1<i>H</i>-imidazole-4,5-dicarboxylato]","Acta Crystallographica Section E","2005","61","1","m155","m157","10.1107/S1600536804033306","","","0.71073","MoKα","","0.0241","0.0219","","","0.0479","0.0487","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204929","11.3447","0.001","13.4618","0.0011","29.91","0.003","90","","98.65","0.002","90","","4515.9","0.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Poly[[tris(di-2-pyridylamine)bis(μ-5-sulfonatosalicylato)tricopper(II)] trihydrate]","","- C44 H39 Cu3 N9 O15 S2 -","- C44 H35 Cu3 N9 O15 S2 -","- C176 H140 Cu12 N36 O60 S8 -","4","0.5","NC6010","Fan, Sai-Rong; Zhu, Long-Guan","Poly[[tris(di-2-pyridylamine)tris(μ-5-sulfonatosalicylato)tricopper(II)] trihydrate]","Acta Crystallographica Section E","2005","61","1","m174","m176","10.1107/S1600536804032908","","","0.71073","MoKα","","0.0563","0.0422","","","0.0975","0.1018","","","","","","0.956","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204930","7.0624","0.0011","10.3895","0.0016","12.7945","0.0019","91.557","0.012","91.519","0.012","104.011","0.012","910","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","diaquatetrakis(μ-1,2-benzenedicarboxylato)di-μ-nitrato-pentastrontium(II)","","- C32 H20 N2 O24 Sr5 -","- C32 H20 N2 O24 Sr5 -","- C32 H20 N2 O24 Sr5 -","1","0.5","NC6011","Stein, Irena; Ruschewitz, Uwe","Polymeric diaquatetrakis(μ-1,2-benzenedicarboxylato)di-μ-nitrato-pentastrontium(II)","Acta Crystallographica Section E","2005","61","1","m141","m143","10.1107/S1600536804032805","","","0.71073","MoKα","","0.0568","0.0338","","","0.0775","0.0912","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204931","4.0159","0.0003","23.6948","0.0014","12.7652","0.0011","90","","91.642","0.007","90","","1214.19","0.16","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(3,4-Methylenedioxyphenoxy)phthalonitrile","","- C15 H8 N2 O3 -","- C15 H8 N2 O3 -","- C60 H32 N8 O12 -","4","1","NC6012","Ocak Iskeleli, Nazan; Ag̃ar, Ayşen","4-(3,4-Methylenedioxyphenoxy)phthalonitrile","Acta Crystallographica Section E","2005","61","1","o158","o159","10.1107/S1600536804033094","","","0.71073","MoKα","","0.0549","0.0445","","","0.119","0.1272","","","","","","1.071","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204932","10.0696","0.0017","9.4318","0.0016","10.1752","0.0019","90","","95.178","0.014","90","","962.4","0.3","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","Pioglitazone hydrochloride","(±)-5-({4-[2-(5-ethyl-2-pyridinio)ethoxy]phenyl}methyl)thiazolidine-2,4-dione chloride","","- C19 H21 Cl N2 O3 S -","- C19 H21 Cl N2 O3 S -","- C38 H42 Cl2 N4 O6 S2 -","2","1","NC6013","Yathirajan, Hemmige S.; Nagaraj, Basavegowda; Nagaraja, Padmarajaiah; Bolte, Michael","Pioglitazone hydrochloride","Acta Crystallographica Section E","2005","61","1","o154","o155","10.1107/S1600536804033100","","","0.71073","MoKα","","0.0459","0.0348","","","0.0718","0.074","","","","","","0.828","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204933","8.0458","0.0009","10.5193","0.0011","15.7386","0.0017","98.073","0.009","90.542","0.009","103.744","0.008","1279.8","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","Phthaloyl amlodipine","3-ethyl 5-methyl 4-(2-chlorophenyl)-2-(2-phthalmidoethoxymethyl)-6-methyl-1,4- dihydropyridine-3,5-dicarboxylate","","- C28 H27 Cl N2 O7 -","- C28 H27 Cl N2 O7 -","- C56 H54 Cl2 N4 O14 -","2","1","NC6014","Yathirajan, Hemmige S.; Nagaraj, Basavegowda; Bolte, Michael","Phthaloyl amlodipine","Acta Crystallographica Section E","2005","61","1","o174","o175","10.1107/S1600536804033471","","","0.71073","MoKα","","0.0485","0.0337","","","0.0831","0.0875","","","","","","0.952","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204934","21.0397","0.0019","11.6598","0.0012","8.6694","0.0008","90","","92.935","0.007","90","","2124","0.4","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","N-Amino-3-methyl-2,3-dihydro-1,3-benzothiazoliminium chloride monohydrate","","- C8 H12 Cl N3 O S -","- C8 H12 Cl N3 O S -","- C64 H96 Cl8 N24 O8 S8 -","8","1","NC6015","Yathirajan, Hemmige S.; Narasegowda, Rajenahally S.; Bolte, Michael","<i>N</i>-Amino-3-methyl-2,3-dihydro-1,3-benzothiazoliminium chloride monohydrate","Acta Crystallographica Section E","2005","61","1","o176","o178","10.1107/S1600536804033483","","","0.71073","MoKα","","0.0272","0.0232","","","0.0631","0.064","","","","","","1.046","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204935","12.7882","0.001","6.9977","0.0005","21.3137","0.0017","90","","105.994","0.001","90","","1833.5","0.2","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Aqua{2,2'-[propane-1,3- diylbis(nitrilomethylidyne)]diphenolato}(thiocyanato)cobalt(III)","","- C18 H18 Co N3 O3 S -","- C18 H18 Co N3 O3 S -","- C72 H72 Co4 N12 O12 S4 -","4","1","NG6068","Sun, Yu-Xi","Aqua(isothiocyanato){2,2'-[propane-1,3-diylbis(nitrilomethylidyne)]diphenolato}cobalt(III)","Acta Crystallographica Section E","2005","61","1","m39","m40","10.1107/S1600536804031307","","","0.71073","MoKα","","0.0757","0.0581","","","0.1493","0.1606","","","","","","1.066","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204936","9.5529","0.0011","12.6089","0.0014","13.7463","0.0016","90","","95.238","0.002","90","","1648.8","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[(2,2'-bipyridine)copper(II)]-μ-5-nitroisophthalato]","","- C18 H11 Cu N3 O6 -","- C18 H11 Cu N3 O6 -","- C72 H44 Cu4 N12 O24 -","4","1","NG6073","Hong-Ping Xiao; Xin-Hua Li; Ya-Qian Cheng","<i>catena</i>-Poly[[(2,2'-bipyridine)copper(II)]-μ-5-nitroisophthalato]","Acta Crystallographica Section E","2005","61","1","m158","m159","10.1107/S1600536804032970","","","0.71073","MoKα","","0.0465","0.0397","","","0.0931","0.0966","","","","","","1.054","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204937","6.9025","0.0014","16.504","0.003","16.77","0.003","90","","90","","90","","1910.4","0.6","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-(Benzotriazol-1-yl)-2-(α-hydroxybenzyl)-N-phenylthioacrylamide","","- C21 H16 Cd N2 O6 -","- C21 H16 Cd N2 O6 -","- C84 H64 Cd4 N8 O24 -","4","1","NG6078","Gao, Shan; Huo, Li-Hua; Gu, Chang-Sheng; Zhao, Jing-Gui","<i>catena</i>-Poly[[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]-μ-4-carboxylatophenoxyacetato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>'']","Acta Crystallographica Section E","2005","61","1","m198","m200","10.1107/S160053680403377X","","","0.71073","MoKα","","0.0577","0.0395","","","0.0586","0.0619","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204938","21.399","0.008","7.504","0.005","24.891","0.016","90","","120.15","0.04","90","","3456","4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2,2'-Bipyridine-κ^2^N,N')(3-oxidonaphthalene-2-carboxylato- κ^2^O:O')palladium(II) hemihydrate","","- C21 H15 N2 O3.5 Pd -","- C21 H15 N2 O3.5 Pd -","- C168 H120 N16 O28 Pd8 -","8","2","OB6443","Yue Wang; Nobuo Okabe","(2,2'-Bipyridine-κ^2^<i>N,N</i>')(3-oxidonaphthalene-2-carboxylato-κ^2^<i>O</i>:<i>O</i>')palladium(II) hemihydrate","Acta Crystallographica Section E","2005","61","1","m3","m5","10.1107/S1600536804030983","","","0.71073","MoKα","","0.0997","0.0312","","","0.0402","0.0442","","","","","","0.658","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204939","9.53","0.005","9.561","0.006","11.609","0.005","108.472","0.005","93.918","0.006","92.673","0.005","998.3","0.9","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[silver(I)-μ-propane-1,3-diamine-κ^2^N:N'] bis(4-nitrobenzoato-κO)silver(I)]","","- C17 H18 Ag2 N4 O8 -","- C17 H18 Ag2 N4 O8 -","- C34 H36 Ag4 N8 O16 -","2","1","OB6444","You, Zhong-Lu; Wang, Zuo-Mao; Zou, Ying; Zhu, Hai-Liang","<i>catena</i>-Poly[[silver(I)-μ-propane-1,3-diamine-κ^2^<i>N</i>:<i>N</i>'] bis(4-nitrobenzoato-κ<i>O</i>)argentate(I)]","Acta Crystallographica Section E","2005","61","1","m6","m8","10.1107/S1600536804031071","","","0.71073","MoKα","","0.0502","0.0436","","","0.1078","0.1182","","","","","","1.067","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204940","9.7879","0.0008","7.9071","0.0005","13.8045","0.001","90","","102.266","0.006","90","","1043.99","0.13","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Ethyl-5-(2-hydroxyphenyl)-2H-1,2,4-triazole-3(4H)-thione","","- C10 H11 N3 O S -","- C10 H11 N3 O S -","- C40 H44 N12 O4 S4 -","4","1","OB6445","Dege, Necmi; Özdemir, Namık; Çetin, Ahmet; Cansız, Ahmet; Şekerci, Memet; Dinçer, Muharrem","4-Ethyl-5-(2-hydroxyphenyl)-2<i>H</i>-1,2,4-triazole-3(4<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","1","o17","o19","10.1107/S1600536804031137","","","0.71073","MoKα","","0.0361","0.0305","","","0.0836","0.0863","","","","","","1.009","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204941","11.229","0.001","9.207","0.001","19.086","0.001","90","","125.4","0.01","90","","1608.4","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-(3-Methylphenyl)-3,5-di-2-pyridyl-4H-1,2,4-triazole","","- C19 H15 N5 -","- C19 H15 N5 -","- C76 H60 N20 -","4","1","OB6446","Zhang, Shu-Ping; You, Zhong-Lu; Shao, Si-Chang; Zhu, Hai-Liang","4-(3-Methylphenyl)-3,5-di-2-pyridyl-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2005","61","1","o27","o28","10.1107/S1600536804031319","","","0.71073","MoKα","","0.1261","0.0644","","","0.1128","0.1357","","","","","","1.01","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2204942","11.704","0.001","19.935","0.002","8.181","0.001","90","","107.58","0.002","90","","1819.6","0.3","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-(4-Isopropylphenyl)-3,5-di-2-pyridyl-4H-1,2,4-triazole","","- C21 H19 N5 -","- C21 H19 N5 -","- C84 H76 N20 -","4","1","OB6447","Zhang, Shu-Ping; You, Zhong-Lu; Shao, Si-Chang; Zhu, Hai-Liang","4-(4-Isopropylphenyl)-3,5-di-2-pyridyl-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2005","61","1","o8","o9","10.1107/S1600536804031101","","","0.71073","MoKα","","0.0803","0.05","","","0.1114","0.1263","","","","","","1.002","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204943","8.294","0.0017","12.654","0.003","23.601","0.005","90","","97.02","0.03","90","","2458.4","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl 3-(dimethylamino)-2-[2-(1-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}- 2-(dimethylamino)vinyloxy)phenyl]acrylate","","- C25 H28 N4 O4 S -","- C25 H28 N4 O4 S -","- C100 H112 N16 O16 S4 -","4","1","OB6448","Wang, Hai-Bo; Chen, Jia-Hui; Pu, Yue-Qing; Wang, Jin-Tang","Methyl 3-(dimethylamino)-2-[2-(1-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}-2-(dimethylamino)vinyloxy)phenyl]acrylate","Acta Crystallographica Section E","2005","61","1","o58","o59","10.1107/S1600536804031897","","","0.71073","MoKα","","0.1474","0.0582","","","0.1653","0.2111","","","","","","1.097","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204944","12.355","0.001","21.912","0.002","8.972","0.001","90","","95.58","0.01","90","","2417.4","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(6,6'-dimethyl-2,2'-bipyridine)copper(I) perchlorate","","- C24 H24 Cl Cu N4 O4 -","- C24 H24 Cl Cu N4 O4 -","- C96 H96 Cl4 Cu4 N16 O16 -","4","1","OB6449","Cui, Guang-Hua; Li, Jian-Rong; Gao, Di; Ng, Seik Weng","Bis(6,6'-dimethyl-2,2'-bipyridine)copper(I) perchlorate","Acta Crystallographica Section E","2005","61","1","m72","m73","10.1107/S1600536804031939","","","0.71073","MoKα","","0.088","0.049","","","0.126","0.151","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204945","9.058","0.001","12.931","0.001","17.879","0.001","85.011","0.001","80.643","0.001","84.314","0.001","2050.8","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Diaquatris(nicotinato-κO)bis(1,10-phenanthroline-κ^2^N,N')cerium(III) trihydrate","","- C42 H38 Ce N7 O11 -","- C42 H38 Ce N7 O11 -","- C84 H76 Ce2 N14 O22 -","2","1","OB6450","Liu, Fu-Chen; Li, Jian-Rong; Ng, Seik Weng","Diaquatris(nicotinato-κ<i>O</i>)bis(1,10-phenanthroline-κ^2^<i>N,N</i>')cerium(III) trihydrate","Acta Crystallographica Section E","2005","61","1","m9","m10","10.1107/S1600536804031125","","","0.71073","MoKα","","0.05","0.034","","","0.066","0.077","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204946","11.304","0.003","9.485","0.003","17.835","0.005","90","","97.434","0.002","90","","1896.2","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis[2-(4-pyridinio)-1H-benzimidazolium] hexacosaoxooctamolybdenum(VI)","","- C24 H22 Mo8 N6 O26 -","- C24 H22 Mo8 N6 O26 -","- C48 H44 Mo16 N12 O52 -","2","0.5","OB6451","Li-Juan Chen; Chang-Kun Xia; Quan-Zheng Zhang; Can-Zhong Lu","Bis[2-(4-pyridinio)-1<i>H</i>-benzimidazolium] hexacosaoxooctamolybdate(VI)","Acta Crystallographica Section E","2005","61","1","m92","m94","10.1107/S1600536804032027","","","0.71073","MoKα","","0.0502","0.0427","","","0.1073","0.1136","","","","","","1.085","","","","has coordinates,has Fobs","201211","2020-10-21","18:00:00",""
"2204947","10.277","0.001","6.9852","0.0005","25.695","0.003","90","","92.512","0.009","90","","1842.8","0.3","299","2","299","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Amino-1-(3,4-methylenedioxyphenyl)-9-methoxy-5,6-dihydro-1H- benzo[f]chromene-2-carbonitrile","","- C22 H18 N2 O4 -","- C22 H18 N2 O4 -","- C88 H72 N8 O16 -","4","1","OB6452","Chen-Xia Yu; Da-Qing Shi; Xiang-Shan Wang; Qi-Ya Zhuang","3-Amino-1-(3,4-methylenedioxyphenyl)-9-methoxy-5,6-dihydro-1<i>H</i>-benzo[<i>f</i>]chromene-2-carbonitrile","Acta Crystallographica Section E","2005","61","1","o84","o86","10.1107/S1600536804032039","","","0.71073","MoKα","","0.0637","0.0354","","","0.0759","0.0824","","","","","","0.861","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204948","7.5757","0.0005","12.7812","0.0004","12.9142","0.0008","62.186","0.005","89.802","0.008","74.08","0.006","1052.09","0.12","193","2","193","2","","","","","","","","5","P -1","-P 1","2","Methyl 2-amino-4-(4-chlorophenyl)-4H-pyrano[3,2-c]coumarin-3-carboxylate N,N-dimethylformamide solvate","methyl 2-amino-4-(4-chlorophenyl)-5-oxo-4H,5H-pyrano[3,2-c]chromene-3-carboxylate N,N-dimethylformamide solvate","","- C23 H21 Cl N2 O6 -","- C23 H21 Cl N2 O6 -","- C46 H42 Cl2 N4 O12 -","2","1","OB6453","Daqing Shi; Nan Wu; Qiya Zhuang; Yong Zhang","Methyl 2-amino-4-(4-chlorophenyl)-4<i>H</i>-pyrano[3,2-<i>c</i>]coumarin-3-carboxylate <i>N</i>,<i>N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2005","61","1","o87","o89","10.1107/S1600536804032040","","","0.7107","MoKα","","0.0419","0.0381","","","0.0987","0.102","","","","","","1.055","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204949","9.525","0.003","5.992","0.003","14.817","0.002","90","","94.77","0.02","90","","842.7","0.5","290","","290","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[1-(hydroxyethylamino)propyl]phosphonic acid","[1-(hydroxyethylammonio)propyl]phosphonate","","- C5 H14 N O4 P -","- C5 H14 N O4 P -","- C20 H56 N4 O16 P4 -","4","1","OB6454","Shivachev, Boris; Petrova, Rosica; Kossev, Krassimir; Troev, Kolio","[1-(Hydroxyethylammonio)propyl]phosphonate","Acta Crystallographica Section E","2005","61","1","o134","o136","10.1107/S1600536804032623","","","0.71073","MoKα","","0.0622","0.0421","","","0.108","0.1232","","","","","","0.877","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204950","10.9","0.002","12.197","0.002","14.772","0.003","91.86","0.01","91.53","0.02","92.28","0.01","1960.5","0.6","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Bis(2,2'-bipyridine-κN,N'){[5-(carboxymethylsulfanyl)-1,3,4-thiadiazol-2- ylsulfanyl]acetato-κO}copper(II) 5-(carboxymethylsulfanyl)-1,3,4-thiadiazol-2-ylsulfanylacetate dihydrate","","- C32 H30 Cu N8 O10 S6 -","- C32 H30 Cu N8 O10 S6 -","- C64 H60 Cu2 N16 O20 S12 -","2","1","OB6456","Gao, Shan; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","Bis(2,2'-bipyridine-κ<i>N</i>,<i>N</i>'){[5-(carboxymethylsulfanyl)-1,3,4-thiadiazol-2-ylsulfanyl]acetato-κ<i>O</i>}copper(II) [5-(carboxymethylsulfanyl)-1,3,4-thiadiazol-2-ylsulfanyl]acetate dihydrate","Acta Crystallographica Section E","2005","61","1","m126","m128","10.1107/S1600536804032647","","","0.71073","MoKα","","0.077","0.052","","","0.141","0.156","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204951","11.2374","0.0008","11.2374","0.0008","24.648","0.003","90","","90","","120","","2695.5","0.4","293","2","123","2","","","","","","","","7","P 63 2 2","P 6c 2c","182","","tris(ethylenediamine-κ^2^N,N')cobalt(III) chloride diiodide monohydrate","","- C6 H26 Cl Co I2 N6 O -","- C6 H26 Cl Co I2 N6 O -","- C36 H156 Cl6 Co6 I12 N36 O6 -","6","0.5","RZ6010","Zhang, Zhang-Jing; Zheng, Fa-Kun; Fu, Ming-Lai; Guo, Guo-Cong; Huang, Jin-Shun","A new cobalt(III) ethylenediamine complex with mixed halide counter-anions, [Co(en)~3~](Cl)(I)~2~·H~2~O","Acta Crystallographica Section E","2005","61","1","m89","m91","10.1107/S1600536804030272","","","0.71073","MoKα","","0.0906","0.0529","","","0.0826","0.0968","","","","","","1.008","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204952","14.951","0.002","9.1564","0.0015","12.815","0.002","90","","90","","90","","1754.3","0.5","223","2","223","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Bis(pyridinium) tetrabromocadmate(II) monohydrate","","- C10 H14 Br4 Cd N2 O -","- C10 H14 Br4 Cd N2 O -","- C40 H56 Br16 Cd4 N8 O4 -","4","0.5","RZ6012","Zhang, Hui; Fang, Liang","Bis(pyridinium) tetrabromocadmate(II) monohydrate","Acta Crystallographica Section E","2005","61","1","m101","m102","10.1107/S1600536804029897","","","0.71073","MoKα","","0.0461","0.0296","","","0.0698","0.0767","","","","","","1.102","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204953","6.1539","0.001","10.7908","0.0017","34.057","0.006","90","","94.504","0.014","90","","2254.6","0.6","298","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(4-Methoxyphenyl)-3-phenyl-2,4,8,10-tetraazaspiro[5.4]dec-1-ene-6,8,10-trione acetone solvate monohydrate","","- C22 H24 N4 O6 -","- C22 H24 N4 O6 -","- C88 H96 N16 O24 -","4","1","RZ6024","Bruno, Giuseppe; Rotondo, Archimede; Nicoló, Francesco; Foti, Francesco; Grassi, Giovanni; Risitano, Francesco","4-(4-Methoxyphenyl)-3-phenyl-2,4,8,10-tetraazaspiro[5.4]dec-1-ene-6,8,10-trione acetone solvate monohydrate","Acta Crystallographica Section E","2005","61","1","o139","o141","10.1107/S1600536804032817","","","0.71073","MoKα","","","0.0553","","","","0.17","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204954","12.027","0.004","13.38","0.005","13.416","0.003","71.32","0.03","86.159","0.013","87.84","0.03","2040.3","1.2","571","2","","","","","","","","","","5","P -1","-P 1","2","","3-Bromo-1,4-diphenyl-1,2,7,9-tetraazaspiro[5.4]dec-2-ene-6,8,10-trione acetone solvate","","- C20 H19 Br N4 O4 -","- C20 H19 Br N4 O4 -","- C80 H76 Br4 N16 O16 -","4","2","RZ6025","Bruno, Giuseppe; Rotondo, Archimede; Nicoló, Francesco; Foti, Francesco; Grassi, Giovanni; Risitano, Francesco","3-Bromo-1,4-diphenyl-1,2,7,9-tetraazaspiro[5.4]dec-2-ene-6,8,10-trione acetone solvate","Acta Crystallographica Section E","2005","61","1","o142","o144","10.1107/S1600536804032829","","","0.71073","MoKα","","","0.056","","","","0.1413","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204955","18.092","0.005","9.471","0.002","8.464","0.002","90","","100.127","0.008","90","","1427.7","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(4-Chlorobenzoyl)methyl morpholine-4-carbodithionate","","- C13 H14 Cl N O2 S2 -","- C13 H14 Cl N O2 S2 -","- C52 H56 Cl4 N4 O8 S8 -","4","1","RZ6026","Liang-Zhong Xu; Wei-Hua Li; Hai-Bin Song; Kai Li; Guan-ping Yu","(4-Chlorobenzoyl)methyl morpholine-4-carbodithionate","Acta Crystallographica Section E","2005","61","1","o130","o131","10.1107/S1600536804032593","","","0.71073","MoKα","","0.0566","0.0348","","","0.0783","0.0882","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204956","33.745","0.005","6.3132","0.0011","18.793","0.004","90","","119.572","0.01","90","","3482.1","1.1","293","2","130.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Re C15 H11 N3 Cl O7","(Acetonitrile)(2,2'-bipyridine)tricarbonylrhenium(I) perchlorate","","- C15 H11 Cl N3 O7 Re -","- C15 H11 Cl N3 O7 Re -","- C120 H88 Cl8 N24 O56 Re8 -","8","1","RZ6027","Chen, Yan-Dan; Zhang, Li-Yi; Chen, Zhong-Ning","(Acetonitrile)(2,2'-bipyridine)tricarbonylrhenium(I) perchlorate","Acta Crystallographica Section E","2005","61","1","m121","m122","10.1107/S1600536804032246","","","0.71073","MoKα","","0.0253","0.0238","","","0.0606","0.0614","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204957","25.826","0.002","6.8065","0.0006","17.2924","0.0016","90","","102.49","0.002","90","","2967.8","0.4","273","2","273","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","7-chloro-8-fluoro-4-phenyl-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline","","- C17 H15 Cl F N O -","- C17 H15 Cl F N O -","- C136 H120 Cl8 F8 N8 O8 -","8","1","RZ6028","K. Ravikumar; B. Sridhar; M. Mahesh; V. V. Narayana Reddy","A diastereoisomer of furo[3,2-<i>c</i>]quinoline","Acta Crystallographica Section E","2005","61","1","o102","o104","10.1107/S1600536804032283","","","0.71073","MoKα","","0.0836","0.0658","","","0.1458","0.1545","","","","","","1.156","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204958","6.5573","0.001","9.5294","0.0014","9.8799","0.0015","62.979","0.002","79.162","0.002","78.385","0.001","535.4","0.14","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","Poly[[diaqua(μ~6~-1,3,5-benzenetricarboxylato)tricadmium(II)] dihydrate]","","- C18 H14 Cd3 O16 -","- C18 H14 Cd3 O16 -","- C18 H14 Cd3 O16 -","1","0.5","RZ6029","You-Fu Zhou; Ben-Lai Wu; Lei Han; Mao-Chun Hong","Poly[[diaqua(μ~6~-1,3,5-benzenetricarboxylato)tricadmium(II)] dihydrate]","Acta Crystallographica Section E","2005","61","1","m160","m163","10.1107/S1600536804033136","","","0.71073","MoKα","","","0.0482","","","0.1026","0.1164","","","","","","1.092","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204959","7.5168","0.0006","15.124","0.001","13.1804","0.001","90","","94.61","0.004","90","","1493.55","0.19","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bromobis(2,3-lutidine)copper(I)","","- C14 H18 Br Cu N2 -","- C14 H18 Br Cu N2 -","- C56 H72 Br4 Cu4 N8 -","4","1","RZ6030","Jones, Peter G.; Zerbe, Eva-Maria","Bromobis(2,3-lutidine)copper(I)","Acta Crystallographica Section E","2005","61","1","m106","m107","10.1107/S1600536804032416","","","0.71073","MoKα","","0.0372","0.0249","","","0.0564","0.0617","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204960","14.1068","0.0009","9.5526","0.0006","21.1298","0.0013","90","","90","","90","","2847.4","0.3","273","2","273","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4-(4-chlorophenyl)-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline","","- C17 H16 Cl N O -","- C17 H16 Cl N O -","- C136 H128 Cl8 N8 O8 -","8","1","RZ6035","Ravikumar, K.; Sridhar, B.; Mahesh, M.; Narayana Reddy, V. V.","A diastereoisomer of furo[3,2-<i>c</i>]quinoline","Acta Crystallographica Section E","2005","61","1","o195","o197","10.1107/S1600536804033550","","","0.71073","MoKα","","0.0629","0.0564","","","0.1456","0.1503","","","","","","1.136","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204961","11.3309","0.0013","12.2714","0.0014","15.0877","0.0015","90","","98.281","0.008","90","","2076","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(2,2'-bipyridine)nitratocopper(II) nitrate","","- C20 H16 Cu N6 O6 -","- C20 H16 Cu N6 O6 -","- C80 H64 Cu4 N24 O24 -","4","1","SJ6001","Marjani, Katayoun; Davies, Sian C.; Durrant, Marcus C.; Hughes, David L.; Khodamorad, Nejat; Samodi, Assadolah","Bis(2,2'-bipyridine)nitratocopper(II) nitrate","Acta Crystallographica Section E","2005","61","1","m11","m14","10.1107/S1600536804030788","","","0.71069","Mo-Kα","","0.1264","0.0486","","","0.0667","0.0924","","","","","","0.969","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204962","11.6288","0.0009","14.0386","0.0011","13.7457","0.001","90","","98.349","0.001","90","","2220.2","0.3","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(3aS,10R,10aS,10bS,13R,13aR)-8-formyl-6-hydroxy-13-methoxy-1,1,7-trimethyl- 5-oxo-1,2,3,3a,5,9,10,10a,13,13a-decahydrocyclohepta[c]furo[3,4-e]chromen-10-yl acetate","","- C23 H30 O8 -","- C23 H30 O8 -","- C92 H120 O32 -","4","2","SJ6021","Shi, Hao","(3a<i>S</i>*,10<i>R</i>*,10a<i>S</i>*,10b<i>S</i>*,13<i>R</i>*,13a<i>R</i>*)-8-Formyl-6-hydroxy-13-methoxy-1,1,7-trimethyl-5-oxo-1,2,3,3a,5,9,10,10a,13,13a-decahydrocyclohepta[<i>c</i>]furo[3,4-<i>e</i>]chromen-10-yl acetate","Acta Crystallographica Section E","2005","61","1","o12","o14","10.1107/S1600536804031046","","","0.71073","MoKα","","0.0573","0.0477","","","0.1128","0.1188","","","","","","0.836","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204963","15.5339","0.0013","11.1141","0.0007","15.7665","0.0015","90","","114.061","0.007","90","","2485.5","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,5-Bis(5-isopropyl-2-methylphenoxy)phthalonitrile","","- C28 H26 N2 O2 -","- C28 H26 N2 O2 -","- C112 H104 N8 O8 -","4","1","SJ6023","Ocak, Nazan; Yavuz, Metin; Işık, Şamil; Akdemir, Nesuhi; Aǧar, Erbil; Özil, Musa","4,5-Bis(5-isopropyl-2-methylphenoxy)phthalonitrile","Acta Crystallographica Section E","2005","61","1","o37","o39","10.1107/S1600536804031289","","","0.71073","MoKα","","0.0916","0.0525","","","0.1458","0.167","","","","","","0.942","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204964","10.4","0.007","9.117","0.006","32.09","0.02","90","","90","","90","","3043","3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","isoprothiolane","diisopropyl (1,3-dithiolan-2-ylidene)malonate","","- C12 H18 O4 S2 -","- C12 H18 O4 S2 -","- C96 H144 O32 S16 -","8","1","SJ6026","Chopra, Deepak; Mohan, T. P.; Rao, K. S.; Guru Row, T. N.","Diisopropyl (1,3-dithiolan-2-ylidene)malonate","Acta Crystallographica Section E","2005","61","1","o3","o5","10.1107/S1600536804030934","","","0.71073","MoKα","","0.1248","0.09","","","0.1882","0.2052","","","","","","1.224","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204965","6.993","0.004","7.543","0.004","11.058","0.006","83.53","0.009","85.171","0.009","79.017","0.009","567.8","0.5","273","2","273","2","","","","","","","","3","P -1","-P 1","2","","1-(1,8-Dihydroxy-6-methoxy-3-methylnaphthalen-2-yl)ethanone","","- C14 H14 O4 -","- C14 H14 O4 -","- C28 H28 O8 -","2","1","SJ6028","Ismail, Nor Hadiani; Alyahya, S. A. Illah.; Shaari, Khozirah; Yamin, Bohari M.","1-(1,8-Dihydroxy-6-methoxy-3-methylnaphthalen-2-yl)ethanone","Acta Crystallographica Section E","2005","61","1","o67","o68","10.1107/S1600536804030181","","","0.71073","MoKα","","0.101","0.066","","","0.135","0.148","","","","","","1.14","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204966","6.9541","0.0012","11.465","0.002","12.059","0.002","90","","113.547","0.003","90","","881.4","0.3","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","[Fe(bpy)(H~2~O)~4~](bdc)","catena-poly[[[tetraaquairon(II)]-μ-4,4'-bipyridine] benzene-1,4-dicarboxylate]","","- C18 H20 Fe N2 O8 -","- C18 H20 Fe N2 O8 -","- C36 H40 Fe2 N4 O16 -","2","0.5","SJ6033","Halder, Gregory J.; Kepert, Cameron J.","A three-dimensional hydrogen-bonded coordination framework: <i>catena</i>-poly[[[tetraaquairon(II)]-μ-4,4'-bipyridine] benzene-1,4-dicarboxylate]","Acta Crystallographica Section E","2005","61","1","m113","m114","10.1107/S1600536804032192","","","0.71073","MoKα","","0.024","0.0231","","","0.0638","0.0645","","","","","","1.134","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204967","12.998","0.006","15.198","0.006","8.543","0.004","90","","102.85","0.008","90","","1645.3","1.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","tert-Butyl 3-oxospiro[indan-1,4'-piperidine]-1'-carboxylate","","- C18 H23 N O3 -","- C18 H23 N O3 -","- C72 H92 N4 O12 -","4","1","SJ6034","Zheng, Pengwu; Li, Chunbao; Wang, Wei; Zhao, Bing","<i>tert</i>-Butyl 3-oxospiro[indan-1,4'-piperidine]-1'-carboxylate","Acta Crystallographica Section E","2005","61","1","o10","o11","10.1107/S1600536804031058","","","0.71073","MoKα","","0.1148","0.0495","","","0.1108","0.1497","","","","","","0.996","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204968","6.048","0.0001","10.1735","0.0003","15.5791","0.0004","90","","90","","90","","958.57","0.04","190","","190","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(2R,5S)-2-Trichloromethyl-3-oxa-1-azabicyclo[3,3,0]octane-4,8-dione","","- C7 H6 Cl3 N O3 -","- C7 H6 Cl3 N O3 -","- C28 H24 Cl12 N4 O12 -","4","1","SJ6035","Punzo, Francesco; Watkin, David J.; Pike, Richard; Moloney, Mark; Panchal, Terry","(2<i>R</i>,5<i>S</i>)-2-Trichloromethyl-3-oxa-1-azabicyclo[3.3.0]octane-4,8-dione","Acta Crystallographica Section E","2005","61","1","o42","o44","10.1107/S1600536804031605","","","0.71073","MoKα","","0.0297","0.0269","","0.0637","0.0618","0.0637","","","","","","0.9547","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204969","11.035","0.004","14.368","0.006","14.637","0.006","114.257","0.002","101.688","0.002","103.272","0.003","1940.6","1.3","130.15","","130.15","","","","","","","","","6","P -1","-P 1","2","","Bis[2-(4,6-diphenyl-2-pyridyl)pyridine-κ^2^N,N]copper(I) perchlorate dichloromethane solvate","","- C45 H34 Cl3 Cu N4 O4 -","- C45 H34 Cl3 Cu N4 O4 -","- C90 H68 Cl6 Cu2 N8 O8 -","2","1","SJ6036","Wei, Qiao-Hua; Yin, Gang-Qiang; Chen, Zhong-Ning","Bis[2-(4,6-diphenyl-2-pyridyl)pyridine-κ^2^<i>N</i>,<i>N</i>]copper(I) perchlorate dichloromethane solvate","Acta Crystallographica Section E","2005","61","1","m117","m118","10.1107/S1600536804032064","","","0.7107","MoKα","","0.0821","0.0554","","","0.1022","0.1156","","","","","","1.067","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2204970","3.8144","0.0005","12.175","0.002","18.806","0.003","90","","90","","90","","873.4","0.2","153","2","153","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","naphthalene-2,3-dicarbonitrile","","- C12 H6 N2 -","- C12 H6 N2 -","- C48 H24 N8 -","4","1","SJ6037","Tamil Selvi Pitchumony; Helen Stoeckli-Evans","An orthorhombic polymorph of naphthalene-2,3-dicarbonitrile","Acta Crystallographica Section E","2005","61","1","o40","o41","10.1107/S1600536804031757","","","0.71073","MoKα","","0.0435","0.0373","","","0.0991","0.1048","","","","","","0.869","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204971","12.561","0.003","12.949","0.003","6.855","0.001","90","","98.68","0.03","90","","1102.2","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Hexaaquamanganese(II) bis[(4-oxo-4H-pyridin-1-yl)acetate] dihydrate","","- C14 H28 Mn N2 O14 -","- C14 H28 Mn N2 O14 -","- C28 H56 Mn2 N4 O28 -","2","0.5","SJ6038","Zhu-Yan Zhang; Shan Gao; Li-Hua Huo; Hui Zhao; Jing-Gui Zhao","Hexaaquamanganese(II) bis[(4-oxo-4<i>H</i>-pyridin-1-yl)acetate] dihydrate","Acta Crystallographica Section E","2005","61","1","m85","m86","10.1107/S1600536804032076","","","0.71073","MoKα","","0.036","0.032","","","0.083","0.085","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204972","12.727","0.003","7.231","0.001","14.947","0.003","90","","108.79","0.03","90","","1302.2","0.5","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","","catena-Poly[[strontium(II)-di-μ-aqua-di-μ-9-hydroxy-fluorene-9-carboxylato] monohydrate]","","- C28 H24 O9 Sr -","- C28 H24 O9 Sr -","- C56 H48 O18 Sr2 -","2","1","SJ6041","Gao, Shan; Huo, Li Hua; Zhao, Hui; Ng, Seik Weng","<i>catena</i>-Poly[[strontium(II)-di-μ-aqua-di-μ-9-hydroxyfluorene-9-carboxylato] monohydrate]","Acta Crystallographica Section E","2005","61","1","m129","m131","10.1107/S1600536804032799","","","0.71073","MoKα","","0.061","0.047","","","0.109","0.115","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204973","8.4681","0.0007","8.9652","0.0008","14.3497","0.0012","75.198","0.002","87.918","0.001","65.395","0.001","954.57","0.14","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(dimethylsulfonyl)amino]- 1H-pyrazole-3-carbonitrile","","- C13 H9 Cl2 F3 N4 O4 S2 -","- C13 H9 Cl2 F3 N4 O4 S2 -","- C26 H18 Cl4 F6 N8 O8 S4 -","2","1","SU6147","Yang, Zhi-Ping; Zhong, Ping; Hu, Mao-Lin; Li, Shu-Yan; Tang, Ri-Yuan","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(dimethylsulfonyl)amino]-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","1","o116","o117","10.1107/S1600536804032428","","","0.71073","MoKα","","0.0538","0.049","","","0.1314","0.1355","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204974","34.57","0.02","14.686","0.007","11.74","0.004","90","","108.67","0.04","90","","5647","5","295","","295","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[1-(diphenylphosphino)-4-(diphenylphosphinoyl)butane-κP^1^]idodgold(I) monohydrate","","- C28 H30 Au I O2 P2 -","- C28 H30 Au I O2 P2 -","- C224 H240 Au8 I8 O16 P16 -","8","1","TK6200","Michael L. Williams; Deborah L. Slade; Sue E. Boyd; Peter C. Healy","Aurophilic and hydrogen-bonding interactions in [1-(diphenylphosphino)-4-(diphenylphosphinoyl)butane-κ<i>P</i>^1^]iodogold(I) monohydrate","Acta Crystallographica Section E","2005","61","1","m30","m32","10.1107/S160053680403137X","","","0.7107","MoKα","","0.0596","0.0329","","","0.0803","0.0899","","","","","","1.028","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204975","16.597","0.003","22.522","0.003","9.871","0.002","90","","90","","90","","3689.8","1.1","295","","295","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C32 H44 N6 O8 S2 -","- C32 H44 N6 O8 S2 -","- C128 H176 N24 O32 S8 -","4","1","TK6202","Ohba, Shigeru; Miyamoto, Hisakazu; Fujioka, Atsushi; Ikeuchi, Takahiro; Jean-Marie Lehn","<i>N,N</i>'-Bis(6-<i>tert</i>-butoxycarbonylamino-2-pyridyl)terephthalamide dimethyl sulfoxide disolvate","Acta Crystallographica Section E","2005","61","1","o182","o184","10.1107/S1600536804033367","","","0.7107","MoKα","","","0.061","","","","0.207","","","","","","0.95","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204976","13.0201","0.0014","7.793","0.0005","17.3305","0.0019","90","","94.373","0.009","90","","1753.3","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(5-methyl-3-phenylisoxazol-4-yl)benzenesulfonamide ethyl methyl ketone hemisolvate","","- C18 H18 N2 O3.5 S -","- C18 H18 N2 O3.5 S -","- C72 H72 N8 O14 S4 -","4","1","TK6204","Yathirajan, Hemmige S.; Narasegowda, Rajenahally S.; Nagarajab, Padmarajaiah; Bolte, Michael","A pseudopolymorph of valdecoxib","Acta Crystallographica Section E","2005","61","1","o179","o181","10.1107/S1600536804033598","","","0.71073","MoKα","","0.053","0.044","","","0.126","0.131","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204977","5.4656","0.0002","5.888","0.0002","7.8714","0.0003","90","","91.097","0.001","90","","253.267","0.016","294","1","294","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","disamarium sodium iridium hexaoxide","","- Ir Na O6 Sm2 -","- Ir Na O6 Sm2 -","- Ir2 Na2 O12 Sm4 -","2","0.5","WM6042","Mugavero III, Samuel J.; Puzdrjakova, Irina V.; Smith, Mark D.; zur Loye, Hans-Conrad","Sm~2~NaIrO~6~, a monoclinically distorted double perovskite","Acta Crystallographica Section E","2005","61","1","i3","i5","10.1107/S1600536804031836","","","0.71073","MoKα","","0.029","0.0262","","","0.0509","0.0519","","","","","","1.129","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204978","8.601","0.0017","9.5176","0.0019","6.7287","0.0013","90","","98.17","0.03","90","","545.23","0.19","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","Caesium vanadium diphosphorus heptasulfide","","- Cs P2 S7 V -","- Cs P2 S7 V -","- Cs2 P4 S14 V2 -","2","0.5","WM6043","Gutzmann, Andreas; Näther, Christian; Bensch, Wolfgang","CsVP~2~S~7~","Acta Crystallographica Section E","2005","61","1","i6","i8","10.1107/S1600536804031150","","","0.71073","MoKα","","0.0753","0.0456","","","0.0946","0.1001","","","","","","1.011","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204979","4.366","0.0005","4.366","0.0005","9.9726","0.001","90","","90","","90","","190.1","0.04","295","2","295","2","","","","","","","","3","I 4 m m","I 4 -2","107","lanthanum iron trigermanide","lanthanum iron trigermanide","","- Fe Ge3 La -","- Fe Ge3 La -","- Fe2 Ge6 La2 -","2","0.125","WM6044","Tkachuk, Andriy V.; Mar, Arthur","Lanthanum iron trigermanide, LaFeGe~3~","Acta Crystallographica Section E","2005","61","1","i1","i2","10.1107/S1600536804031253","","","0.71073","MoKα","","0.0313","0.0307","","","0.0749","0.0752","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204980","9.08","0.006","22.782","0.015","10.055","0.007","90","","109.476","0.01","90","","1961","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4'-{[2-(But-2-enyl)-4-chloro-5-formyl-1H-imidazol-1-yl]methyl}biphenyl- 2-carbonitrile","","- C22 H18 Cl N3 O -","- C22 H18 Cl N3 O -","- C88 H72 Cl4 N12 O4 -","4","1","WN6311","Malathy Sony, S. M.; Charles, P.; Ponnuswamy, M. N.; Yathirajan, H. S.; Nethaji, M.","4'-{[2-(But-2-enyl)-4-chloro-5-formyl-1<i>H</i>-imidazol-1-yl]methyl}biphenyl-2-carbonitrile","Acta Crystallographica Section E","2005","61","1","o25","o26","10.1107/S1600536804031186","","","0.71073","MoKα","","0.0817","0.0636","","","0.1695","0.1836","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204981","10.5872","0.0011","10.5872","0.0011","11.9509","0.0012","90","","90","","90","","1339.6","0.2","110","2","110","2","","","","","","","","5","P 43","P 4cw","78","","(S)-(Acetylacetonato-κ^2^O,O')[2-(1-aminoethyl)phenyl- κ^2^C^1^,N]palladium(II)","","- C13 H17 N O2 Pd -","- C13 H17 N O2 Pd -","- C52 H68 N4 O8 Pd4 -","4","1","WW6314","Calmuschi, Beatrice; Englert, Ulli","(<i>S</i>)-(Acetylacetonato-κ^2^<i>O</i>,<i>O</i>')[2-(1-aminoethyl)phenyl-κ^2^<i>C</i>^1^,<i>N</i>]palladium(II)","Acta Crystallographica Section E","2005","61","1","m164","m165","10.1107/S1600536804032842","","","0.71073","MoKα","","0.0207","0.0196","","","0.0471","0.0476","","","","","","1.083","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204982","10.951","0.005","10.951","0.005","12.442","0.007","90","","90","","90","","1492.1","1.3","110","2","110","2","","","","","","","","6","P 43","P 4cw","78","","(S)-2-(1-Aminoethyl)phenyl-κ^2^C^1^,N](hexafluoroacetylacetonato- κ^2^O,O')palladium(II)","","- C13 H9 F6 N O2 Pd -","- C13 H9 F6 N O2 Pd -","- C52 H36 F24 N4 O8 Pd4 -","4","1","WW6315","Calmuschi, Beatrice; Englert, Ulli","(<i>S</i>)-[2-(1-Aminoethyl)phenyl-κ^2^<i>C</i>^1^,<i>N</i>](hexafluoroacetylacetonato-κ^2^<i>O</i>,<i>O</i>')palladium(II)","Acta Crystallographica Section E","2005","61","1","m166","m167","10.1107/S1600536804032854","","","0.71073","MoKα","","0.0384","0.0367","","","0.0936","0.0946","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204983","23.283","0.012","8.824","0.006","15.562","0.01","90","","112.574","0.0013","90","","2952","3","293","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","rac-[2-(1-Aminoethyl)phenyl-κ^2^C^1^,N](hexafluoroacetylacetonato- κ^2^O,O')palladium(II)","","- C13 H11 F6 N O2 Pd -","- C13 H11 F6 N O2 Pd -","- C104 H88 F48 N8 O16 Pd8 -","8","1","WW6316","Calmuschi, Beatrice; Englert, Ulli","<i>rac</i>-[2-(1-Aminoethyl)phenyl-κ^2^<i>C</i>^1^,<i>N</i>](hexafluoroacetylacetonato-κ^2^<i>O</i>,<i>O</i>')palladium(II)","Acta Crystallographica Section E","2005","61","1","m168","m170","10.1107/S1600536804032866","","","0.71073","MoKα","","0.1029","0.0566","","","0.1224","0.1375","","","","","","0.991","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204984","7.373","0.0002","13.529","0.0003","17.268","0.0003","90","","90","","90","","1722.47","0.07","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Acetonitrilechlorobis(η^5^-cyclopentadienyl)vanadium(IV) tetrachloroiron(III)","","- C12 H13 Cl5 Fe N V -","- C12 H13 Cl5 Fe N V -","- C48 H52 Cl20 Fe4 N4 V4 -","4","1","WW6317","Honzíček, Jan; Císařová, Ivana; Vinklárek, Jaromír","Acetonitrilechlorotris(η^5^-cyclopentadienyl)vanadium(IV) tetrachloroferrate(III)","Acta Crystallographica Section E","2005","61","1","m149","m151","10.1107/S1600536804032830","","","0.71073","MoKα","","0.024","0.0221","","","0.0524","0.0535","","","","","","1.047","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204985","8.7861","0.0003","10.359","0.0009","17.9636","0.0007","99.192","0.007","90.389","0.002","105.774","0.003","1551.01","0.16","296.2","","","","","","","","","","","6","P -1","-P 1","2","","Acetonitrile(1,10-phenanthroline )(2,2':6',2''-terpyridine)ruthenium(II) hexafluorophosphate","","- C29 H22 F12 N6 P2 Ru -","- C29 H22 F12 N6 P2 Ru -","- C58 H44 F24 N12 P4 Ru2 -","2","1","WW6333","Naokazu Yoshikawa; Akio Ichimura; Nobuko Kanehisa; Yasushi Kai; Hiroshi Takashima; Keiichi Tsukahara","Acetonitrile(1,10-phenanthroline)(2,2':6',2''-terpyridine)ruthenium(II) bis(hexafluorophosphate)","Acta Crystallographica Section E","2005","61","1","m55","m56","10.1107/S1600536804031629","","","0.7107","MoKα","","","0.0888","","","","0.1719","","","","","","1.29","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204986","8.29","0.0002","8.381","0.0002","12.795","0.0003","73.882","0.0015","89.372","0.0014","62.465","0.0013","750.07","0.03","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","Dichloro{(η^5^,κN)- [(tert-butylamido)dimethylsilyl]cyclopentadienyl}titanium(IV)","","- C11 H19 Cl2 N Si Ti -","- C11 H19 Cl2 N Si Ti -","- C22 H38 Cl4 N2 Si2 Ti2 -","2","1","YA6226","Erben, Milan; Císařová, Ivana; Vinklárek, Jaromír; Dušek, Michal","{(η^5^,κ<i>N</i>)-[(<i>tert</i>-Butylamido)dimethylsilyl]cyclopentadienyl}dichlorotitanium(IV)","Acta Crystallographica Section E","2005","61","1","m50","m51","10.1107/S1600536804031332","","","0.71073","MoKα","","0.03","0.027","","","0.069","0.072","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204987","9.3049","0.0008","11.1595","0.0015","11.4248","0.0018","108.526","0.005","106.493","0.008","90.737","0.006","1071.6","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[[tetraaquazinc(II)]-μ-4,4'-bipyridine-κ^2^N:N'] 3-carboxylatophenoxyacetate monohydrate]","","- C19 H24 N2 O10 Zn -","- C19 H24 N2 O10 Zn -","- C38 H48 N4 O20 Zn2 -","2","1","YA6230","Zhao, Jing-Gui; Gu, Chang-Sheng; Huo, Li-Hua; Liu, Ji-Wei; Gao, Shan","<i>catena</i>-Poly[[[tetraaquazinc(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] 3-carboxylatophenoxyacetate monohydrate]","Acta Crystallographica Section E","2005","61","1","m76","m78","10.1107/S1600536804031344","","","0.71073","MoKα","","0.068","0.04","","","0.079","0.089","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204988","5.839","0.002","9.498","0.003","15.663","0.005","90","","92.76","0.02","90","","867.6","0.5","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","α-Cyano-4-hydroxy-cinnamic acid","2-Cyano-3-(4-hydroxyphenyl)propenoic acid","","- C10 H7 N O3 -","- C10 H7 N O3 -","- C40 H28 N4 O12 -","4","1","AC6150","Qian, Hui-Fen; Huang, Wei; Yao, Cheng","2-Cyano-3-(4-hydroxyphenyl)propenoic acid","Acta Crystallographica Section E","2005","61","2","o370","o372","10.1107/S1600536805001224","","","0.71073","MoKα","","0.0646","0.0579","","","0.1109","0.1145","","","","","","0.987","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204989","12.0293","0.0015","13.1788","0.0017","13.8881","0.0018","68.211","0.002","72.262","0.002","67.135","0.002","1850.4","0.4","90","2","90","2","","","","","","","","7","P -1","-P 1","2","[(CH~2~trpy)(bipy)CORu] 2PF~6~ acetone","cis-(2,2'-Bipyridyl-κ^2^N,N')carbonyl(η^3^-1-methylene-2,2':6',2''- terpyridyl-κ^3^C^1^,N,N')-ruthenium(II) bis(hexafluorophosphate) acetone disolvate","","- C33 H33 F12 N5 O3 P2 Ru -","- C33 H33 F12 N5 O3 P2 Ru -","- C66 H66 F24 N10 O6 P4 Ru2 -","2","1","AC6152","Gibson, Dorothy H.; Mashuta, Mark S.; Andino, Jose G.","<i>cis</i>-(2,2'-Bipyridyl-κ^2^<i>N</i>,<i>N</i>')carbonyl(η^3^-1-methylene-2,2':6',2''-terpyridyl-κ^3^<i>C</i>^1^,<i>N</i>,<i>N</i>')ruthenium(II) bis(hexafluorophosphate) acetone disolvate","Acta Crystallographica Section E","2005","61","2","m341","m343","10.1107/S160053680500142X","","","0.71073","MoKα","","0.035","0.034","","","0.088","0.089","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204990","7.1233","0.0003","17.3399","0.0007","9.5533","0.0004","90","","90","","90","","1180","0.08","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","","1-(6-Bromopyridin-2-yl)-3-methyl-3H-imidzol-1-ium bromide monoydrate","","- C9 H11 Br2 N3 O -","- C9 H11 Br2 N3 O -","- C36 H44 Br8 N12 O4 -","4","1","AC6155","Cheng, Bi Yun; Zeng, Jing Yao; Chiu, Pei Ling; Lee, Hon Man","1-(6-Bromopyridin-2-yl)-3-methyl-3<i>H</i>-imidazol-1-ium bromide monohydrate","Acta Crystallographica Section E","2005","61","2","o509","o510","10.1107/S1600536805002783","","","0.71073","MoKα","","0.0435","0.0346","","","0.0914","0.0971","","","","","","1.049","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204991","12.2994","0.0018","11.6445","0.0017","13.66","0.002","90","","113.909","0.002","90","","1788.5","0.5","293","2","293","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","Aqua[bis(5-bromosalicylidene)ethylenediaminato]chloromanganese(III)","aqua{4,4'-dibromo-2,2'-[1,2- ethanediylbis(nitrilomethylidyne)]diphenolato]chloromanganese(III)), [Mn(C~16~H~12~Br~2~N~2~O~2~)Cl(H~2~O)]","","- C16 H14 Br2 Cl Mn N2 O3 -","- C16 H14 Br2 Cl Mn N2 O3 -","- C64 H56 Br8 Cl4 Mn4 N8 O12 -","4","1","BR6176","Dang, Li-Long; Huo, Yong-Qian; Wang, Wei; Li, Jun","Aqua[bis(5-bromosalicylidene)ethylenediaminato]chloromanganese(III)","Acta Crystallographica Section E","2005","61","2","m332","m334","10.1107/S1600536805000942","","","0.71073","MoKα","","0.082","0.0726","","","0.1586","0.1641","","","","","","1.191","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204992","11.2152","0.0014","8.7122","0.001","29.091","0.003","90","","95.719","0.009","90","","2828.3","0.6","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-(3-Methoxysalicylideneamino)-1H-benzimidazole monohydrate","","- C15 H15 N3 O3 -","- C15 H15 N3 O3 -","- C120 H120 N24 O24 -","8","1","BT6567","Albayrak, Çiǧdem; Odabas̨oǧlu, Mustafa; Büyükgüngör, Orhan","2-(3-Methoxysalicylideneamino)-1<i>H</i>-benzimidazole monohydrate","Acta Crystallographica Section E","2005","61","2","o423","o424","10.1107/S1600536804033057","","","0.71073","MoKα","","0.073","0.032","","","0.058","0.062","","","","","","0.83","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204993","12.545","0.0009","8.4858","0.0008","13.2955","0.001","90","","111.755","0.006","90","","1314.56","0.19","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(3-Methoxysalicylideneamino)-1H-benzimidazole","","- C15 H13 N3 O2 -","- C15 H13 N3 O2 -","- C60 H52 N12 O8 -","4","1","BT6568","Odabas̨oǧlu, Mustafa; Albayrak, Çiǧdem; Büyükgüngör, Orhan","2-(3-Methoxysalicylideneamino)-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2005","61","2","o425","o426","10.1107/S1600536804033069","","","0.71073","MoKα","","0.083","0.039","","","0.076","0.087","","","","","","0.88","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204994","15.121","0.003","7.234","0.001","12.773","0.002","90","","114.95","0.01","90","","1266.8","0.4","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-Chloromethyl-4-(dimethylamino)-N,N-dimethylanilinium chloride","","- C11 H18 Cl2 N2 -","- C11 H18 Cl2 N2 -","- C44 H72 Cl8 N8 -","4","1","BT6570","Batsanov, Andrei S.; Collings, Jonathan C.; Marder, Todd B.","<i>N</i>-Chloromethyl-4-(dimethylamino)-<i>N,N</i>-dimethylanilinium chloride","Acta Crystallographica Section E","2005","61","2","o201","o202","10.1107/S1600536804033860","","","0.71073","MoKα","","0.0497","0.0372","","","0.1079","0.1146","","","","","","1.051","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204995","10.518","0.001","20.61","0.002","7.4612","0.0008","90","","90","","90","","1617.4","0.3","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3<i>R</i>,8<i>S</i>,9<i>R</i>)-10,11-Dihydrocinchonidine","","- C19 H24 N2 O -","- C19 H24 N2 O -","- C76 H96 N8 O4 -","4","1","BT6573","Lei, Xin-Xiang; Jing, Xiong; Zhang, An-Jiang; Ng, Seik Weng","10,11-Dihydrocinchonan-9-ol","Acta Crystallographica Section E","2005","61","2","o230","o232","10.1107/S1600536804034117","","","0.71073","MoKα","","0.079","0.072","","","0.156","0.16","","","","","","1.29","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204996","14.31","0.001","13.1112","0.0005","26.642","0.002","90","","90.007","0.005","90","","4998.6","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(-)-(3a'S,4'S,9b'S,1R,2S,5R)-4'-Ethyl-3a',4',5',7',8',9b'-hexahydro-2- isopropyl-5-methyl-2'-phenylspiro[cyclohexane-1,7'-dioxino[3,2-e]isoindole]- 1',3',9'-trione","","- C27 H33 N O5 -","- C27 H33 N O5 -","- C216 H264 N8 O40 -","8","4","BT6574","Schollmeyer, Dieter; Hoffmann, Ralf; Mattay, Jochen","(‒)-(3a'<i>S</i>,4'<i>S</i>,9b'<i>S</i>,1<i>R</i>,2<i>S</i>,5<i>R</i>)-4'-Ethyl-3a',4',5',7',8',9b'-hexahydro-2-isopropyl-5-methyl-2'-phenylspiro[cyclohexane-1,7'-dioxino[3,2-<i>e</i>]isoindole]-1',3',9'-trione","Acta Crystallographica Section E","2005","61","2","o290","o291","10.1107/S1600536805000140","","","1.54178","CuKα","","0.0712","0.0506","","","0.137","0.1541","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204997","32.264","0.003","7.6517","0.0007","12.0672","0.0011","90","","95.242","0.002","90","","2966.6","0.5","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","4-aminiumbenzoic acid 5-sulfosalicylate","4-carboxyanilinium 3-carboxy-4-hydroxybenzenesulfonate","","- C14 H13 N O8 S -","- C14 H13 N O8 S -","- C112 H104 N8 O64 S8 -","8","1","BT6575","Smith, Graham; Wermuth, Urs D.; White, Jonathan M.","The 1:1 proton-transfer compound of 5-sulfosalicylic acid with 4-aminobenzoic acid","Acta Crystallographica Section E","2005","61","2","o313","o316","10.1107/S1600536805000152","","","0.71073","MoKα","","0.0434","0.04","","","0.1141","0.1171","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204998","10.4278","0.0005","13.3828","0.0006","18.0857","0.0009","90","","90","","90","","2523.9","0.2","273","2","273","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","6,10-bis(acetyloxy)-8-isopropyl-4,4,11a-trimethyl-2-oxo-2,3,4,6,11,11a- hexahydrobenzo[5,6]cyclohepta[1,2-b]pyran-9-yl acetate","","- C26 H32 O8 -","- C26 H32 O8 -","- C104 H128 O32 -","4","1","BT6576","K. Ravikumar; B. Sridhar; M. Marathanda Murthy","Bharangin triacetate","Acta Crystallographica Section E","2005","61","2","o380","o382","10.1107/S1600536805000838","","","0.71073","MoKα","","0.055","0.0526","","","0.1271","0.1285","","","","","","1.246","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2204999","7.493","0.002","16.237","0.003","8.253","0.002","90","","92.91","0.03","90","","1002.8","0.4","295","2","295","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","Poly[tetrasilver(I)-di-μ-aqua-bis[μ~8~-3-carboxylato-4- hydroxybenzenesulfonato]","","- C14 H12 Ag4 O14 S2 -","- C14 H12 Ag4 O14 S2 -","- C28 H24 Ag8 O28 S4 -","2","0.5","BT6577","Gao, Shan; Zhu, Zhi-Bao; Huo, Li-Hua; Ng, Seik Weng","Poly[di-μ-aqua-bis(μ~8~-3-carboxylato-4-hydroxybenzenesulfonato)tetrasilver(I)]","Acta Crystallographica Section E","2005","61","2","m282","m284","10.1107/S1600536805000516","","","0.71073","MoKα","","0.029","0.026","","","0.066","0.068","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205000","8.309","0.001","11.264","0.002","12.611","0.002","112.743","0.006","97.608","0.007","95.516","0.007","1064.8","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Poly[[triaquadisilver(I)]bis[μ~4~-3-carboxy-4-hydroxybenzenesulfonato] monohydrate]","","- C14 H18 Ag2 O16 S2 -","- C14 H18 Ag2 O16 S2 -","- C28 H36 Ag4 O32 S4 -","2","1","BT6578","Gao, Shan; Zhu, Zhi-Bao; Huo, Li-Hua; Ng, Seik Weng","Poly[[triaquabis(μ~4~-3-carboxy-4-hydroxybenzenesulfonato)disilver(I)] monohydrate]","Acta Crystallographica Section E","2005","61","2","m279","m281","10.1107/S1600536805000504","","","0.71073","MoKα","","0.031","0.028","","","0.072","0.074","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205001","20.517","0.003","11.689","0.002","13.686","0.003","90","","124.33","0.03","90","","2710.5","1.3","295","2","295","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Dipyridinium diaquatetrachlorotin(IV) 1,5-naphthalenedisulfonate","","- C20 H22 Cl4 N2 O8 S2 Sn -","- C20 H22 Cl4 N2 O8 S2 Sn -","- C80 H88 Cl16 N8 O32 S8 Sn4 -","4","0.5","BT6579","Gao, Shan; Huo, Li-Huo; Zhao, Hui; Ng, Seik Weng","Dipyridinium diaquatetrachlorotin(IV) 1,5-naphthalenedisulfonate","Acta Crystallographica Section E","2005","61","2","m285","m287","10.1107/S1600536805000528","","","0.71073","MoKα","","0.0268","0.0258","","","0.0731","0.0739","","","","","","1.009","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205002","13.199","0.003","5.699","0.001","11.039","0.002","90","","112.79","0.03","90","","765.5","0.3","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[bis[aquamercury(I)]-di-μ-aqua-μ-1,5-naphthalenedisulfonato]","","- C10 H14 Hg2 O10 S2 -","- C10 H14 Hg2 O10 S2 -","- C20 H28 Hg4 O20 S4 -","2","0.5","BT6580","Zhu, Zhi-Biao; Shan Gao; Huo, Li-Hua; Ng, Seik Weng","Poly[bis[aquamercury(I)]-di-μ-aqua-μ-1,5-naphthalenedisulfonato]","Acta Crystallographica Section E","2005","61","2","m288","m289","10.1107/S160053680500053X","","","0.71073","MoKα","","0.054","0.046","","","0.117","0.136","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205003","8.16","0.005","8.451","0.005","11.629","0.005","97.921","0.005","108.234","0.005","110.548","0.005","685","0.7","293","2","293","2","","","","","","","","4","P 1","P 1","1","","4-(2,6-dimethylphenoxy)phthalonitrile","","- C16 H12 N2 O -","- C16 H12 N2 O -","- C32 H24 N4 O2 -","2","2","BT6581","Büyükgüngör, Orhan; Kos̨ar, Bas̨ak; Akdemir, Nesuhi; Ağar, Erbil; Gümrükçüoğlu, Ismail","4-(2,6-Dimethylphenoxy)phthalonitrile","Acta Crystallographica Section E","2005","61","2","o335","o336","10.1107/S1600536805001078","","","0.71069","MoKα","","0.042","0.0388","","","0.1102","0.1128","","","","","","1.027","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205004","6.6691","0.0004","7.8721","0.0007","9.7547","0.0006","90","","94.404","0.007","90","","510.61","0.06","150","2","150","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","Poly[di-μ~4~-acetato-di-μ~2~-azido-copper(II)disodium(II)]","","- C4 H6 Cu N6 Na2 O4 -","- C4 H6 Cu N6 Na2 O4 -","- C8 H12 Cu2 N12 Na4 O8 -","2","0.5","BT6583","Näther, Christian; Greve, Jan; Jeß, Inke","Poly[di-μ~4~-acetato-di-μ~2~-azido-copper(II)disodium(I)] at 150K","Acta Crystallographica Section E","2005","61","2","m314","m316","10.1107/S160053680500108X","","","0.71073","MoKα","","0.0444","0.0392","","","0.1014","0.1046","","","","","","1.089","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205005","20.454","0.003","15.749","0.003","14.603","0.003","90","","120.05","0.004","90","","4071.8","1.3","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[μ-4'-(2-pyridyl)-2,2':6',2''-terpyridine]disilver(I) bis(hexafluorophosphate)","","- C40 H28 Ag2 F12 N8 P2 -","- C40 H28 Ag2 F12 N8 P2 -","- C160 H112 Ag8 F48 N32 P8 -","4","0.5","BT6584","Hou, Lei; Li, Dan; Ng, Seik Weng","Bis[μ-4'-(2-pyridyl)-2,2':6',2''-terpyridine]disilver(I) bis(hexafluorophosphate)","Acta Crystallographica Section E","2005","61","2","m404","m406","10.1107/S1600536805002618","","","0.71073","MoKα","","0.0846","0.0681","","","0.1942","0.2028","","","","","","1.168","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205006","11.4626","0.0006","12.0032","0.0009","16.7541","0.0009","90","","90","","90","","2305.2","0.2","150","2","150","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","Poly[tetra-μ~2~-azido-di-μ~2~-4,4'-bipyridine-sodium(I)iron(III)]","","- C20 H16 Fe N16 Na -","- C20 H16 Fe N16 Na -","- C80 H64 Fe4 N64 Na4 -","4","0.5","BT6585","Näther, Christian; Greve, Jan; Jeß, Inke","Poly[tetra-μ~2~-azido-di-μ~2~-4,4'-bipyridine-sodium(I)iron(III)]","Acta Crystallographica Section E","2005","61","2","m317","m319","10.1107/S1600536805001091","","","0.71073","MoKα","","0.032","0.029","","","0.0739","0.0753","","","","","","1.085","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205007","10.6219","0.0007","7.6529","0.0003","11.1018","0.0007","90","","104.804","0.007","90","","872.49","0.09","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[[(2-iodopyrazine-κN^4^)copper(I)]-μ~3~-thiocyanato-κ^3^N:S:S]","","- C5 H3 Cu I N3 S -","- C5 H3 Cu I N3 S -","- C20 H12 Cu4 I4 N12 S4 -","4","1","BT6587","Näther, Christian; Wriedt, Mario; Jeß, Inke","Poly[[(2-iodopyrazine-κ<i>N</i>^4^)copper(I)]-μ~3~-thiocyanato-κ^3^<i>N</i>:<i>S</i>:<i>S</i>]","Acta Crystallographica Section E","2005","61","2","m329","m331","10.1107/S1600536805001327","","","0.71073","MoKα","","0.0488","0.0372","","","0.08","0.0856","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205008","15.422","0.002","3.8275","0.0006","19.282","0.003","90","","103.29","0.01","90","","1107.7","0.3","93.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H16 N4 O4 -","- C34 H16 N4 O4 -","- C68 H32 N8 O8 -","2","0.5","BT6588","Mizuguchi, Jin; Hino, Kazuyuki; Sato, Kazuyuki; Takahashi, Hiroo; Suzuki, Shigeru","<i>N,N</i>'-Di-3-pyridylperylene-3,4:9,10-bis(dicarboximide)","Acta Crystallographica Section E","2005","61","2","o434","o436","10.1107/S1600536805001996","","","1.5418","CuKα","","","0.0391","","","","0.0731","","","","","","0.94","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205009","17.599","0.001","7.1705","0.0005","20.679","0.002","90","","111.004","0.005","90","","2436.2","0.3","93.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C34 H16 N4 O4 -","- C34 H16 N4 O4 -","- C136 H64 N16 O16 -","4","1","BT6589","Mizuguchi, Jin; Hino, Kazuyuki; Sato, Kazuyuki; Takahashi, Hiroo; Suzuki, Shigeru","<i>N,N</i>'-Di-2-pyridylperylene-3,4:9,10-bis(dicarboximide)","Acta Crystallographica Section E","2005","61","2","o437","o439","10.1107/S160053680500200X","","","1.5418","CuKα","","","0.0624","","","","0.0452","","","","","","1.889","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205010","21.232","0.002","15.89","0.002","6.9311","0.0008","90","","90","","90","","2338.4","0.5","93.2","","","","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C34 H16 N4 O4 -","- C34 H16 N4 O4 -","- C136 H64 N16 O16 -","4","0.5","BT6590","Hino, Kazuyuki; Sato, Kazuyuki; Takahashi, Hiroo; Suzuki, Shigeru; Mizuguchi, Jin","<i>N,N</i>'-Di-4-pyridylperylene-3,4:9,10-bis(dicarboximide)","Acta Crystallographica Section E","2005","61","2","o440","o441","10.1107/S1600536805002011","","","1.5418","CuKα","","","0.0737","","","","0.1475","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205011","15.795","0.003","7.917","0.002","9.829","0.002","90","","90.65","0.03","90","","1229","0.5","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","poly[[diaquacalcium(II)]-μ~4~-benzene-1,3-dioxyacetato]","","- C10 H12 Ca O8 -","- C10 H12 Ca O8 -","- C40 H48 Ca4 O32 -","4","1","BT6591","Gao, Shan; Huo, Li-Hua; Liu, Ji-Wei; Ng, Seik Weng","Twinned poly[[diaquacalcium(II)]-μ~4~-benzene-1,3-dioxyacetato]","Acta Crystallographica Section E","2005","61","2","m407","m409","10.1107/S1600536805002588","","","0.71073","MoKα","","0.075","0.061","","","0.166","0.203","","","","","","1.11","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205012","13.341","0.003","13.981","0.003","14.185","0.003","70.33","0.01","75.8","0.01","66.64","0.01","2268","0.9","275","2","295","2","","","","","","","","6","P -1","-P 1","2","","Tetrakis(μ~2~-4-tolylthioacetato-κ^2^O:O')bis[(pyridine-κN)copper(II)]","","- C46 H46 Cu2 N2 O8 S4 -","- C46 H46 Cu2 N2 O8 S4 -","- C92 H92 Cu4 N4 O16 S8 -","2","1","BT6592","Gao, Shan; Huo, Li-Hua; Shu, Hong; Ng, Seik Weng","Tetrakis(μ~2~-4-tolylthioacetato-κ^2^<i>O</i>:<i>O</i>')bis[(pyridine-κ<i>N</i>)copper(II)]","Acta Crystallographica Section E","2005","61","2","m389","m391","10.1107/S1600536805002412","","","0.71073","MoKα","","0.053","0.037","","","0.106","0.12","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205013","20.61","0.004","12.246","0.002","12.907","0.003","90","","90","","90","","3257.6","1.1","295","2","295","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","Aquabis(3,5-dicarboxybenzoato-κO)bis(hexamethylenetetramine-κN)nickel(II)","","- C30 H36 N8 Ni O13 -","- C30 H36 N8 Ni O13 -","- C120 H144 N32 Ni4 O52 -","4","0.5","BT6593","Gao, Shan; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","Aquabis(3,5-dicarboxybenzoato-κ<i>O</i>)bis(hexamethylenetetramine-κ<i>N</i>)nickel(II)","Acta Crystallographica Section E","2005","61","2","m392","m393","10.1107/S1600536805002424","","","0.71073","MoKα","","0.059","0.047","","","0.115","0.122","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205014","13.3078","0.0019","7.9299","0.0011","15.168","0.002","90","","90","","90","","1600.7","0.4","273","2","273","2","","","","","","","","3","P n a 21","P 2c -2n","33","","15,18-dimethyl-5-dioxo-14- oxapentacyclo[11.4.1.0^2,15^.0^4,13^.0^6,11^]octadeca-3,6,8,10-tetraene- 18-carbaldehyde","","- C20 H18 O4 -","- C20 H18 O4 -","- C80 H72 O16 -","4","1","BT6594","K. Ravikumar; B. Sridhar; S. Venkat Reddy; U. Sampath Kumar; J. Madhusudana Rao","The natural naphthoquinone sterekunthal-B","Acta Crystallographica Section E","2005","61","2","o494","o496","10.1107/S160053680500259X","","","0.71073","MoKα","","0.0399","0.0386","","","0.1027","0.1049","","","","","","1.026","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205015","7.9612","0.0002","11.802","0.0003","15.3935","0.0004","90","","99.614","0.001","90","","1426.03","0.06","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[bis[aqua(1,10-phenanthroline)zinc(II)]-μ~4~-1,2,4,5- benzenetetracarboxylato]","","- C34 H22 N4 O10 Zn2 -","- C34 H22 N4 O10 Zn2 -","- C68 H44 N8 O20 Zn4 -","2","0.5","BV6008","Liu, Fu-Chen; Wang, Xiu-Li; Li, Jian-Rong; Ng, Seik Weng","<i>catena</i>-Poly[bis[aqua(1,10-phenanthroline)zinc(II)]-μ~4~-benzene-1,2,4,5-tetracarboxylato]","Acta Crystallographica Section E","2005","61","2","m299","m301","10.1107/S1600536805000711","","","0.71073","MoKα","","0.048","0.04","","","0.1","0.105","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205016","5.0587","0.0003","13.4343","0.0007","11.4989","0.0006","90","","96.149","0.001","90","","776.97","0.07","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Hexaaquamanganese(II) 5,5'-(1,4-phenylene)bis-tetrazolate","","- C8 H16 Mn N8 O6 -","- C8 H16 Mn N8 O6 -","- C16 H32 Mn2 N16 O12 -","2","0.5","BV6009","Ma, Zhi-Jie; Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun","Hexaaquamanganese(II) 5,5'-(1,4-phenylene)ditetrazolate","Acta Crystallographica Section E","2005","61","2","m361","m363","10.1107/S1600536805001418","","","0.71073","MoKα","","0.0304","0.029","","","0.0797","0.0807","","","","","","1.089","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205017","12.642","0.003","12.987","0.003","14.501","0.003","86.15","0.03","75.77","0.03","70.17","0.03","2170.6","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Tris(1,10-phenanthroline-κN,N')manganese(II) bis(perchlorate) chloroform disolvate","","- C38 H26 Cl8 Mn N6 O8 -","- C38 H26 Cl8 Mn N6 O8 -","- C76 H52 Cl16 Mn2 N12 O16 -","2","1","BV6010","Cui, Guang-Hua; Li, Jian-Rong","Tris(1,10-phenanthroline-κ<i>N</i>,<i>N</i>')manganese(II) bis(perchlorate) chloroform disolvate","Acta Crystallographica Section E","2005","61","2","m349","m350","10.1107/S160053680500156X","","","0.71073","MoKα","","0.1129","0.0729","","","0.1849","0.205","","","","","","1.005","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205018","11.75","0.006","13.512","0.007","14.068","0.007","65.43","0.006","86.264","0.007","81.663","0.007","2009.8","1.8","571","2","571","2","","","","","","","","5","P -1","-P 1","2","","Tetrakis(μ-N-acetyl-N-phenylglycinato-κ^2^O,O')bis[(N-acetyl-N- phenylglycinato-κ^3^O,O,O)(1,10-phenanthroline-κ^2^N,N')cerium(III)] dihydrate","","- C84 H80 Ce2 N10 O20 -","- C84 H80 Ce2 N10 O20 -","- C84 H80 Ce2 N10 O20 -","1","0.5","CF6392","Fu, Ai-Yun; Fu, Shi-Zhou; Yu, Tao","Tetrakis(μ-<i>N</i>-acetyl-<i>N</i>-phenylglycinato-κ^2^<i>O,O</i>')bis[(<i>N</i>-acetyl-<i>N</i>-phenylglycinato-κ^3^<i>O,O,O</i>)(1,10-phenanthroline-κ^2^<i>N,N</i>')cerium(III)] dihydrate","Acta Crystallographica Section E","2005","61","2","m223","m225","10.1107/S1600536804034014","","","0.71073","MoKα","","0.0768","0.0468","","","0.1031","0.1226","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205019","11.163","0.004","6.651","0.002","21.519","0.007","90","","100.015","0.006","90","","1573.3","0.9","297","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,4-(Methylenedioxy)benzaldehyde benzoylhydrazone ethanol solvate","","- C17 H18 N2 O4 -","- C17 H18 N2 O4 -","- C68 H72 N8 O16 -","4","1","CF6394","Ai-Xiu Li; Li-Li Liu","3,4-(Methylenedioxy)benzaldehyde benzoylhydrazone ethanol solvate","Acta Crystallographica Section E","2005","61","2","o277","o279","10.1107/S1600536805000437","","","0.71073","MoKα","","0.0906","0.0451","","","0.1053","0.1364","","","","","","1.064","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205020","6.4862","0.0001","27.931","0.0005","6.4787","0.0001","90","","109.894","0.0007","90","","1103.68","0.03","120","","120","","","","","","","","","4","P 1 21 1","P 2yb","4","","2-Azido-2-deoxy-3,4-O-isopropylidene-2-C-methyl-D-ribono-1,5-lactone","","- C9 H13 N3 O4 -","- C9 H13 N3 O4 -","- C36 H52 N12 O16 -","4","2","CF6395","Punzo, Francesco; Watkin, David J.; Jenkinson, Sarah F.; da Cruz, Filipa P.; Fleet, George W. J.","2-Azido-2-deoxy-3,4-<i>O</i>-isopropylidene-2-<i>C</i>-methyl-<small>D</small>-ribono-1,5-lactone","Acta Crystallographica Section E","2005","61","2","o511","o512","10.1107/S160053680500067X","","","0.71073","MoKα","","0.063","0.0446","","0.1018","0.0953","0.1018","","","","","","0.9941","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205021","9.5559","0.0002","13.8885","0.0005","15.2346","0.0005","90","","91.557","0.002","90","","2021.15","0.11","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetra-n-butylammonium hexafluorophosphate","","- C16 H36 F6 N P -","- C16 H36 F6 N P -","- C64 H144 F24 N4 P4 -","4","1","CF6396","Zafra Stein; Israel Goldberg","Tetra-<i>n</i>-butylammonium hexafluorophosphate at 110K","Acta Crystallographica Section E","2005","61","2","o272","o274","10.1107/S1600536805000462","","","0.71073","MoKα","","0.074","0.0483","","","0.1169","0.1301","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205022","7.74","0.002","5.6749","0.0013","11.484","0.002","90","","101.055","0.002","90","","495.06","0.19","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","p-Phenylene diacetate","","- C10 H10 O4 -","- C10 H10 O4 -","- C20 H20 O8 -","2","0.5","CF6399","Juan Men; Fengcai Gu; Huifang Sun","<i>p</i>-Phenylene diacetate","Acta Crystallographica Section E","2005","61","2","o471","o472","10.1107/S1600536805002199","","","0.71073","MoKα","","0.0632","0.0393","","","0.1052","0.1162","","","","","","1.072","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205023","6.635","0.005","9.239","0.007","9.359","0.008","115.53","0.03","107.51","0.02","95.6","0.02","476.2","0.7","296.1","","296.1","","","","","","","","","4","P -1","-P 1","2","","Diaquabis(μ-4-hydroxybenzenecarboxylato-κ^2^O,O')disilver(I)(Ag—Ag) tetrahydrate","","- C14 H22 Ag2 O12 -","- C14 H22 Ag2 O12 -","- C14 H22 Ag2 O12 -","1","0.5","CF6400","Wang, Yue; Okabe, Nobuo","Diaquabis(μ-4-hydroxybenzenecarboxylato-κ^2^<i>O</i>,<i>O</i>')disilver(I)(<i>Ag</i>—<i>Ag</i>) tetrahydrate","Acta Crystallographica Section E","2005","61","2","m382","m384","10.1107/S1600536805002217","","","0.71075","MoKα","","0.0276","0.0249","","","0.064","0.0653","","","","","","1.073","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205024","24.26","0.001","9.0818","0.0005","15.0164","0.0008","90","","115.516","0.001","90","","2985.8","0.3","90","1","90","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(tetrahydroborate-H,H')-bis(triphenylphosphine)-copper(I)","","- C36 H34 B Cu P2 -","- C36 H34 B Cu P2 -","- C144 H136 B4 Cu4 P8 -","4","0.5","CI6482","Moncol, Jan; Gembicky, Milan; Coppens, Philip","(Tetrahydroborato)bis(triphenylphosphine)copper(I): a redetermination at 90K","Acta Crystallographica Section E","2005","61","2","m242","m243","10.1107/S1600536804030314","","","0.71069","MoKα","","0.0245","0.0225","","","0.0633","0.0643","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205025","10.472","0.003","13.526","0.004","14.963","0.005","113.44","0.005","100.681","0.006","104.926","0.006","1777.1","1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","(8E)-8-benzylidene-3,4,5,6,7,8-hexahydro-4-phenylquinazoline-2(1H)-thione","","- C21 H20 N2 S -","- C21 H20 N2 S -","- C84 H80 N8 S4 -","4","2","CI6498","Zhang, Xiu-Ling; Liang, Zu-Pei","(8<i>E</i>)-8-Benzylidene-3,4,5,6,7,8-hexahydro-4-phenylquinazoline-2(1<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","2","o217","o219","10.1107/S1600536804033859","","","0.71073","MoKα","","0.1142","0.0479","","","","0.129","","","","","","1.002","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205026","13.8103","0.0009","11.5082","0.0007","15.0809","0.0009","90","","113.236","0.001","90","","2202.4","0.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ethyl 3-hydroxy-2-naphthoate","","- C13 H12 O3 -","- C13 H12 O3 -","- C104 H96 O24 -","8","2","CI6506","Jin, Cheng-Zhi; Jin, Long-Fei","Ethyl 3-hydroxy-2-naphthoate","Acta Crystallographica Section E","2005","61","2","o275","o276","10.1107/S1600536805000176","","","0.71073","MoKα","","0.121","0.0636","","","0.1221","0.1467","","","","","","1.043","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205027","7.7115","0.0007","18.8101","0.0016","15.2619","0.0013","90","","97.023","0.001","90","","2197.2","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[[(1,10-phenanthroline)nickel(II)]-μ-4,4'-oxydibenzoato] 0.25-hydrate]","","- C26 H16.5 N2 Ni O5.25 -","- C26 H16 N2 Ni O5.25 -","- C104 H64 N8 Ni4 O21 -","4","1","CI6507","Hong-Ping Xiao; Jia-Guo Wang; Xin-Hua Li; Mao-Lin Hu; Wei-Bing Zhang","<i>catena</i>-Poly[[[(1,10-phenanthroline)nickel(II)]-μ-4,4'-oxydibenzoato] 0.25-hydrate]","Acta Crystallographica Section E","2005","61","2","m257","m259","10.1107/S1600536805000218","","","0.71073","MoKα","","0.0709","0.05","","","0.1191","0.1268","","","","","","1.024","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205028","8.3212","0.0008","8.9609","0.0009","9.8813","0.001","97.07","0.002","101.475","0.002","108.355","0.002","671.54","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H19 N2 O5 P -","- C10 H19 N2 O5 P -","- C20 H38 N4 O10 P2 -","2","1","CI6511","He-Jiao Hu; Cui-Rong Sun; Hong Zhang; Yuan-Jiang Pan","<i>N</i>-(Dicyclopropylmethylamino)-4,5-dihydro-1,3-oxazolium dihydrogenphosphate","Acta Crystallographica Section E","2005","61","2","o413","o415","10.1107/S1600536805001571","","","0.71073","MoKα","","0.0325","0.0298","","","0.0827","0.0843","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205029","8.2642","0.0013","11.4273","0.0018","12.099","0.0019","90","","94.709","0.002","90","","1138.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-Methoxyphenyl)-3-(1H-1,2,4-triazol-1-yl)propan-1-one","","- C12 H13 N3 O2 -","- C12 H13 N3 O2 -","- C48 H52 N12 O8 -","4","1","CI6512","Jun Wan; Chun-Li Li; Xue-Mei Li; Shu-Sheng Zhang","1-(4-Methoxyphenyl)-3-(1<i>H</i>-1,2,4-triazol-1-yl)propan-1-one","Acta Crystallographica Section E","2005","61","2","o307","o308","10.1107/S1600536805000681","","","0.71073","MoKα","","0.044","0.0397","","","0.1076","0.1122","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205030","9.111","0.003","18.921","0.007","16.536","0.005","90","","92.368","0.006","90","","2848.2","1.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3,3'-(p-phenylenedimethylene)bis(1-methylimiadzolium)‒tetrachloroargentate(I) (3/2)","","- C48 H60 Ag2 Cl8 N12 -","- C48 H60 Ag2 Cl8 N12 -","- C96 H120 Ag4 Cl16 N24 -","2","0.5","CI6513","Wang, Jun-Wen; Xu, Feng-Bo; Li, Qing-Shan; Song, Hai-Bin; Zhang, Zheng-Zhi","3,3'-(<i>p</i>-Phenylenedimethylene)bis(1-methylimidazolium)‒tetrachloroargentate(I) (3/2)","Acta Crystallographica Section E","2005","61","2","m367","m369","10.1107/S1600536805001583","","","0.71073","MoKα","","0.0951","0.0506","","","0.1156","0.1315","","","","","","1.074","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205031","4.6082","0.0001","12.965","0.004","18.105","0.005","100.074","0.005","92.978","0.005","96.526","0.005","1055.3","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","3-Geranyloxy-6-methyl-1,8-dihydroxyanthraquinone","3-(3,7-Dimethylocta-2,6-dienyloxy)-1,8-dihydroxy-6-methyl-9,10-anthraquinone","","- C25 H26 O5 -","- C25 H26 O5 -","- C50 H52 O10 -","2","1","CI6514","Nawong Boonnak; Suchada Chantrapromma; Hoong-Kun Fun; Shazia Anjum; Shamsher Ali; Atta-ur-Rahman; Chatchanok Karalai","3-(3,7-Dimethylocta-2,6-dienyloxy)-1,8-dihydroxy-6-methyl-9,10-anthraquinone","Acta Crystallographica Section E","2005","61","2","o410","o412","10.1107/S1600536805001674","","","0.71073","MoKα","","0.1426","0.0856","","","0.1924","0.2192","","","","","","1.065","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205032","7.8361","0.0006","4.009","0.0003","21.572","0.002","90","","97.586","0.007","90","","671.75","0.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,5-methylenedithio-1,3-dithiol-2-one","","- C4 H2 O S4 -","- C4 H2 O S4 -","- C16 H8 O4 S16 -","4","1","CI6515","Xue, Gang; Yu, Wentao; Fang, Qi","4,5-Methylenedithio-1,3-dithiol-2-one","Acta Crystallographica Section E","2005","61","2","o429","o430","10.1107/S160053680500173X","","","0.71073","MoKα","","0.0348","0.0263","","","0.0634","0.0677","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205033","22.779","0.003","11.7073","0.0012","16.8032","0.0016","90","","124.978","0.006","90","","3671.7","0.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3-{[(1Z)-(3-Methyl-5-oxo-1-phenyl-1,5-dihydropyrazol-4- ylidene)(phenyl)methyl]amino}propionic acid","","- C20 H19 N3 O3 -","- C20 H19 N3 O3 -","- C160 H152 N24 O24 -","8","1","CI6517","Hai-Zhen Xu; Xin Zhang; Gui-Sheng Yu","3-{[(1<i>Z</i>)-(3-Methyl-5-oxo-1-phenyl-1,5-dihydropyrazol-4-ylidene)(phenyl)methyl]amino}propionic acid","Acta Crystallographica Section E","2005","61","2","o456","o458","10.1107/S1600536805002023","","","0.71073","MoKα","","0.0673","0.0396","","","0.1045","0.1182","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205034","15.113","0.002","15.692","0.002","16.806","0.002","90","","90","","90","","3985.6","0.9","293","2","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","(1,4,7,10,13,16-hexaoxacyclooctadecane-κ^6^O)potassium chlorochromate","","- C12 H24 Cl Cr K O9 -","- C12 H24 Cl Cr K O9 -","- C96 H192 Cl8 Cr8 K8 O72 -","8","1","CV6410","Kotlyar, Sergei A.; Zubatyuk, Roman I.; Shishkin, Oleg V.; Chuprin, Gennady N.; Kiriyak, Andrey V.; Kamalov, Gerbert L.","(18-Crown-6)potassium chlorochromate","Acta Crystallographica Section E","2005","61","2","m293","m295","10.1107/S1600536805000085","","","0.71073","MoKα","","","0.0816","","","","0.2526","","","","","","0.909","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205035","7.2372","0.0008","8.1279","0.0009","9.1779","0.001","69.491","0.002","78.012","0.002","84.999","0.002","494.57","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Diaqua bis(6-nitro-3H-benzimidazol) copper(II) dinitrate","","- C14 H14 Cu N8 O12 -","- C14 H14 Cu N8 O12 -","- C14 H14 Cu N8 O12 -","1","0.5","CV6433","Cai-Feng Ding; Shu-Sheng Zhang; Bing-Qing Tian; Xue-Mei Li; Hong Xu; Ping-Kai Ouyang","Diaquabis(5-nitro-1<i>H</i>-benzimidazole-κ<i>N</i>^3^)copper(II) dinitrate","Acta Crystallographica Section E","2005","61","2","m235","m236","10.1107/S1600536804034300","","","0.71073","MoKα","","0.0317","0.03","","","0.0812","0.0829","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205036","9.3325","0.0008","10.7217","0.0009","14.2612","0.0012","77.4","0.001","71.961","0.001","65.437","0.001","1227.44","0.18","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[[(4'-phenyl-2,2':6',2''-terpyridine-κ^3^N,N',N'')zinc(II)]- μ-terephthalato-κ^2^O:O'] monohydrate]","","- C29 H21 N3 O5 Zn -","- C29 H21 N3 O5 Zn -","- C58 H42 N6 O10 Zn2 -","2","1","CV6436","Tu, Qi-Dong; Yin, Ye-Gao; He, Jun; Xiang, Jing; Li, Dan; Ng, Seik Weng","<i>catena</i>-Poly[[[(4'-phenyl-2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')zinc(II)]-μ-terephthalato-κ^2^<i>O</i>:<i>O</i>'] monohydrate]","Acta Crystallographica Section E","2005","61","2","m254","m256","10.1107/S1600536805000127","","","0.71073","MoKα","","0.0813","0.0592","","","0.136","0.1512","","","","","","1.115","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205037","16.3545","0.0004","10.8868","0.0003","18.4635","0.0005","90","","104.102","0.002","90","","3188.32","0.15","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(±)-1-[(cyclohexyloxy)carbonyloxy]ethyl 2-ethoxy-1-{[2'-(1H-tetrazol-5-yl)biphenyl-4-yl]methyl}-1H-benzimidazole- 7-carboxylate","","- C33 H34 N6 O6 -","- C33 H34 N6 O6 -","- C132 H136 N24 O24 -","4","1","CV6437","Fernández, Daniel; Vega, Daniel; Ellena, Javier A.","Candesartan cilexetil, an antihypertensive agent containing an extended double ester chain","Acta Crystallographica Section E","2005","61","2","o309","o312","10.1107/S1600536805000097","","","0.71073","MoKα","","0.1176","0.0877","","","0.2531","0.2917","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205038","10.8731","0.0009","18.7861","0.0014","20.5836","0.0019","90","","90","","90","","4204.5","0.6","293","2","293","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","","4-Benzoyl-1,5-diphenyl-1H-pyrazole-3-carboxylic acid methanol solvate","","- C24 H20 N2 O4 -","- C24 H20 N2 O4 -","- C192 H160 N16 O32 -","8","1","CV6438","Yıldırım, İsmail; Özdemir, Namık; Akçamur, Yunus; Dinçer, Muharrem; Andaç, Ömer","4-Benzoyl-1,5-diphenyl-1<i>H</i>-pyrazole-3-carboxylic acid methanol solvate","Acta Crystallographica Section E","2005","61","2","o256","o258","10.1107/S1600536804034348","","","0.71073","MoKα","","0.1046","0.043","","","0.0738","0.0792","","","","","","1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205039","10.216","0.002","15.445","0.004","13.01","0.006","90","","106.37","0.02","90","","1969.6","1.1","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","tert-butylmerocyanine","4-[(1-Methyl-1,4-dihydropyridinylidene)ethylidene]-2,6-di-tert-butyl-2,5- cyclohexadien-1-one","","- C22 H29 N O -","- C22 H29 N O -","- C88 H116 N4 O4 -","4","1","CV6439","Masciocchi, Norberto; Scuderi, Patrizia; Maspero, Angelo","Brooker's di-<i>tert</i>-butylmerocyanine","Acta Crystallographica Section E","2005","61","2","o227","o229","10.1107/S1600536804034129","","","0.71073","MoKα","","0.1479","0.071","","","0.165","0.2074","","","","","","1.018","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205040","10.1918","0.0009","17.7185","0.0016","14.1563","0.0013","90","","106","0.002","90","","2457.4","0.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Z)-Ethyl 3-phenyl-2-[(triphenylphosphoranylidene)amino]prop-2-enoate","","- C29 H26 N O2 P -","- C29 H26 N O2 P -","- C116 H104 N4 O8 P4 -","4","1","CV6440","Huang, Xiao-Bo; Liu, Miao-Chang; Wu, Hua-Yue; Ding, Jin-Chang; Hu, Mao-Lin","(<i>Z</i>)-Ethyl 3-phenyl-2-[(triphenylphosphoranylidene)amino]prop-2-enoate","Acta Crystallographica Section E","2005","61","2","o280","o281","10.1107/S1600536805000309","","","0.71073","MoKα","","0.0639","0.054","","","0.1248","0.1306","","","","","","1.116","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205041","8.8895","0.0011","8.9281","0.001","9.6787","0.0013","98.382","0.01","113.16","0.01","101.06","0.009","671.99","0.16","293","","293","","","","","","","","","4","P -1","-P 1","2","1,2,4,5,7-Pentabromo-5-methoxyindane","(1RS,2SR)-1,2,4,5,7-Pentabromo-5-methoxyindane","","- C10 H7 Br5 O -","- C10 H7 Br5 O -","- C20 H14 Br10 O2 -","2","1","CV6443","Mehmet Akkurt; Ísmail Çelik; Kıymet Berkil; Ahmet Tutar; Cem Cüneyt Ersanlı; Osman Çakmak; Orhan Büyükgüngör","(1<i>RS</i>,2S<i>R</i>)-1,2,4,5,7-Pentabromo-5-methoxyindane","Acta Crystallographica Section E","2005","61","2","o475","o477","10.1107/S160053680500111X","","","0.71073","MoKα","","0.1111","0.0412","","","0.0644","0.0735","","","","","","0.813","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205042","21.473","0.004","10.229","0.002","12.353","0.002","90","","98.68","0.02","90","","2682.2","0.9","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Melaminium benzoate dihydrate","","- C10 H16 N6 O4 -","- C10 H16 N6 O4 -","- C80 H128 N48 O32 -","8","1","CV6445","Genivaldo Julio Perpétuo; Jan Janczak","Melaminium benzoate dihydrate","Acta Crystallographica Section E","2005","61","2","o287","o289","10.1107/S1600536805000619","","","0.71073","MoKα","","0.0622","0.0361","","","0.0836","0.0942","","","","","","1.002","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205043","4.6858","0.0007","8.2573","0.0009","17.627","0.002","90","","90","","90","","682.02","0.15","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","5-aminophthalide","5-Amino-3H-isobenzofuran-1-one","","- C8 H7 N O2 -","- C8 H7 N O2 -","- C32 H28 N4 O8 -","4","1","CV6446","Yathirajan, Hemmige S.; Nagaraj, Basavegowda; Gaonkar, Santhosh L.; Narasegowda, Rajenahally S.; Prabhuswamy, Basappa; Bolte, Michael","5-Amino-3<i>H</i>-isobenzofuran-1-one (5-aminophthalide)","Acta Crystallographica Section E","2005","61","2","o343","o344","10.1107/S1600536805000851","","","0.71073","MoKα","","0.0317","0.0264","","","0.0652","0.0673","","","","","","1.044","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205044","15.4063","0.0019","6.0861","0.0006","15.4426","0.0016","90","","93.95","0.009","90","","1444.5","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","5-bromophthalide","5-Bromo-3H-isobenzofuran-1-one","","- C8 H5 Br O2 -","- C8 H5 Br O2 -","- C64 H40 Br8 O16 -","8","2","CV6447","Yathirajan, Hemmige S.; Nagaraj, Basavegowda; Gaonkar, Santhosh L.; Narasegowda, Rajenahally S.; Prabhuswamy, Basappa; Bolte, Michael","5-Bromo-3<i>H</i>-isobenzofuran-1-one (5-bromophthalide)","Acta Crystallographica Section E","2005","61","2","o345","o346","10.1107/S160053680500084X","","","0.71073","MoKα","","0.0758","0.0488","","","0.1109","0.1215","","","","","","0.965","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205045","8.4201","0.0002","16.2404","0.0003","15.196","0.0004","90","","103.844","0.001","90","","2017.63","0.08","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(η^6^-N,N-Diethylaniline)(η^4^-1,2,3,4-tetramethylcyclobutadiene)cobalt(I) hexafluorophosphate","","- C18 H27 Co F6 N P -","- C18 H27 Co F6 N P -","- C72 H108 Co4 F24 N4 P4 -","4","1","CV6448","Kennedy, Alan R.; Pauson, Peter L.","(η^6^-<i>N,N</i>-Diethylaniline)(η^4^-1,2,3,4-tetramethylcyclobutadiene)cobalt(I) hexafluorophosphate","Acta Crystallographica Section E","2005","61","2","m302","m303","10.1107/S1600536805000863","","","0.71073","MoKα","","0.0946","0.0523","","","0.1212","0.1407","","","","","","1.026","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205046","9.8221","0.001","10.6654","0.001","16.5207","0.0016","107.009","0.002","101.652","0.002","100.645","0.002","1565","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","(Z)-3-Phenylethyl-5-phenylmethylidene-2-thioxo-1H-imidazolidin-4-one","","- C18 H16 N2 O S -","- C18 H16 N2 O S -","- C72 H64 N8 O4 S4 -","4","2","CV6452","Hua-Yue, Wu; Xiao-Bo, Huang; Jin-Chang, Ding; Miao-Chang, Liu; Mao-Lin, Hu","(<i>Z</i>)-5-Benzylidene-3-phenethyl-2-thioxoimidazolidin-4-one","Acta Crystallographica Section E","2005","61","2","o497","o499","10.1107/S1600536805002667","","","0.71073","MoKα","","0.1054","0.0757","","","0.1662","0.1895","","","","","","1.13","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205047","17.944","0.001","11.9692","0.0006","6.9072","0.0003","90","","90","","90","","1483.5","0.13","298","","","","","","","","","","","5","P n a 21","P 2c -2n","33","","(2-Phenylethyl)ammonium tetrabromothallate(III)","","- C8 H12 Br4 N Tl -","- C8 H12 Br4 N Tl -","- C32 H48 Br16 N4 Tl4 -","4","1","DN6172","M. Abdi; F. Zouari; N. Chniba-Boudjada; P. Bordet; A. Ben Salah","(2-Phenylethyl)ammonium tetrabromothallate(III)","Acta Crystallographica Section E","2005","61","2","m240","m241","10.1107/S1600536804033070","","","0.56085","AgKα","","0.0989","0.0511","","","0.107","0.1316","","","","","","1.03","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205048","8.447","0.005","10.821","0.007","11.759","0.007","67.224","0.009","70.794","0.009","77.127","0.009","930.2","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","2-[(E)-Benzylideneamino]-N-(2-fluorophenyl)-4,5,6,7-tetrahydro-1- benzothiophene-3-carboxamide","","- C22 H19 F N2 O S -","- C22 H19 F N2 O S -","- C44 H38 F2 N4 O2 S2 -","2","1","DN6180","Vasu; Nirmala, K. A.; Chopra, Deepak; Mohan, S.; Saravanan, J.","2-[(<i>E</i>)-Benzylideneamino]-<i>N</i>-(2-fluorophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide","Acta Crystallographica Section E","2005","61","2","o236","o238","10.1107/S1600536804033008","","","0.71073","MoKα","","0.0533","0.0462","","","0.1217","0.1282","","","","","","1.038","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2205049","16.6509","0.0003","9.7336","0.0002","8.9989","0.0003","90","","90","","90","","1458.48","0.06","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","creatininium nitrate","","","- C4 H8 N4 O4 -","- C4 H8 N4 O4 -","- C32 H64 N32 O32 -","8","1","DN6185","Fadila, Berrah; Hanane, Lamraoui; Nourredine, Benali-Cherif","Hydrogen bonding in creatininium nitrate","Acta Crystallographica Section E","2005","61","2","o210","o212","10.1107/S1600536804032349","","","0.71073","MoKα","","0.0641","0.04","","","0.1001","0.1098","","","","","","1.02","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205050","10.8401","0.0007","17.359","0.001","15.611","0.001","90","","106.534","0.001","90","","2816.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(di-2-pyridylmethanediol-κ^3^N,O,N')nickel(II) dilactate","","- C28 H30 N4 Ni O10 -","- C28 H30 N4 Ni O10.001 -","- C112 H120 N16 Ni4 O40.004 -","4","1","DN6186","Li, Cui-Jin; Li, Wei; Tong, Ming-Liang; Ng, Seik Weng","Bis(di-2-pyridylmethanediol-κ^3^<i>N,O,N</i>')nickel(II) dilactate","Acta Crystallographica Section E","2005","61","2","m229","m231","10.1107/S1600536804033975","","","0.71073","MoKα","","0.059","0.045","","","0.105","0.112","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205051","23.557","0.002","8.5744","0.0006","15.848","0.001","90","","91.983","0.001","90","","3199.2","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","bis(di-2-pyridylmethanediol-κ^3^N,O,N')copper(II) diacetate tetrahydrate","","- C26 H34 Cu N4 O12 -","- C26 H34 Cu N4 O12 -","- C104 H136 Cu4 N16 O48 -","4","0.5","DN6187","Li, Cui-Jin; Li, Wei; Tong, Ming-Liang; Ng, Seik Weng","A <i>C</i>-centered monoclinic modification of bis(di-2-pyridylmethanediol-κ^3^<i>N,O,N</i>')copper(II) diacetate tetrahydrate","Acta Crystallographica Section E","2005","61","2","m232","m234","10.1107/S1600536804033987","","","0.71073","MoKa","","0.043","0.037","","","0.114","0.119","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205052","10.7048","0.0017","16.38","0.003","28.722","0.005","90","","90","","90","","5036.2","1.5","110","2","110","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","bis[μ-6,6'-di-tert-butyl-4,4'-dimethyl-2,2- (ethylenedithio)diphenolato]bis[methylaluminium(I)]","","- C50 H70 Al2 O4 S4 -","- C50 H70 Al2 O4 S4 -","- C200 H280 Al8 O16 S16 -","4","0.5","DN6188","Ma, Haiyan; Melillo, Gianluca; Oliva, Leone; Spaniol, Thomas P.; Okuda, Jun","A dimeric alkyl complex supported by an <i>O,S,S,O</i>-tetradentate diphenolate ligand","Acta Crystallographica Section E","2005","61","2","m221","m222","10.1107/S1600536804033793","","","0.71073","MoKα","","0.0464","0.041","","","0.1057","0.1094","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205053","11.0319","0.0005","6.8524","0.0004","7.7018","0.0004","90","","105.444","0.003","90","","561.19","0.05","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-poly[[bis(1-methyl-1H-tetrazole-κN^4^)copper(II)]-di-μ-bromo]","","- C4 H8 Br2 Cu N8 -","- C4 H8 Br2 Cu N8 -","- C8 H16 Br4 Cu2 N16 -","2","0.5","DN6190","Ivashkevich, Ludmila S.; Lyakhov, Alexander S.; Gaponik, Pavel N.; Degtyarik, Michail M.","An X-ray powder diffraction study of <i>catena</i>-poly[[bis(1-methyl-1<i>H</i>-tetrazole-κ<i>N</i>^4^)copper(II)]-di-μ-bromo]","Acta Crystallographica Section E","2005","61","2","m394","m396","10.1107/S1600536805002205","","","1.5418","CuKα","","","","","","","","","","1.23","","","","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205054","20.6438","0.0019","5.3153","0.0005","16.7247","0.0015","90","","97.039","0.002","90","","1821.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N'-Diphenyl-2,2'-(1,3,4-thiadiazolyl-2,5-dithio)diacetamide","","- C18 H16 N4 O2 S3 -","- C18 H16 N4 O2 S3 -","- C72 H64 N16 O8 S12 -","4","1","DN6192","Yong-Hong Wen; Shu-Sheng Zhang; Bao-Hui Yu; Xue-Mei Li; Qing Liu","<i>N</i>,<i>N</i>'-Diphenyl-2,2'-(1,3,4-thiadiazolyl-2,5-dithio)diacetamide","Acta Crystallographica Section E","2005","61","2","o347","o348","10.1107/S1600536805001479","","","0.71073","MoKα","","0.0493","0.039","","","0.0951","0.1017","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205055","10.748","0.003","14.417","0.004","10.92","0.003","90","","111.28","0.004","90","","1576.7","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dimethyl [phenyl(pyridine-4-carboxamido)methyl]phosphonate","","- C15 H17 N2 O4 P -","- C15 H17 N2 O4 P -","- C60 H68 N8 O16 P4 -","4","1","DN6194","Fang, Hua; Fang, Mei-Juan; Liu, Xiao-Xia; Lin, Jing-Jing; Zhao, Yu-Fen","Dimethyl [phenyl(pyridine-4-carboxamido)methyl]phosphonate","Acta Crystallographica Section E","2005","61","2","o408","o409","10.1107/S1600536805001492","","","0.71073","MoKα","","0.0658","0.0603","","","0.1361","0.1394","","","","","","1.152","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205056","9.001","0.0018","9.551","0.0019","14.251","0.003","90","","102.94","0.03","90","","1194","0.4","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Phenyl-3-[(1H-1,2,4-triazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione","","- C11 H10 N6 S -","- C11 H10 N6 S -","- C44 H40 N24 S4 -","4","1","DN6195","Fangfang Jian; Zhengshuai Bai; Kai Li; Hailian Xiao","4-Phenyl-3-[(1<i>H</i>-1,2,4-triazol-1-yl)methyl]-1<i>H</i>-1,2,4-triazole-5-thione","Acta Crystallographica Section E","2005","61","2","o393","o395","10.1107/S1600536805001510","","","0.71073","MoKα","","0.0681","0.0335","","","0.0743","0.0841","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205057","8.086","0.004","10.635","0.005","14.519","0.007","90","","103.614","0.008","90","","1213.5","1","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-Bis[(2E)-3-(N,N-dimethylamino)-1-(2-pyridyl)prop-2-en-1- one]diisothiocyanatonickel(II)","","- C22 H24 N6 Ni O2 S2 -","- C22 H24 N6 Ni O2 S2 -","- C44 H48 N12 Ni2 O4 S4 -","2","0.5","DN6198","Gai-Xian Li; Jian-Qing Li; Xu-Zhen Kang","<i>trans</i>-Bis[(2<i>E</i>)-3-(<i>N,N</i>-dimethylamino)-1-(2-pyridyl)prop-2-en-1-one]diisothiocyanatonickel(II)","Acta Crystallographica Section E","2005","61","2","m410","m411","10.1107/S1600536805002795","","","0.71073","MoKα","","0.1219","0.0696","","","0.1248","0.1449","","","","","","0.975","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205058","7.173","0.0014","12.267","0.003","7.868","0.0016","90","","100.75","0.03","90","","680.2","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","4-Methyl-2-thioxo-2,3-dihydrothiazol-3-yl 4-methylphenyl carbonate","","- C12 H11 N O3 S2 -","- C12 H11 N O3 S2 -","- C24 H22 N2 O6 S4 -","2","1","FL6139","Hartung, Jens; Schneiders, Nina; Bergsträsser, Uwe","4-Methyl-2-thioxo-2,3-dihydrothiazol-3-yl 4-methylphenyl carbonate","Acta Crystallographica Section E","2005","61","2","o421","o422","10.1107/S1600536805001431","","","0.71073","MoKα","","0.0915","0.0707","","","0.1383","0.1499","","","","","","1.135","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205059","7.5364","0.0012","9.9","0.0016","23.288","0.004","90","","90","","90","","1737.5","0.5","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","16α,17-Epoxypregn-4-ene-3,11,20-trione","17-acetyl-10,13-dimethyl-1,2,6,7,9,10,12,13,14,15,16, 17-dodecahydro-8H-20-oxa-cyclopropa[16,17]cyclopenta[a]phenanthrene-3,11-dione","","- C21 H26 O4 -","- C21 H26 O4 -","- C84 H104 O16 -","4","1","FL6141","Nie, Qiang; Wang, Jingkang; Wang, Shi; Zhang, Meijing","16α,17-Epoxypregn-4-ene-3,11,20-trione","Acta Crystallographica Section E","2005","61","2","o398","o399","10.1107/S1600536805001443","","","0.71073","MoKα","","0.0524","0.0396","","","0.1023","0.1086","","","","","","1.073","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205060","6.7128","0.0003","6.7911","0.0002","13.6379","0.0008","75.83","0.003","75.999","0.002","78.326","0.003","578.08","0.05","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","4-Aminopyridinium isonicotinate monohydrate","","- C11 H13 N3 O3 -","- C11 H13 N3 O3 -","- C22 H26 N6 O6 -","2","1","FL6142","Kennedy, Alan R.; Kittner, Madeleine","4-Aminopyridinium isonicotinate monohydrate","Acta Crystallographica Section E","2005","61","2","o333","o334","10.1107/S1600536805000887","","","0.71073","MoKα","","0.0507","0.0359","","","0.0825","0.0903","","","","","","1.037","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205061","14.473","0.003","6.994","0.001","17.2","0.003","90","","103.37","0.03","90","","1693.9","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5-acetyl-4,6-dimethyl-1,2,3,4-tetrahydropyrimidin-2-one","","- C8 H12 N2 O2 -","- C8 H12 N2 O2 -","- C64 H96 N16 O16 -","8","1","GH6009","Zavodnik, Valery E.; Shutalev, Anatoly D.; Gurskaya, Galina V.; Stash, Adam I.; Tsirelson, Vladimir G.","5-Acetyl-4,6-dimethyl-1,2,3,4-tetrahydropyrimidin-2-one","Acta Crystallographica Section E","2005","61","2","o365","o367","10.1107/S1600536805000383","","","0.71073","MoKα","","0.052","0.0294","","","0.0919","0.0948","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205062","10.8364","0.0008","19.4649","0.0015","12.6722","0.001","90","","103.926","0.001","90","","2594.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2,6-Bis(4-methoxyphenyl)-1-nitroso-3,5-diphenylpiperidin-4-one","2,6-Bis(4-methoxyphenyl)-1-nitroso-3,5-diphenylpiperidin-4-one","","- C31 H28 N2 O4 -","- C31 H28 N2 O4 -","- C124 H112 N8 O16 -","4","1","GH6010","S. Natarajan; R. V. Krishnakumar; M. Subha Nandhini; V. P. Alex Raja; S. Perumal; K. Ravikumar","2,6-Bis(4-methoxyphenyl)-1-nitroso-3,5-diphenylpiperidin-4-one","Acta Crystallographica Section E","2005","61","2","o359","o361","10.1107/S1600536805000954","","","0.71073","MoKα","","0.0689","0.0508","","","0.1376","0.1512","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205063","7.8006","0.0005","11.6289","0.0008","11.9121","0.0008","67.701","0.001","75.488","0.001","78.896","0.001","962.12","0.11","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(2-amino-4,6-dimethylpyrimidine)(nickel(II)thiocyante)","Tetraaquadithiocyanatonickel(II) tetrakis(2-amino-4,6-dimethylpyrimidine) dihydrate","","- C26 H48 N14 Ni O6 S2 -","- C26 H48 N14 Ni O6 S2 -","- C26 H48 N14 Ni O6 S2 -","1","0.5","HB6132","Madhukar Hemamalini; Packianathan Thomas Muthiah; Ray J. Butcher","Tetraaquadithiocyanatonickel(II) tetrakis(2-amino-4,6-dimethylpyrimidine) dihydrate","Acta Crystallographica Section E","2005","61","2","m204","m206","10.1107/S1600536804033884","","","0.71073","MoKα","","0.0652","0.0445","","","0.1065","0.1151","","","","","","1.046","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205064","23.562","0.003","6.5271","0.0005","28.881","0.004","90","","108.863","0.01","90","","4203.1","0.9","296","1","296","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[μ-2,8-Dimethyl-5,11-bis(dimethylaminoethyl)-1,4,5,6,7,10,11,12- octahydrodiimidazo[4,5-h;4,5-c][1,6]diazecine]bis[aquacopper(II)] diacetate hexahydrate","","- C28 H64 Cu2 N8 O16 -","- C28 H64 Cu2 N8 O16 -","- C112 H256 Cu8 N32 O64 -","4","0.5","HB6133","Gasque, Laura; Olguín, Juan; Bernès, Sylvain","[μ-2,8-Dimethyl-5,11-bis(dimethylaminoethyl)-1,4,5,6,7,10,11,12-octahydrodiimidazo[4,5-<i>h</i>;4,5-<i>c</i>][1,6]diazecine]bis[aquacopper(II)] diacetate hexahydrate","Acta Crystallographica Section E","2005","61","2","m274","m276","10.1107/S1600536805000206","","","0.71073","MoKα","","0.0408","0.032","","","0.0878","0.0927","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205065","10.715","0.002","9.2","0.001","11.692","0.002","90","","92.02","0.04","90","","1151.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(Benzoylthiocarbonyl)morpholine","","- C12 H13 N O2 S -","- C12 H13 N O2 S -","- C48 H52 N4 O8 S4 -","4","1","HB6134","Liu, Wei-Wei; Li, Yi-Zhi; Kong, Ling-Dong; Hu, Hong-Wen","4-(Benzoylthiocarbonyl)morpholine","Acta Crystallographica Section E","2005","61","2","o295","o297","10.1107/S1600536805000449","","","0.71073","MoKα","","0.0935","0.057","","","0.0987","0.1077","","","","","","1.095","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205066","12.2038","0.0004","12.6561","0.0004","16.9518","0.0006","90","","95.714","0.001","90","","2605.24","0.15","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Aqua(bromomaleatoκ-O)bis(phenanthroline-κ^2^N,N')manganese(II) monohydrate","","- C28 H21 Br Mn N4 O6 -","- C28 H21 Br Mn N4 O6 -","- C112 H84 Br4 Mn4 N16 O24 -","4","1","HB6135","Dai-Xi Li; Duan-Jun Xu; Yuan-Zhi Xu","Aqua(bromomaleato-κ<i>O</i>)bis(phenanthroline-κ^2^<i>N,N</i>')manganese(II) monohydrate","Acta Crystallographica Section E","2005","61","2","m271","m273","10.1107/S1600536805000486","","","0.71073","MoKα","","0.054","0.032","","","0.075","0.081","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205067","6.873","0.005","9.721","0.005","15.523","0.002","90","","96.49","0.01","90","","1030.5","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(2-oxopyridinato N-oxide-κ^2^O,O')copper(II)","","- C10 H8 Cu N2 O4 -","- C10 H8 Cu N2 O4 -","- C40 H32 Cu4 N8 O16 -","4","1","HB6136","Xu, Li; Li, Yi-Zhi; Liu, San-Hui; Chen, Xue-Tai; Zhou, Jian-Hao","Bis(2-oxopyridinatoN-oxide-κ^2^O,O')copper(II)","Acta Crystallographica, Section E: Structure Reports Online","2005","61","2","m364","m366","10.1107/s1600536805001819","","","0.71073","MoKα","","0.0512","0.0438","","","0.1094","0.1129","","","","","","0.989","","","","has coordinates","219069","2020-10-21","18:00:00",""
"2205068","8.343","0.002","12.302","0.003","17.54","0.004","98.82","0.03","102.77","0.03","97.7","0.03","1708.4","0.8","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Bis(2,2'-bipyridine)(3-carboxy-4-hydroxybenzenesulfonato)copper(II) 3-carboxy-4-hydroxybenzenesulfonate","","- C34 H26 Cu N4 O12 S2 -","- C34 H26 Cu N4 O12 S2 -","- C68 H52 Cu2 N8 O24 S4 -","2","1","HB6137","Gao, Shan; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","Bis(2,2'-bipyridine)(3-carboxy-4-hydroxybenzenesulfonato)copper(II) 3-carboxy-4-hydroxybenzenesulfonate","Acta Crystallographica Section E","2005","61","2","m290","m292","10.1107/S1600536805000590","","","0.71073","MoKα","","0.143","0.067","","","0.122","0.147","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205069","14.35","0.004","5.306","0.0009","12.672","0.005","90","","109.96","0.02","90","","906.9","0.5","200","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Lithium hydrogen (RS)-phenylsuccinate","","- C10 H9 Li O4 -","- C10 H9 Li O4 -","- C40 H36 Li4 O16 -","4","1","HB6138","Fischer, Andreas","Lithium hydrogen (<i>RS</i>)-phenylsuccinate","Acta Crystallographica Section E","2005","61","2","m320","m322","10.1107/S1600536805001017","","","0.71073","MoKα","","0.0765","0.05","","","0.1142","0.13","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205070","17.6227","0.0009","11.3661","0.0005","17.1939","0.0007","90","","110.011","0.002","90","","3236","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[[bis(μ-4-cyanobenzoato-κ^2^O:O)bis[(4-cyanobenzoato- κ^2^O,O')cobalt(II)]]-di-μ-4,4'-bipyridine-κ^4^N:N'] dihydrate dimethylformamide tetrasolvate]","","- C64 H64 Co2 N12 O14 -","- C64 H64 Co2 N12 O14 -","- C128 H128 Co4 N24 O28 -","2","0.5","HB6139","He, Hong-Yin; Zhu, Long-Guan; Ng, Seik Weng","<i>catena</i>-Poly[[[bis(μ-4-cyanobenzoato-κ^2^<i>O</i>:<i>O</i>)bis[(4-cyanobenzoato-κ^2^<i>O,O</i>')cobalt(II)]]-di-μ-4,4'-bipyridine-κ^4^<i>N</i>:<i>N</i>'] dihydrate dimethylformamide tetrasolvate]","Acta Crystallographica Section E","2005","61","2","m311","m313","10.1107/S1600536805001054","","","0.71073","MoKα","","0.083","0.065","","","0.175","0.188","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205071","13.4146","0.0009","10.2135","0.0008","7.8627","0.0006","90","","95.295","0.005","90","","1072.67","0.14","150","1","150","1","","","","","","","","5","C 1 c 1","C -2yc","9","","Methylchlorosila[1]ferrocenophane","","- C11 H11 Cl Fe Si -","- C11 H11 Cl Fe Si -","- C44 H44 Cl4 Fe4 Si4 -","4","1","HB6140","Chan, Wing Yan; Lough, Alan J.; Manners, Ian","Methylchlorosila[1]ferrocenophane","Acta Crystallographica Section E","2005","61","2","m375","m376","10.1107/S1600536805001352","","","0.71073","MoKα","","0.0478","0.0389","","","0.0909","0.0976","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205072","6.9687","0.0008","11.4468","0.0012","12.687","0.0013","110.396","0.002","100.042","0.002","100.915","0.002","899.1","0.17","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","8-Hydroxyquinolinium hemi(dibromosuccinate) dibromosuccinic acid","","- C30 H26 Br6 N2 O14 -","- C30 H26 Br6 N2 O14 -","- C30 H26 Br6 N2 O14 -","1","0.5","HB6142","Dai-Xi Li; Duan-Jun Xu; Yuan-Zhi Xu","8-Hydroxyquinolinium‒dibromosuccinate‒dibromosuccinic acid (2/1/2)","Acta Crystallographica Section E","2005","61","2","o402","o404","10.1107/S1600536805001704","","","0.71073","MoKα","","0.093","0.064","","","0.147","0.17","","","","","","1.103","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205073","14.187","0.006","19.218","0.008","8.139","0.004","90","","108.061","0.007","90","","2109.7","1.6","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Ethylenediammonium diaquabis(ethylenediamine-κ^2^N,N')zinc(II) bis(pyridine-2,6-dicarboxylato-κ^3^,O,N,O')zincate(II) dihydrate","","- C34 H46 N10 O20 Zn3 -","- C34 H46 N10 O20 Zn3 -","- C68 H92 N20 O40 Zn6 -","2","0.25","HB6143","Fu, Ai-Yun; Wang, Da-Qi; Sun, De-Zhi","Ethylenediammonium diaquabis(ethylenediamine-κ^2^<i>N</i>,<i>N</i>')zinc(II) bis(pyridine-2,6-dicarboxylato-κ^3^,<i>O</i>,<i>N</i>,<i>O</i>')zincate(II) dihydrate","Acta Crystallographica Section E","2005","61","2","m401","m403","10.1107/S1600536805002576","","","0.71073","MoKα","","0.0893","0.0444","","","0.0681","0.0743","","","","","","1.001","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205074","6.997","0.001","14.221","0.003","18.355","0.004","90","","90","","90","","1826.4","0.6","295","2","295","2","","","","","","","","6","P n n m","-P 2 2n","58","","[N,N'-Ethylenebis(salicylideneiminato)]nickel(II) chloroform solvate","","- C17 H15 Cl3 N2 Ni O2 -","- C17 H15 Cl3 N2 Ni O2 -","- C68 H60 Cl12 N8 Ni4 O8 -","4","0.5","HB6145","Cheng, Xiao-Li; Gao, Shan; Huo, Li-Hua; Ng, Seik Weng","[<i>N</i>,<i>N</i>'-Ethylenebis(salicylideneiminato)]nickel(II) chloroform solvate","Acta Crystallographica Section E","2005","61","2","m385","m386","10.1107/S1600536805002187","","","0.71073","MoKα","","0.054","0.046","","","0.141","0.147","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205075","8.9669","0.0006","9.0527","0.0006","16.295","0.001","86.608","0.001","78.84","0.001","86.593","0.001","1293.9","0.15","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","Bis[di-2-pyridyl(hydroxy)methanolato-κ^3^O,N,N')]iron(III) tetrafluoroborate trihydrate","","- C22 H24 B F4 Fe N4 O7 -","- C22 H24 B F4 Fe N4 O7 -","- C44 H48 B2 F8 Fe2 N8 O14 -","2","1","HB6146","Onggo, Djulia; Mimin, Aminah; Yamin, Bohari M.; Ng, Seik Weng","Bis[di-2-pyridyl(hydroxy)methanolato-κ^3^<i>O</i>,<i>N</i>,<i>N</i>']iron(III) tetrafluoroborate trihydrate","Acta Crystallographica Section E","2005","61","2","m387","m388","10.1107/S1600536805002369","","","0.71073","MoKα","","0.086","0.067","","","0.161","0.172","","","","","","1.14","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205076","29.1857","0.0011","9.8249","0.0004","12.0285","0.0005","90","","101.902","0.002","90","","3375","0.2","110","2","110","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","p-bromophenylboronic acid","4-bromophenylboronic acid'","","- C6.08 H6.24 B Br O2.04 -","- C6.08 H6.24 B Br O2.04 -","- C97.28 H99.84 B16 Br16 O32.64 -","16","2","HG6113","Bhuvanesh, Nattamai S. P.; Reibenspies, Joseph H.","4-Bromophenylboronic acid ethanol 0.04-solvate","Acta Crystallographica Section E","2005","61","2","o362","o364","10.1107/S1600536804033744","","","1.54178","CuKα","","0.0645","0.0495","","","0.138","0.1487","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205077","8.185","0.002","14.756","0.003","15.092","0.005","90","","121.73","0.02","90","","1550.3","0.8","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-Methoxyphenyl)-2-(6-methyl-2-nitro-3-pyridyloxy)propan-1-one","","- C16 H16 N2 O5 -","- C16 H16 N2 O5 -","- C64 H64 N8 O20 -","4","1","HG6119","Vencato, Ivo; Ferri, Pedro H.; Santos, Suzana C.; Pereira, Maristela; Lariucci, Carlito; Homar, Leon I. B.; Napolitano, Hamilton B.","1-(4-Methoxyphenyl)-2-(6-methyl-2-nitro-3-pyridyloxy)propan-1-one","Acta Crystallographica Section E","2005","61","2","o247","o249","10.1107/S1600536804032301","","","0.71073","MoKα","","0.102","0.052","","","0.134","0.162","","","","","","1.04","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205078","4.2065","0.0002","5.1845","0.0002","38.9371","0.0018","90","","91.723","0.002","90","","848.78","0.07","190","","190","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","n-Octanol","","- C8 H18 O -","- C8 H18 O -","- C32 H72 O4 -","4","1","HG6120","Shallard-Brown, Howard A.; Watkin, David J.; Cowley, Andrew R.","<i>n</i>-Octanol","Acta Crystallographica Section E","2005","61","2","o213","o214","10.1107/S1600536804032775","","","0.71073","MoKα","","0.1254","0.1254","","0.1565","0.1565","0.1565","","","","","","0.9944","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205079","19.089","0.003","8.4715","0.0011","23.161","0.003","90","","90.315","0.002","90","","3745.4","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-(Benzotriazol-1-yl)-2-(α-hydroxybenzyl)-N-phenylthioacrylamide","","- C21 H16 N4 O S -","- C21 H16 N4 O S -","- C168 H128 N32 O8 S8 -","8","1","HG6121","Liu, Fa-Qian; Li, Wei-Hua; Lu, Lu-De; Yang, Xu-Jie; Wang, Xin; Bao-Rong Hou","2-(Benzotriazol-1-yl)-2-(α-hydroxybenzyl)-<i>N</i>-phenylthioacrylamide","Acta Crystallographica Section E","2005","61","2","o208","o209","10.1107/S1600536804033768","","","0.71073","MoKα","","0.0772","0.0395","","","0.107","0.1208","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205080","9.463","0.0017","12.879","0.002","16.44","0.003","90","","105.802","0.003","90","","1927.9","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4-Bis(1-phenyl-1H-tetrazol-5-ylsulfanyl)butane","","- C18 H18 N8 S2 -","- C18 H18 N8 S2 -","- C72 H72 N32 S8 -","4","1","HG6123","Wang, Wei; Liu, Hui-Min; Zhang, Wen-Qin","1,4-Bis(1-phenyl-1<i>H</i>-tetrazol-5-ylsulfanyl)butane","Acta Crystallographica Section E","2005","61","2","o206","o207","10.1107/S1600536804033756","","","0.71073","MoKα","","0.0575","0.0377","","","0.0955","0.1086","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205081","13.68","0.009","6.916","0.005","19.968","0.014","90","","108.292","0.011","90","","1794","2","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H21 N3 O3 -","- C19 H21 N3 O3 -","- C76 H84 N12 O12 -","4","1","HG6125","Zhang, Xin-Li; Li, Zong-Xiao","4-[(4-Hydroxybenzylidene)amino]-1,5-dimethyl-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-3-one methanol solvate","Acta Crystallographica Section E","2005","61","2","o266","o268","10.1107/S1600536804034324","","","0.71073","MoKα","","0.1228","0.0484","","","0.1102","0.1418","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205082","3.9117","0.0009","17.232","0.004","13.686","0.003","90","","97.116","0.004","90","","915.4","0.4","273","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","7-Amino-1H-3,1-benzothiazine-2,4-dithione","","- C8 H6 N2 S3 -","- C8 H6 N2 S3 -","- C32 H24 N8 S12 -","4","1","HG6127","Yu, Yun; Zhong, Hui-Ping; Yang, Kai-Bin; Huang, Rong-Bin; Zheng, Lan-Sun","7-Amino-1<i>H</i>-3,1-benzothiazine-2,4-dithione","Acta Crystallographica Section E","2005","61","2","o387","o388","10.1107/S1600536805000772","","","0.71073","MoKα","","0.0665","0.0589","","","0.1547","0.1602","","","","","","1.136","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205083","5.841","0.0005","13.363","0.0011","15.325","0.0017","90","","90","","90","","1196.17","0.19","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","4-Chlorophenyl thiobenzoate","4-Chlorophenyl thiobenzoate","","- C13 H9 Cl O S -","- C13 H9 Cl O S -","- C52 H36 Cl4 O4 S4 -","4","1","HG6128","T. Bhupathi Ganesh; A. Dhakshinamoorthy; K. Pitchumani; S. Athimoolam; B. Sridhar; R. K. Rajaram","4-Chlorophenyl thiobenzoate","Acta Crystallographica Section E","2005","61","2","o340","o342","10.1107/S1600536805000966","","","0.71073","MoKα","","0.0714","0.0371","","","0.0853","0.0964","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205084","9.4446","0.0001","12.4158","0.0001","15.0802","0.0002","72.645","0.001","78.207","0.001","77.39","0.001","1628.61","0.03","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","1,1,3,3-Tetraphenyl-1,2,3-triphosphenium tetrachloroaluminate dichloromethane solvate","","- C28 H28 Al Cl6 P3 -","- C28 H28 Al Cl6 P3 -","- C56 H56 Al2 Cl12 P6 -","2","1","HG6130","Deng, Robert M. K.; Dillon, Keith B.; Goeta, Andrés E.; Thompson, Amber L.","1,1,3,3-Tetraphenyl-1,2,3-triphosphenium tetrachloroaluminate dichloromethane solvate","Acta Crystallographica Section E","2005","61","2","m296","m298","10.1107/S1600536805000656","","","0.71073","MoKα","","0.0323","0.0288","","","0.0727","0.0753","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205085","24.002","0.004","10.9833","0.0017","24.364","0.003","90","","90","","90","","6422.9","1.7","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Sildenafil citrate monohydrate","1-{[3-(6,7-Dihydro-1-methyl-7-oxo-3-propyl-1H-pyrazolo[4,3-d]pyrimidin-5-yl)- 4-ethoxyphenyl]sulfonyl}-4-methylpiperazinium citrate monohydrate","","- C28 H40 N6 O12 S -","- C28 H40 N6 O12 S -","- C224 H320 N48 O96 S8 -","8","1","HG6131","Yathirajan, Hemmige S.; Basavegowda, Nagaraj; Nagaraja, Padmarajaiah; Bolte, Michael","Sildenafil citrate monohydrate","Acta Crystallographica Section E","2005","61","2","o489","o491","10.1107/S1600536805002564","","","0.71073","MoKα","","0.1743","0.0785","","","0.1364","0.1543","","","","","","0.782","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205086","22.759","0.004","5.5729","0.0009","8.3902","0.0014","90","","90.929","0.002","90","","1064","0.3","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","1-(4-Hydroxyphenyl)-3-(1H-1,2,4-triazol-1-yl)propan-1-one","","- C11 H11 N3 O2 -","- C11 H11 N3 O2 -","- C44 H44 N12 O8 -","4","1","HG6135","Fa-Qian Liu; Wei-Hua Li; Hai-Bin Song; Lu-De Lu; Xu-Jie Yang; Xin Wang","1-(4-Hydroxyphenyl)-3-(1<i>H</i>-1,2,4-triazol-1-yl)propan-1-one","Acta Crystallographica Section E","2005","61","2","o400","o401","10.1107/S1600536805001169","","","0.71073","MoKα","","0.0415","0.0296","","","0.071","0.0761","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205087","7.298","0.001","7.298","0.001","16.56","0.003","90","","90","","120","","763.8","0.2","123","2","123","","","","","","","","","4","P -3 c 1","-P 3 2""c","165","","1,4,7-triazacyclononane hemihydrate","","- C6 H16 N3 O0.5 -","- C6 H16 N3 O0.5 -","- C24 H64 N12 O2 -","4","0.333333","IS6022","Battle, Andrew R.; Johnson, Daniel L.; Martin, Lisandra L.","1,4,7-Triazacyclononane hemihydrate","Acta Crystallographica Section E","2005","61","2","o330","o332","10.1107/S1600536805000814","","","0.71073","MoKα","","","0.0485","","","","0.1398","","","","","","1.118","","","","has coordinates,has Fobs","194389","2020-10-21","18:00:00",""
"2205088","4.473","0.001","14.772","0.005","18.263","0.002","79.38","0.02","88.78","0.01","86.33","0.02","1183.6","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3-[(4-Hydroxy-3-methoxyphenyl)methylenehydrazinocarbonyl]-(1H)-1,2,4-Triazole","","- C11 H11 N5 O3 -","- C11 H11 N5 O3 -","- C44 H44 N20 O12 -","4","2","IS6028","Fu-You Pan; Jian-Guo Yang","3-[<i>N</i>'-(4-Hydroxy-3-methoxybenzylidene)hydrazinocarbonyl]-1<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2005","61","2","o503","o505","10.1107/S1600536804034269","","","0.71073","MoKα","","0.1089","0.0432","","","0.1108","0.1401","","","","","","1.013","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205089","14.3741","0.0004","14.1573","0.0004","17.9269","0.0005","90","","91.328","0.001","90","","3647.12","0.18","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetraaquatetra(dimethylacetamide-κO)neodymium(III) hexacyanoferrate(III) trihydrate","","- C22 H50 Fe N10 Nd O11 -","- C22 H50 Fe N10 Nd O11 -","- C88 H200 Fe4 N40 Nd4 O44 -","4","1","IS6031","Overgaard, Jacob; Svendsen, Helle; Chevalier, Marie A.; Iversen, Bo B.","Tetraaquatetrakis(dimethylacetamide-κ<i>O</i>)neodymium(III) hexacyanoferrate(III) trihydrate","Acta Crystallographica Section E","2005","61","2","m268","m270","10.1107/S1600536805000577","","","0.71073","MoKα","","0.0374","0.0243","","","0.0646","0.0679","","","","","","1.074","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2205090","14.896","0.003","5.968","0.0011","18.894","0.004","90","","95.752","0.004","90","","1671.2","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-tert-Butyl-3-(α-Hydroxy-4-isopropylbenzylidene)pyrrolidine-2,4-dione","","- C18 H23 N O3 -","- C18 H23 N O3 -","- C72 H92 N4 O12 -","4","1","IS6032","Hai-Zhen Xu; Xin Zhang; Xiao-Jun Zhao; Gui-Sheng Yu","1-<i>tert</i>-Butyl-3-(α-hydroxy-4-isopropylbenzylidene)pyrrolidine-2,4-dione","Acta Crystallographica Section E","2005","61","2","o292","o294","10.1107/S1600536805000589","","","0.71073","MoKα","","0.1166","0.0609","","","0.1652","0.2068","","","","","","1.015","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205091","16.884","0.003","5.873","0.002","13.135","0.003","90","","108.38","0.01","90","","1236","0.6","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N'-(2-Chlorobenzylidene)-2-hydroxybenzohydrazide","","- C14 H11 Cl N2 O2 -","- C14 H11 Cl N2 O2 -","- C56 H44 Cl4 N8 O8 -","4","1","IS6033","Fu-You Pan; Jian-Guo Yang","<i>N</i>'-(2-Chlorobenzylidene)-2-hydroxybenzohydrazide","Acta Crystallographica Section E","2005","61","2","o354","o355","10.1107/S1600536805000735","","","0.71073","MoKα","","0.1862","0.0438","","","0.1002","0.1401","","","","","","0.979","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205092","9.5485","0.0016","8.2197","0.0013","25.94","0.004","90","","90","","90","","2035.9","0.6","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","2-Acetyl-3'-chloroacetanilide","N-(3-chlorophenyl)-3-oxobutanamide","","- C10 H10 Cl N O2 -","- C10 H10 Cl N O2 -","- C80 H80 Cl8 N8 O16 -","8","1","IS6034","Tai, Xi-Shi; Liu, Wan-Yi; Liu, Yan-Zhen; Li, Yi-Zhi","2-Acetyl-3'-chloroacetanilide","Acta Crystallographica Section E","2005","61","2","o389","o390","10.1107/S1600536805001145","","","0.71073","MoKα","","0.0844","0.0413","","","0.0678","0.0748","","","","","","0.979","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205093","8.3294","0.0006","22.4059","0.0016","14.5461","0.0011","90","","102.241","0.001","90","","2653","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-Bipyridinium‒5-nitroisophthalate‒5-nitroisophthalic acid‒water (1/1/1/2)","","- C26 H22 N4 O14 -","- C26 H22 N4 O14 -","- C104 H88 N16 O56 -","4","1","IS6035","Di-Mei Chen; Xin-Hua Li; Hong-Ping Xiao; Mao-Lin Hu","2,2'-Bipyridinium 5-nitroisophthalate 5-nitroisophthalic acid dihydrate","Acta Crystallographica Section E","2005","61","2","o317","o319","10.1107/S1600536805000759","","","0.71073","MoKα","","0.0844","0.0732","","","0.1511","0.1569","","","","","","1.228","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205095","9.8406","0.0006","10.1729","0.0006","15.2354","0.0009","73.5009","0.0013","84.7304","0.0014","80.783","0.0013","1441.76","0.15","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Aquabis(2,2'-bipyridine)(3-carboxylato-4-hydroxybenzenesulfonato)manganese(II) dihydrate","","- C27 H26 Mn N4 O9 S -","- C27 H26 Mn N4 O9 S -","- C54 H52 Mn2 N8 O18 S2 -","2","1","IS6038","Fan, Sai-Rong; Zhu, Long-Guan; Xiao, Hong-Ping; Ng, Seik Weng","Aquabis(2,2'-bipyridine)(3-carboxylato-4-hydroxybenzenesulfonato)manganese(II) dihydrate","Acta Crystallographica Section E","2005","61","2","m377","m378","10.1107/S1600536805002321","","","0.71073","MoKα","","0.059","0.048","","","0.119","0.125","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205096","9.3627","0.0012","9.61","0.0013","11.7698","0.0015","87.956","0.003","72.496","0.002","79.561","0.002","993","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Tetramethylpyrazinium‒trichloroacetate‒trichloroacetic acid (1/1/1)","","- C12 H14 Cl6 N2 O4 -","- C12 H14 Cl6 N2 O4 -","- C24 H28 Cl12 N4 O8 -","2","1","IS6039","Di-Mei Chen; Feng-Yi Xia; Mao-Lin Hu; Li Li; Zhi-Min Jin","2,3,5,6-Tetramethylpyrazinium‒trichloroacetate‒trichloroacetic acid (1/1/1)","Acta Crystallographica Section E","2005","61","2","o419","o420","10.1107/S1600536805001741","","","0.71073","MoKα","","0.0719","0.0631","","","0.1769","0.1853","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205097","9.9505","0.0014","11.1049","0.0014","12.1187","0.0014","74.621","0.002","66.75","0.002","89.352","0.002","1179.7","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","μ-Terephthalato-bis[bis(2,2'-bipyridine)copper(II)] diperchlorate dihydrate","","- C48 H40 Cl2 Cu2 N8 O14 -","- C48 H40 Cl2 Cu2 N8 O14 -","- C48 H40 Cl2 Cu2 N8 O14 -","1","0.5","IS6040","Sai-Zhen Yang; Xin-Hua Li","μ-Terephthalato-bis[bis(2,2'-bipyridine)copper(II)] bis(perchlorate) dihydrate","Acta Crystallographica Section E","2005","61","2","m356","m357","10.1107/S1600536805001753","","","0.71073","MoKα","","0.0496","0.0448","","","0.1193","0.1233","","","","","","1.049","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2205098","4.7477","0.0005","5.568","0.0011","44.455","0.005","87.619","0.013","87.92","0.009","77.733","0.011","1146.9","0.3","296","1","","","","","","","","","","3","P -1","-P 1","2","","Henicosane-1,21-dithiol","","- C21 H44 S2 -","- C21 H44 S2 -","- C42 H88 S4 -","2","1","IS6041","Naotake Nakamura; Hirotaka Shimizu; Yoshihiro Ogawa","Henicosane-1,21-dithiol","Acta Crystallographica Section E","2005","61","2","o450","o452","10.1107/S1600536805002400","","","1.5418","CuKα","","","0.056","","","","0.123","","","","","","1.001","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205099","19.9073","0.0015","10.2232","0.0005","11.0723","0.0007","90","","104.705","0.002","90","","2179.6","0.2","295","3","295","3","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(4-hydroxybenzoato-κ^2^O,O')(1,10-phenanthroline-κ^2^N,N')copper(II)","","- C26 H18 Cu N2 O6 -","- C26 H18 Cu N2 O6 -","- C104 H72 Cu4 N8 O24 -","4","0.5","IS6042","Jian-Rong Su; Jian-Ming Gu; Duan-Jun Xu","Bis(4-hydroxybenzoato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)","Acta Crystallographica Section E","2005","61","2","m379","m381","10.1107/S1600536805002333","","","0.71073","MoKα","","0.049","0.039","","","0.104","0.109","","","","","","0.988","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205100","11.33","0.002","6.9142","0.0013","17.913","0.003","90","","107.145","0.003","90","","1340.9","0.4","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","4,5,9,14-Tetramethyl-19-norcholest-24-en-3-one","4,5,9,14-Tetramethyl-19-norcholest-24-en-3-one","","- C30 H50 O -","- C30 H50 O -","- C60 H100 O2 -","2","1","KP6020","Liu, Ke-Yue; Gao, Wen-Yuan; Zhang, Tie-Jun; Chen, Hai-Xia; Surname, Zhou-Bin","4,5,9,14-Tetramethyl-19-norcholest-24-en-3-one","Acta Crystallographica Section E","2005","61","2","o391","o392","10.1107/S1600536805000875","","","0.71073","MoKα","","0.091","0.0482","","","0.1131","0.1366","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205101","13.02","0.006","6.608","0.003","15.119","0.007","90","","113.109","0.007","90","","1196.4","1","293","2","566","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","6-fluoro-3-(4-piperidinio)benz[d]isoxazole chloride","","- C12 H14 Cl F N2 O -","- C12 H14 Cl F N2 O -","- C48 H56 Cl4 F4 N8 O4 -","4","1","KP6027","Yathirajan, H. S.; Narasimhamurthy, T.; Nagaraj, B.; Nagaraja, P.; Narasegowda, R. S.; Rathore, Ravindranath S.","N—H^+^···Cl^{-^} and C—H···O interactions in 6-fluoro-3-(4-piperidinio)benz[<i>d</i>]isoxazole chloride","Acta Crystallographica Section E","2005","61","2","o356","o358","10.1107/S1600536805000899","","","0.71073","MoKα","","0.0472","0.0422","","","0.1116","0.1155","","","","","","1.096","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205102","10.247","0.002","12.387","0.003","21.858","0.002","90","","90.59","0.01","90","","2774.3","0.9","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Benzoylacetone 4-methoxybenzoylhydrazonato-κ^3^O,N,O')(N- benzoylhydroxylaminato-κ^2^O,O')oxovanadium(IV)","","- C31 H26 N3 O6 V -","- C31 H26 N3 O6 V -","- C124 H104 N12 O24 V4 -","4","1","KP6031","Gao, Shan; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","(Benzoylacetone 4-methoxybenzoylhydrazonato-κ^3^<i>O,N,O</i>')(<i>N</i>-benzoylhydroxylaminato-κ^2^<i>O,O</i>')oxovanadium(IV)","Acta Crystallographica Section E","2005","61","2","m325","m326","10.1107/S1600536805000929","","","0.71073","MoKα","","0.047","0.036","","","0.105","0.11","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2205103","17.2129","0.0009","13.501","0.0007","11.3932","0.0006","90","","103.979","0.001","90","","2569.3","0.2","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(5-bromo-N-cyclohexylsalicylideneaminato-κ^2^N,O)nickel(II)","","- C26 H30 Br2 N2 Ni O2 -","- C26 H30 Br2 N2 Ni O2 -","- C104 H120 Br8 N8 Ni4 O8 -","4","0.5","KP6032","Sun, Yu-Xi; Ng, Seik Weng","Bis(5-bromo-<i>N</i>-cyclohexylsalicylideneaminato-κ^2^<i>N,O</i>)nickel(II)","Acta Crystallographica Section E","2005","61","2","m323","m324","10.1107/S1600536805000930","","","0.71073","MoKα","","0.044","0.033","","","0.084","0.091","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205104","11.663","0.002","11.695","0.002","18.348","0.004","90","","105.38","0.03","90","","2413","0.9","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(Z)-2,3-Bis(2-phenylindozin-3-yl)-2-butenedinitrile","","- C32 H20 N4 -","- C32 H20 N4 -","- C128 H80 N16 -","4","1","KP6033","Liu, Wei-Wei; Li, Yi-Zhi; Sun, Run-Kun; Hu, Hong-Wen; Wu, Qiang-Jin; Huang, Zi-Xiang","(<i>Z</i>)-2,3-Bis(2-phenylindolizin-3-yl)-2-butenedinitrile","Acta Crystallographica Section E","2005","61","2","o445","o447","10.1107/S1600536805001820","","","0.71073","MoKα","","0.1049","0.0648","","","0.1265","0.1371","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205105","10.433","0.001","7.458","0.001","7.238","0.001","90","","113.3","0.02","90","","517.25","0.14","14","","14","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","1,3,5-triazine-2,4,6-triamine","","- C3 H6 N6 -","- C3 H6 N6 -","- C12 H24 N24 -","4","1","LH6307","Cousson, A.; Nicolaï, B.; Fillaux, F.","Melamine (1,3,5-triazine-2,4,6-triamine): a neutron diffraction study at 14K","Acta Crystallographica Section E","2005","61","2","o222","o224","10.1107/S160053680403332X","","neutron","0.831","neutron","","0.0557","0.0467","","0.0438","0.0434","0.0434","","","","","","1.1111","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205106","18.7","0.003","19.717","0.004","15.728","0.003","90","","114.45","0.01","90","","5279","1.7","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Aqua{2-[(E)-3,5-dibromo-2-oxidobenzylideneamino]ethanesulfonato}(1,10- phenanthroline)zinc(II) ethanol solvate","","- C23 H23 Br2 N3 O6 S Zn -","- C23 H23 Br2 N3 O6 S Zn -","- C184 H184 Br16 N24 O48 S8 Zn8 -","8","1","LH6315","Shu-Hua Zhang; Yi-Min Jiang; Kai-Bei Yu","Aqua{2-[(<i>E</i>)-3,5-dibromo-2-oxidobenzylideneamino]ethanesulfonato}(1,10-phenanthroline)zinc(II) ethanol solvate","Acta Crystallographica Section E","2005","61","2","m209","m211","10.1107/S1600536804033562","","","0.71073","MoKα","","0.0865","0.034","","","0.0572","0.0623","","","","","","0.825","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205107","9.826","0.003","8.235","0.002","16.073","0.005","90","","95.857","0.005","90","","1293.8","0.6","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Mercury dibromide bis-oxypyridine","(2,2'-Bipyridine N,N'-dioxide-κ^2^O,O')dibromo-mercury(II)","","- C10 H8 Br2 Hg N2 O2 -","- C10 H8 Br2 Hg N2 O2 -","- C40 H32 Br8 Hg4 N8 O8 -","4","1","LH6337","Tedmann, Onyango M.; Zavalij, Peter Y.; Madan, Stanley K.; Oliver, Scott R.J.","(2,2'-Bipyridine <i>N</i>,<i>N</i>'-dioxide-κ^2^<i>O</i>,<i>O</i>')dibromomercury(II)","Acta Crystallographica Section E","2005","61","2","m212","m213","10.1107/S1600536804033690","","","0.71073","MoKα","","0.0669","0.0418","","","0.0991","0.1128","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205108","9.433","0.004","15.69","0.007","10.024","0.005","90","","108.998","0.006","90","","1402.8","1.1","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Mercury diiodide bis-oxypyridine","(2,2'-Bypiridine N,N'-dioxide-κ^2^O,O')diiodinemercury(II)","","- C10 H8 Hg I2 N2 O2 -","- C10 H8 Hg I2 N2 O2 -","- C40 H32 Hg4 I8 N8 O8 -","4","1","LH6338","Tedmann, Onyango M.; Zavalij, Peter Y.; Madan, Stanley K.; Oliver, Scott R.J.","(2,2'-Bipyridine <i>N</i>,<i>N</i>'-dioxide-κ^2^<i>O</i>,<i>O</i>')diiodomercury(II)","Acta Crystallographica Section E","2005","61","2","m214","m216","10.1107/S1600536804033707","","","0.71073","MoKα","","0.1003","0.0541","","","0.0606","0.0686","","","","","","0.86","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205109","27.612","0.0002","7.947","0.0003","5.977","0.001","90","","90","","90","","1311.5","0.2","150","2","150","2","","","","","","","","4","P c a 21","P 2c -2ac","29","p-methylphenyl p-toluenesulfonate","4-methylphenyl 4-toluenesulfonate","","- C14 H14 O3 S -","- C14 H14 O3 S -","- C56 H56 O12 S4 -","4","1","LH6339","Vadivelu Manivannan; Nagarajan Vembu; Maruthai Nallu; Kandasamy Sivakumar; Fronczek, Frank R.","4-Methylphenyl 4-toluenesulfonate: supramolecular aggregation through weak C—H···O and C—H···π interactions","Acta Crystallographica Section E","2005","61","2","o242","o244","10.1107/S1600536804033343","","","0.71073","MoKα","","0.0744","0.0389","","","0.0779","0.0833","","","","","","0.852","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205110","5.36","0.009","8.697","0.014","27.46","0.05","90","","90.17","0.03","90","","1280","4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(4-Chlorophenyl)-3-hydroxy-1-phenylpropan-1-one","","- C15 H13 Cl O2 -","- C15 H13 Cl O2 -","- C60 H52 Cl4 O8 -","4","1","LH6340","Yu, Zhifang; Gu, Xiuyan; Zhao, Bing; Tian, Zhongzhen","3-(4-Chlorophenyl)-3-hydroxy-1-phenylpropan-1-one","Acta Crystallographica Section E","2005","61","2","o225","o226","10.1107/S1600536804033719","","","0.71073","MoKα","","0.0776","0.0453","","","0.1371","0.1668","","","","","","1.065","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205111","24.321","0.003","5.0468","0.0005","8.6066","0.0008","90","","90","","90","","1056.4","0.19","173","2","173","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","3-(p-Nitrobenzyl)-1,3-thiazolidine-2,4-dione","","- C10 H8 N2 O4 S -","- C10 H8 N2 O4 S -","- C40 H32 N8 O16 S4 -","4","1","LH6342","Yathirajan, Hemmige S.; Rai, Kuriya M. Lokanatha; Gaonkar, Santhosh L.; Narasegowda, Rajenahally S.; Prabhuswamy, Basappa; Bolte, Michael","3-(<i>p</i>-Nitrobenzyl)-1,3-thiazolidine-2,4-dione","Acta Crystallographica Section E","2005","61","2","o245","o246","10.1107/S1600536804033951","","","0.71073","MoKα","","0.0514","0.0483","","","0.1212","0.1235","","","","","","1.018","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205112","19.4607","0.001","10.5889","0.0015","9.0394","0.0012","90","","99.948","0.008","90","","1834.7","0.4","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-Decylphenyl)pyridin-4(1H)-one","","- C21 H29 N O -","- C21 H29 N O -","- C84 H116 N4 O4 -","4","1","LH6343","Li, Chenguang; Wolf, Jeremy R.; Dyer, Daniel J.; Robinson, Paul D.","1-(4-Decylphenyl)pyridin-4(1<i>H</i>)-one","Acta Crystallographica Section E","2005","61","2","o233","o235","10.1107/S1600536804033963","","","0.71069","MoKα","","0.127","0.038","","","0.098","0.129","","","","","","0.99","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205113","15.83","0.001","9.785","0.0008","30.02","0.002","90","","96.533","0.002","90","","4619.8","0.6","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[μ-3,5-bis(2-pyridyl)-4-(4-isopropylphenyl)-4H-1,2,4-triazole[disilver(I) diperchlorate acetonitrile solvate","","- C44 H41 Ag2 Cl2 N11 O8 -","- C44 H41 Ag2 Cl2 N11 O8 -","- C176 H164 Ag8 Cl8 N44 O32 -","4","0.5","LH6344","You, Zhong-Lu; Shao, Si-Chang; Zhang, Shu-Ping; Zhu, Hai-Liang; Ng, Seik Weng","Bis[μ-3,5-bis(2-pyridyl)-4-(4-isopropylphenyl)-4<i>H</i>-1,2,4-triazole]disilver(I) diperchlorate acetonitrile solvate","Acta Crystallographica Section E","2005","61","2","m265","m267","10.1107/S1600536805000243","","","0.71073","MoKα","","0.096","0.053","","","0.122","0.15","","","","","","0.996","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205114","9.695","0.002","17.266","0.004","23.543","0.004","90","","90","","90","","3941","1.4","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","β-Methyl-γ-bis(N,O-8-quinolinoxy)germa-γ-lactone","","- C22 H18 Ge N2 O4 -","- C22 H18 Ge N2 O4 -","- C176 H144 Ge8 N16 O32 -","8","1","LH6346","Mahboob, Sumera; Parvez, Masood; Mazhar, Muhammad; Ali, Saqib","β-Methyl-γ,γ-bis(8-quinolinoxy)germa-γ-lactone","Acta Crystallographica Section E","2005","61","2","m358","m360","10.1107/S1600536805001455","","","0.71073","MoKα","","0.066","0.04","","","0.093","0.107","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205115","12.0013","0.0011","11.1465","0.0011","5.2327","0.0004","90","","90","","90","","699.99","0.11","295","2","295","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","7-Methyl-1H-indazole","","- C8 H8 N2 -","- C8 H8 N2 -","- C32 H32 N8 -","4","1","LH6347","Foces-Foces, C.","Hydrogen-bonded networks in 1<i>H</i>-indazoles: the case of 7-methyl-1<i>H</i>-indazole","Acta Crystallographica Section E","2005","61","2","o337","o339","10.1107/S160053680500070X","","","1.5418","CuKα","","0.044","0.0389","","","0.1098","0.1154","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205116","7.195","0.001","8.629","0.002","11.522","0.002","90","","97.59","0.03","90","","709.1","0.2","163","2","163","2","","","","","","","","5","P 1 21 1","P 2yb","4","hemiprotonated 1-methylcytosine","1-Methylcytosinium iodide 1-methylcytosine","","- C10 H15 I N6 O2 -","- C10 H15 I N6 O2 -","- C20 H30 I2 N12 O4 -","2","1","LH6348","Jens Müller; Eva Freisinger","[(1-Methylcytosine)~2~H]I, an asymmetric base pair","Acta Crystallographica Section E","2005","61","2","o320","o322","10.1107/S1600536805000693","","","0.71069","MoKα","","0.0247","0.0204","","","0.0421","0.0429","","","","","","0.98","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205117","3.722","0.001","6.263","0.003","26.506","0.009","90","","94.41","0.02","90","","616","0.4","93.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H10 N4 O2 -","- C16 H10 N4 O2 -","- C32 H20 N8 O4 -","2","0.5","LH6349","Mizuguchi, Jin; Imoda, Tomohiko; Takahashi, Hiroo","3,6-Di-4-pyridylpyrrolo[3,4-<i>c</i>]pyrrole-1,4(2<i>H</i>,5<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","2","o500","o502","10.1107/S1600536805002114","","","1.5419","CuKα","","","0.241","","","","0.5649","","","","","","1.778","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205118","9.5311","0.0008","12.5662","0.001","14.9862","0.0012","90","","103.774","0.007","90","","1743.3","0.3","200","","200","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","N,N'-(o-Phenylene)dibenzenesulfonamide","N,N'-(o-Phenylene)dibenzenesulfonamide","","- C18 H16 N2 O4 S2 -","- C18 H16 N2 O4 S2 -","- C72 H64 N8 O16 S8 -","4","1","LH6351","Bryan, Jeffrey C.; Rosenberg, Jay M.; Kavallieratos, Konstantinos","<i>N</i>,<i>N</i>'-(<i>o</i>-Phenylene)dibenzenesulfonamide","Acta Crystallographica Section E","2005","61","2","o396","o397","10.1107/S1600536805001133","","","0.71073","MoKα","","0.047","0.033","","","0.084","0.09","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205119","7.7129","0.0004","11.5063","0.0006","13.3854","0.0007","82.614","0.001","83.165","0.001","72.724","0.001","1120.8","0.1","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[bis[aqua(1,10-phenanthroline-κ^2^N,N')cobalt(II)]- di-μ-4,4'-oxydibenzoato-1:2κ^4^O:O']","","- C52 H36 Co2 N4 O12 -","- C52 H36 Co2 N4 O12 -","- C52 H36 Co2 N4 O12 -","1","0.5","LH6352","Xiao, Hong-Ping; Li, Xin-Hua; Ng, Seik Weng","<i>catena</i>-Poly[bis[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II)]-di-μ-4,4'-oxydibenzoato-1:2κ^4^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","2","m344","m345","10.1107/S1600536805001558","","","0.71073","MoKα","","0.037","0.034","","","0.09","0.092","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205120","7.1227","0.0001","7.7284","0.0001","11.4138","0.0001","90","","90","","90","","628.296","0.013","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Lithium Chloride Dioxane","poly[μ~2~-chloro-μ~2~-dioxane-κ^2^O:O'-lithium(I)]","","- C4 H8 Cl Li O2 -","- C4 H8 Cl Li O2 -","- C16 H32 Cl4 Li4 O8 -","4","1","LH6353","Morris, J. Jacob; Noll, Bruce C.; Henderson, Kenneth W.","A redetermination of lithium chloride dioxane","Acta Crystallographica Section E","2005","61","2","m351","m353","10.1107/S1600536805001716","","","0.71073","MoKα","","0.0177","0.017","","","0.0452","0.0454","","","","","","1.083","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205121","8.033","0.004","10.55","0.007","14.662","0.009","97.75","0.07","97.87","0.04","103.97","0.05","1176.1","1.3","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","trans-4-[(4-Dimethylaminophenyl)ethenyl]-N-methylquinolinium p-toluenesulfonate monohydrate","","- C27 H30 N2 O4 S -","- C27 H30 N2 O4 S -","- C54 H60 N4 O8 S2 -","2","1","LH6354","Coe, Benjamin J.; Hall, Jonathan J.; Harris, James A.; Brunschwig, B. S.; Coles, Simon J.; Hursthouse, Michael B.","<i>trans</i>-4-[(4-Dimethylaminophenyl)ethenyl]-<i>N</i>-methylquinolinium <i>p</i>-toluenesulfonate monohydrate","Acta Crystallographica Section E","2005","61","2","o464","o467","10.1107/S1600536805002138","","","0.71073","MoKα","","0.0637","0.045","","","0.1126","0.1258","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205122","19.805","0.003","7.988","0.002","7.369","0.002","90","","98.18","0.02","90","","1153.9","0.5","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(2-Nitrophenylsulfonyl)glycine methyl ester","","- C9 H10 N2 O6 S -","- C9 H10 N2 O6 S -","- C36 H40 N8 O24 S4 -","4","1","NC6016","Laurent F. Bornaghi; Sally-Ann Poulsen; Peter C. Healy; Alan R. White","<i>N</i>-(2-Nitrophenylsulfonyl)glycine methyl ester","Acta Crystallographica Section E","2005","61","2","o323","o325","10.1107/S1600536805000784","","","0.7107","MoKα","","0.075","0.0496","","","0.1504","0.2061","","","","","","1.088","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205123","5.8182","0.0005","9.5061","0.0007","15.461","0.001","90","","93.89","0.006","90","","853.15","0.11","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Cyano-3-(4-hydroxyphenyl)acrylic acid","","- C10 H7 N O3 -","- C10 H7 N O3 -","- C40 H28 N4 O12 -","4","1","NC6017","Karas, Michael; Fournier, Isabelle; Bolte, Michael","2-Cyano-3-(4-hydroxyphenyl)acrylic acid","Acta Crystallographica Section E","2005","61","2","o383","o384","10.1107/S1600536805001480","","","0.71073","MoKα","","0.0362","0.0325","","","0.09","0.093","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205124","14.692","0.002","14.692","0.002","8.0106","0.0013","90","","90","","90","","1729.1","0.4","173","2","173","2","","","","","","","","4","P -4 21 c","P -4 2n","114","","2-(5-Ethylpyridin-2-yl)ethanol","","- C9 H13 N O -","- C9 H13 N O -","- C72 H104 N8 O8 -","8","1","NC6018","Yathirajan, Hemmige S.; Gaonkar, Santhosh L.; Bolte, Michael","2-(5-Ethylpyridin-2-yl)ethanol","Acta Crystallographica Section E","2005","61","2","o492","o493","10.1107/S1600536805001947","","","0.71073","MoKα","","0.0348","0.0284","","","0.0685","0.07","","","","","","0.979","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205125","16.778","0.002","7.4093","0.0007","9.8472","0.0011","90","","106.097","0.009","90","","1176.1","0.2","173","2","173","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Phosphenium bromide","","- C12 H12 Br P -","- C12 H12 Br P -","- C48 H48 Br4 P4 -","4","0.5","NC6019","Dornhaus, Franz; Lerner, Hans-Wolfram; Bolte, Michael","Diphenylphosphenium bromide","Acta Crystallographica Section E","2005","61","2","o448","o449","10.1107/S1600536805002151","","","0.71073","MoKα","","0.0426","0.0406","","","0.0948","0.0961","","","","","","1.079","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205126","11.0428","0.0012","18.507","0.002","10.1462","0.0011","90","","104.547","0.009","90","","2007.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1'-(1-Hydroxyethyl)-N,N-diphenylferrocene-1-carboxamide","","- C25 H23 Fe N O2 -","- C25 H23 Fe N O2 -","- C100 H92 Fe4 N4 O8 -","4","1","NG6077","Cetina, Mario; Đaković, Senka; Hergold-Brundić, Antonija; Rapić, Vladimir","1'-(1-Hydroxyethyl)-<i>N,N</i>-diphenylferrocene-1-carboxamide","Acta Crystallographica Section E","2005","61","2","m307","m310","10.1107/S1600536804033379","","","0.71073","MoKα","","0.0785","0.0663","","","0.1595","0.1687","","","","","","1.168","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205127","12.513","0.003","15.918","0.003","12.122","0.002","90","","115.32","0.03","90","","2182.5","0.9","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H52 Cu2 N8 O12 -","- C40 H52 Cu2 N8 O12 -","- C80 H104 Cu4 N16 O24 -","2","0.5","NG6080","Jin Yang; Li Li; Jian-Fang Ma; Ying-Ying Liu","A dinuclear copper complex with a <i>p</i>-aminobenzoate anion","Acta Crystallographica Section E","2005","61","2","m237","m239","10.1107/S1600536804034336","","","0.71073","MoKα","","0.0483","0.0299","","","0.0743","0.0896","","","","","","0.957","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2205128","5.5677","0.0011","6.3662","0.0013","11.62","0.002","102.11","0.03","95.59","0.03","106.68","0.03","380.26","0.16","296","2","296","2","","","","","","","","4","P -1","-P 1","2","Hexaaquamagnesium(II) benzene-1,4-dioxyacetate","Hexaaquamagnesium(II) p-phenylenebis(oxyacetate)","","- C10 H20 Mg O12 -","- C10 H20 Mg O12 -","- C10 H20 Mg O12 -","1","0.5","NG6081","Yang, Qian; Gao, Shan; Huo, Li-Hua","Hexaaquamagnesium(II) benzene-1,4-dioxyacetate","Acta Crystallographica Section E","2005","61","2","m277","m278","10.1107/S1600536805000498","","","0.71073","MoKα","","0.0529","0.0458","","","0.1204","0.122","","","","","","1.02","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205129","8.4342","0.0018","9.391","0.002","10.36","0.002","79.941","0.003","71.597","0.003","89.332","0.003","765.8","0.3","183","2","183","2","","","","","","","","4","P -1","-P 1","2","Ethyl 2-aceto-3-tryptamino-2-propenoate","Ethyl 2-acetyl-3-[2-(1H-indol-3-yl)ethylamino]propenoate","","- C17 H20 N2 O3 -","- C17 H20 N2 O3 -","- C34 H40 N4 O6 -","2","1","OB6457","Fan, Ning-Juan; Li, Dong-Hong; Jiang, Xiao-Ming; Zhang, Yong-Bin; Guo, Wei; Xia, Chi-Zhong","Ethyl 2-acetyl-3-[2-(1<i>H</i>-indol-3-yl)ethylamino]propenoate","Acta Crystallographica Section E","2005","61","2","o373","o374","10.1107/S1600536805001261","","","0.71073","MoKα","","0.0531","0.0429","","","0.1054","0.1108","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205130","8.2523","0.0007","19.6807","0.0016","10.2857","0.0008","90","","105.388","0.001","90","","1610.6","0.2","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-Acetamido-N-(2-chlorophenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide","","- C17 H17 Cl N2 O2 S -","- C17 H17 Cl N2 O2 S -","- C68 H68 Cl4 N8 O8 S4 -","4","1","OB6458","Chandra Kumar, K.; Kokila, M. K.; Puttaraja; Mohan, S.; Manjunath Shetty, K. S.; Kulkarni, Manohar V.","2-Acetamido-<i>N</i>-(2-chlorophenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide","Acta Crystallographica Section E","2005","61","2","o304","o306","10.1107/S1600536805000103","","","0.71073","MoKα","","0.0484","0.043","","","0.1217","0.1273","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205131","15.3802","0.0006","5.4473","0.0002","18.0635","0.0008","90","","90","","90","","1513.37","0.11","120","","120","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3R,4R,5S)-5-(Acetamidomethyl)-N-benzyl-3,4-dihydroxytetrahydrofuran- 3-carboxamide","","- C15 H20 N2 O5 -","- C15 H20 N2 O5 -","- C60 H80 N8 O20 -","4","1","OB6459","Punzo, Francesco; Watkin, David J.; Iezzi Simone, Michela; Fleet, George W. J.","(3<i>R</i>,4<i>R</i>,5<i>S</i>)-5-(Acetamidomethyl)-<i>N</i>-benzyl-3,4-dihydroxytetrahydrofuran-3-carboxamide","Acta Crystallographica Section E","2005","61","2","o513","o515","10.1107/S1600536805001467","","","0.71073","MoKα","","0.0465","0.034","","0.0769","0.0735","0.0769","","","","","","0.9344","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205132","8.1624","0.0003","8.5569","0.0003","11.6","0.0005","90","","90","","90","","810.2","0.05","120","","120","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2C-Methyl-D-arabinono-1,4-lactone","","- C6 H12 O6 -","- C6 H12 O6 -","- C24 H48 O24 -","4","1","OB6460","Punzo, Francesco; Watkin, David J.; Jenkinson, Sarah F.; Fleet, George W. J.","2<i>C</i>-Methyl-<small>D</small>-arabinono-1,4-lactone monohydrate","Acta Crystallographica Section E","2005","61","2","o326","o327","10.1107/S1600536805000723","","","0.71073","MoKα","","0.0369","0.0306","","0.0709","0.0687","0.0709","","","","","","0.977","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205133","18.285","0.004","10.779","0.003","16.152","0.004","90","","113.652","0.004","90","","2916","1.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(±)-(3aRS,4SR)-9-Chloro-3a,4-diethoxy-6,8-dimethoxy-2- (2-chloro-4-nitrophenyl)-4-(4-chlorophenyl)chromano[4,3-d]-Δ^1,9b^-1,2,3- thiadiazoline","","- C27 H24 Cl3 N3 O7 S -","- C27 H24 Cl3 N3 O7 S -","- C108 H96 Cl12 N12 O28 S4 -","4","1","OB6461","Yong-Zhou Hu; Hua-Zhou Ying","(±)-(3a<i>RS</i>,4<i>SR</i>)-9-Chloro-2-(2-chloro-4-nitrophenyl)-4-(4-chlorophenyl)-3a,4-diethoxy-6,8-dimethoxychromano[4,3-<i>d</i>]-Δ^1,9^^b^-1,2,3-thiadiazoline","Acta Crystallographica Section E","2005","61","2","o416","o418","10.1107/S1600536805001807","","","0.71073","MoKα","","0.0875","0.0485","","","0.1026","0.1148","","","","","","0.891","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205134","13.337","0.003","5.3977","0.0014","14.312","0.004","90","","109.898","0.019","90","","968.8","0.4","298","1","298","1","","","","","","","","4","P 1 21 1","P 2yb","4","","4,4'-(2-Methyl-1H-imidazole-4,5-diyl)bis[2(S)-methyl-3-azoniabutanoate] acetic acid monohydrate","","- C14 H26 N4 O7 -","- C14 H26 N4 O7 -","- C28 H52 N8 O14 -","2","1","OB6462","Gasque, Laura; Mijangos, Edgar; Bernès, Sylvain","4,4'-(2-Methyl-1<i>H</i>-imidazole-4,5-diyl)bis[2(<i>S</i>)-methyl-3-azoniabutanoate] acetic acid monohydrate","Acta Crystallographica Section E","2005","61","2","o284","o286","10.1107/S1600536805000115","","","0.71073","MoKα","","0.0585","0.0413","","","0.106","0.1173","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205135","7.4853","0.0017","13.449","0.003","22.653","0.005","90","","90","","90","","2280.5","0.9","297","2","297","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","(±)-(1SR,8RS,10RS)-9,9,10-Tribromotricyclo[6.2.1.0^2,7^]undeca-2,4,6-triene","","- C11 H9 Br3 -","- C11 H9 Br3 -","- C88 H72 Br24 -","8","1","OB6464","Ersanlı, Cem Cüneyt; Çoruh, Ufuk; Tuncer, Hökelek; Vázquez-López, Ezequiel M.; Arif, Daştan","(±)-(1<i>SR</i>,8<i>RS</i>,10<i>RS</i>)-9,9,10-Tribromotricyclo[6.2.1.0^2,7^]undeca-2,4,6-triene","Acta Crystallographica Section E","2005","61","2","o263","o265","10.1107/S1600536805000255","","","0.71073","MoKα","","0.0863","0.0326","","","0.059","0.0662","","","","","","0.817","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205136","5.737","0.002","18.801","0.006","16.518","0.006","90","","93.368","0.004","90","","1778.6","1.1","150.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[bis(μ~4~-hexafluoroglutarato)bis(tetrahydrofuran)tetrasilver(I)]- μ~2~-4,4'-biphenyldicarbonitrile]","","- C32 H24 Ag4 F12 N2 O10 -","- C32 H24 Ag4 F12 N2 O10 -","- C64 H48 Ag8 F24 N4 O20 -","2","0.5","OB6465","Liu, Shu-Qin; Konaka, Hisashi; Kuroda-Sowa, Takayoshi; Munakata, Megumu","<i>catena</i>-Poly[[bis(μ~4~-hexafluoroglutarato)bis(tetrahydrofuran)tetrasilver(I)]-μ~2~-4,4'-biphenyldicarbonitrile]","Acta Crystallographica Section E","2005","61","2","m251","m253","10.1107/S1600536805000267","","","0.7107","MoKα","","","0.025","","","","0.0465","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205137","15.105","0.002","7.398","0.002","15.056","0.002","90","","112.72","0.01","90","","1551.9","0.5","273","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Nitrato[1-(2-pyridylmethyliminomethyl)naphthalen-2-olato]zinc(II)","","- C17 H13 N3 O4 Zn -","- C17 H13 N3 O4 Zn -","- C68 H52 N12 O16 Zn4 -","4","1","OB6466","Yang, De-Suo","Nitrato[1-(2-pyridylmethyliminomethyl)naphthalen-2-olato]zinc(II)","Acta Crystallographica Section E","2005","61","2","m247","m248","10.1107/S1600536805000279","","","0.71073","MoKα","","0.0464","0.039","","","0.1086","0.1137","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205138","14.996","0.001","13.597","0.001","25.156","0.002","90","","90","","90","","5129.3","0.7","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Bis[4-bromo-2-(cyclohexyliminomethyl)phenolato]copper(II)","","- C26 H30 Br2 Cu N2 O2 -","- C26 H30 Br2 Cu N2 O2 -","- C208 H240 Br16 Cu8 N16 O16 -","8","1","OB6467","Yang, De-Suo","Bis[4-bromo-2-(cyclohexyliminomethyl)phenolato]copper(II)","Acta Crystallographica Section E","2005","61","2","m249","m250","10.1107/S1600536805000280","","","0.71073","MoKα","","0.0705","0.0431","","","0.1043","0.1169","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205139","7.252","0.004","7.442","0.004","13.43","0.008","93.49","0.05","98.74","0.05","94.56","0.05","712.2","0.7","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2-Methyl-6-(1,7,7-trimethylbicyclo[2.2.1]hept-2-yl)phenol","","- C17 H24 O -","- C17 H24 O -","- C34 H48 O2 -","2","1","OB6469","Oleg Ya. Borbulevych","2-Methyl-6-(1,7,7-trimethylbicyclo[2.2.1]hept-2-yl)phenol","Acta Crystallographica Section E","2005","61","2","o378","o379","10.1107/S1600536805001236","","","0.71073","MoKα","","0.12","0.0457","","","0.1035","0.1148","","","","","","0.785","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205140","17.032","0.002","3.9694","0.0005","35.819","0.005","90","","90","","90","","2421.6","0.5","95","2","95","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","Ethyl 1,3-dibromoazulene-6-carboxylate","","- C13 H10 Br2 O2 -","- C13 H10 Br2 O2 -","- C104 H80 Br16 O16 -","8","2","OB6470","Hussain, Zakir; Oeser, Thomas; Hopf, Henning","Ethyl 1,3-dibromoazulene-6-carboxylate","Acta Crystallographica Section E","2005","61","2","o478","o479","10.1107/S1600536805001972","","","0.71073","MoKα","","0.044","0.042","","","0.091","0.092","","","","","","1.111","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205141","12.2243","0.0006","19.1241","0.001","8.5207","0.0019","90","","90","","90","","1992","0.5","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","12,13-Dihydro-12-oxo-13-phenylbenzo[b]naphth[f][1,4]oxazepine-2,3-dicarbonitrile","","- C25 H13 N3 O2 -","- C25 H13 N3 O2 -","- C100 H52 N12 O8 -","4","1","RN6033","Is̨ik, S̨amil; Yavuz, Metin; Akdemir, Nesuhi; Ağar, Erbil; Özil, Musa","12,13-Dihydro-12-oxo-13-phenylbenzo[<i>b</i>]naphth[<i>f</i>][1,4]oxazepine-2,3-dicarbonitrile","Acta Crystallographica Section E","2005","61","2","o427","o428","10.1107/S1600536805000991","","","0.71073","MoKα","","0.0599","0.0331","","","0.0694","0.0759","","","","","","0.879","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205142","19.7","0.004","13.097","0.003","20.021","0.004","90","","90","","90","","5165.6","1.9","298","2","298","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","Hexaaquazinc(II) bis(perchlorate) 2,5-dimethylpyrazine 1,4-dioxide","","- C12 H28 Cl2 N4 O18 Zn -","- C12 H28 Cl2 N4 O18 Zn -","- C96 H224 Cl16 N32 O144 Zn8 -","8","1","RN6035","Lu, Jian Jun; Shi, Jing Min","Hexaaquazinc(II) bis(perchlorate) bis(2,5-dimethylpyrazine 1,4-dioxide)","Acta Crystallographica Section E","2005","61","2","m327","m328","10.1107/S1600536805001005","","","0.71073","MoKα","","0.0705","0.0542","","","0.1312","0.1415","","","","","","1.058","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205143","9.5998","0.0012","10.8872","0.0013","14.4903","0.0018","79.303","0.002","76.243","0.002","80.467","0.002","1433.7","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(Z)-1-phenyl-2-(3-phenylthiazolidin-2-ylidene)ethanone","","- C17 H15 N O S -","- C17 H15 N O S -","- C68 H60 N4 O4 S4 -","4","2","RN6038","Liang-zhong Xu; Hai-Zhen Xu; Hai-Bin Song; Yong-Qi Qin; Kai Zhou","(<i>Z</i>)-1-Phenyl-2-(3-phenylthiazolidin-2-ylidene)ethanone","Acta Crystallographica Section E","2005","61","2","o459","o460","10.1107/S1600536805002102","","","0.71073","MoKα","","0.0506","0.0351","","","0.0874","0.0955","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205144","17.099","0.003","14.758","0.003","8.002","0.0016","90","","95","0.03","90","","2011.6","0.7","293","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Azidobis(2,2'-bipyridine)cadmium(II)","","- C20 H16 Cd N10 -","- C20 H16 Cd N10 -","- C80 H64 Cd4 N40 -","4","1","RZ6033","Fangfang Jian; Chunlei Li; Hailian Xiao; Pingping Sun","Azidobis(2,2'-bipyridine)cadmium(II)","Acta Crystallographica Section E","2005","61","2","m217","m218","10.1107/S1600536804033537","","","0.71073","MoKα","","0.0447","0.025","","","0.0639","0.0707","","","","","","1.071","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205145","5.8303","0.0001","9.8983","0.0002","24.1599","0.0004","90","","90","","90","","1394.27","0.04","120","","120","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2,2':5,6-Di-O-isopropylidene-2-C-hydroxmethyl-D-talono-1,4-lactone","","- C13 H20 O7 -","- C13 H20 O7 -","- C52 H80 O28 -","4","1","RZ6034","Christopher C. Harding; David J. Watkin; Andrew R. Cowley; Raquel Soengas; Ulla P. Skytte; George W. J. Fleet","2,2':5,6-Di-<i>O</i>-isopropylidene-2-<i>C</i>-hydroxymethyl-<small>D</small>-talono-1,4-lactone","Acta Crystallographica Section E","2005","61","2","o250","o252","10.1107/S1600536804033549","","","0.71073","MoKα","","0.0407","0.0337","","0.0781","0.0758","0.0781","","","","","","0.9556","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205146","9.5001","0.001","9.8823","0.001","9.9403","0.001","98.039","0.002","115.157","0.002","104.092","0.002","787.18","0.14","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","5-(4-nitrophenyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinoline","","- C18 H18 N2 O3 -","- C18 H18 N2 O3 -","- C36 H36 N4 O6 -","2","1","RZ6039","K.Ravikumar; B.Sridhar; M. Mahesh; V. V. Narayana Reddy","A diastereoisomer of pyrano[3,2-<i>c</i>]quinoline","Acta Crystallographica Section E","2005","61","2","o461","o463","10.1107/S1600536805002448","","","0.71073","MoKα","","0.0731","0.061","","","0.1318","0.1386","","","","","","1.153","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205147","11.818","0.004","7.422","0.003","24.425","0.009","90","","90","","90","","2142.4","1.4","298","2","298","2","","","","","","","","6","P n a 21","P 2c -2n","33","","Poly[disilver(I)(Ag—Ag)-μ-4-chlorobenzoato-μ-piperazine]","","- C18 H18 Ag2 Cl2 N2 O4 -","- C18 H18 Ag2 Cl2 N2 O4 -","- C72 H72 Ag8 Cl8 N8 O16 -","4","1","SJ6025","Yang, Song; Zou, Ying; Zhu, Hai-liang","Poly[disilver(I)(<i>Ag</i>—<i>Ag</i>)-μ-4-chlorobenzoato-μ-piperazine]","Acta Crystallographica Section E","2005","61","2","m219","m220","10.1107/S1600536804033732","","","0.71073","MoKα","","0.0505","0.0351","","","0.0833","0.1006","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205148","6.2771","0.0013","9.792","0.002","19.073","0.004","90","","90","","90","","1172.3","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","2-Phenylselanyl-3,5-methano-2H-cyclopenta[b]furan-2-one","2-Phenylselanyl-3,5-methano-2H-cyclopenta[b]furan-2-one","","- C14 H14 O2 Se -","- C14 H14 O2 Se -","- C56 H56 O8 Se4 -","4","1","SJ6027","Thomas Francis; D. Alan R. Happer; Ward T. Robinson","2-Phenylselanyl-3,5-methano-2<i>H</i>-cyclopenta[<i>b</i>]furan-2-one","Acta Crystallographica Section E","2005","61","2","o453","o455","10.1107/S160053680500231X","","","0.71073","MoKα","","0.027","0.0227","","","0.0525","0.0542","","","","","","1.012","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205149","14.768","0.002","13.048","0.002","15.084","0.002","90","","118.349","0.003","90","","2558","0.6","113.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H25 Cl2 N5 O5 Ru -","- C24 H25 Cl2 N5 O5 Ru -","- C96 H100 Cl8 N20 O20 Ru4 -","4","1","SJ6039","Kojima, Takahiko; Weber, David M.; Choma, Christin T.","{<i>N</i>-[Bis(2-pyridyl)methyl]-<i>N</i>,<i>N</i>-bis(2-pyridylmethyl)amine-κ^5^<i>N</i>}chlororuthenium(II) perchlorate methanol solvate","Acta Crystallographica Section E","2005","61","2","m226","m228","10.1107/S1600536804032209","","","0.7107","MoKα","","","0.044","","","","0.1195","","","","","","1.319","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205150","7.866","0.0004","20.076","0.0009","8.106","0.0003","90","","97.794","0.002","90","","1268.26","0.1","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","o-methylphenyl p-toluenesulfonate","2-methylphenyl 4-toluenesulfonate","","- C14 H14 O3 S -","- C14 H14 O3 S -","- C56 H56 O12 S4 -","4","1","SJ6042","Vadivelu Manivannan; Nagarajan Vembu; Maruthai Nallu; Kandasamy Sivakumar; Fronczek, Frank R.","2-Methylphenyl 4-toluenesulfonate: supramolecular aggregation through weak C—H···O, C—H···π and π‒π interactions","Acta Crystallographica Section E","2005","61","2","o239","o241","10.1107/S1600536804033112","","","0.71073","MoKα","","0.069","0.0409","","","0.1047","0.1174","","","","","","0.919","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205151","11.2017","0.001","9.7789","0.0006","13.2237","0.0014","90","","115.035","0.009","90","","1312.4","0.2","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H22 Cu N4 O6 -","- C28 H22 Cu N4 O6 -","- C56 H44 Cu2 N8 O12 -","2","0.5","SJ6045","Jian-Rong Su; Jian-Ming Gu; Duan-Jun Xu","Bis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)bis(4-hydroxybenzoato-κ^2^<i>O,O</i>')copper(II)","Acta Crystallographica Section E","2005","61","2","m244","m246","10.1107/S1600536804034221","","","0.71069","MoKα","","0.045","0.038","","","0.102","0.106","","","","","","1.059","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205152","5.8464","0.0009","8.8422","0.0014","26.927","0.004","90","","90","","90","","1392","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1R,2R)-Ethyl 1-azido-2-hydroxy-2,3-dihydro-1H-pyrrolo[1,2-a]indole-9-carboxylate","","- C14 H14 N4 O3 -","- C14 H14 N4 O3 -","- C56 H56 N16 O12 -","4","1","SU6146","Fernandes, Manuel A.; Koning, Charles B. de; Michael, Joseph P.; Petersen, Riaan L.","(1<i>R</i>,2<i>R</i>)-Ethyl 1-azido-2-hydroxy-2,3-dihydro-1<i>H</i>-pyrrolo[1,2-<i>a</i>]indole-9-carboxylate","Acta Crystallographica Section E","2005","61","2","o269","o271","10.1107/S1600536805000231","","","0.71073","MoKα","","0.0535","0.0323","","","0.0762","0.0828","","","","","","1.086","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205153","7.527","0.005","24.889","0.005","11.757","0.005","90","","106.007","0.005","90","","2117.2","1.7","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Ethyl-1-[2-(1-ethylmorpholinium-1-yl)ethyl]benzimidazolium diiodide monohydrate","","- C17 H29 I2 N3 O2 -","- C17 H29 I2 N3 O2 -","- C68 H116 I8 N12 O8 -","4","1","SU6148","Mehmet Akkurt; Sema Öztürk Yıldırım; Hasan Küçükbay; Ülkü Yılmaz; Orhan Büyükgüngör","3-Ethyl-1-[2-(1-ethylmorpholinium-1-yl)ethyl]benzimidazolium diiodide monohydrate","Acta Crystallographica Section E","2005","61","2","o301","o303","10.1107/S160053680403301X","","","0.71073","MoKα","","0.0273","0.0249","","","0.0558","0.0565","","","","","","1.093","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205154","7.296","0.001","8.014","0.002","10.208","0.002","86.97","0.02","70.53","0.02","73.04","0.02","537.6","0.2","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 4,6-dimethyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate","","- C9 H14 N2 O2 S -","- C9 H14 N2 O2 S -","- C18 H28 N4 O4 S2 -","2","1","SU6149","Zavodnik, Valery E.; Shutalev, Anatoly D.; Gurskaya, Galina V.; Stash, Adam I.; Tsirelson, Vladimir G.","Ethyl 4,6-dimethyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate","Acta Crystallographica Section E","2005","61","2","o468","o470","10.1107/S1600536805001935","","","0.71073","MoKα","","0.0468","0.0296","","","0.0927","0.0949","","","","","","1.118","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205155","6.824","0.003","11.887","0.006","25.224","0.01","90","","90","","90","","2046.1","1.6","120","2","120","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Guanidinium 4-hydroxypyridinium-2,6-dicarboxylate","","- C8 H10 N4 O5 -","- C8 H10 N4 O5 -","- C64 H80 N32 O40 -","8","1","SU6151","Moghimi, Abolghasem; Aghabozorg, Hossein; Soleimannejad, Janet; Ramezanipour, Farshid","Guanidinium 4-hydroxypyridinium-2,6-dicarboxylate","Acta Crystallographica Section E","2005","61","2","o442","o444","10.1107/S1600536805001121","","","0.71073","MoKα","","0.0814","0.0562","","","0.1247","0.1333","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205156","8.351","0.001","11.22","0.001","13.566","0.001","89.4","0.01","75.91","0.01","85.68","0.01","1229.3","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","(3,5-dimethyl-1H-pyrazole-κN^2^)[N,N-bis(3,5-dimethyl-1H-pyrazol-1-ylmethyl- κN^2^)-2-hydroxyethylamine-κN]nitratocopper(II) nitrate","","- C19 H31 Cu N9 O7 -","- C19 H31 Cu N9 O7 -","- C38 H62 Cu2 N18 O14 -","2","1","SU6154","Ramdani, Abdelkrim; El Kodadi, Mohamed; Fouad, Malek; Eddike, Driss; Tillard, Monique; Claude Belin","A redetermination of [<i>N</i>,<i>N</i>-bis(3,5-dimethyl-1<i>H</i>-pyrazol-1-ylmethyl-κ<i>N</i>^2^)-2-hydroxyethylamine-κ<i>N</i>](3,5-dimethyl-1<i>H</i>-pyrazole-κ<i>N</i>^2^)nitratocopper(II) nitrate","Acta Crystallographica Section E","2005","61","2","m346","m348","10.1107/S1600536805001170","","","0.71069","MoKα","","0.0999","0.0873","","","0.2229","0.2312","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205157","17.61","0.001","17.61","0.001","17.206","0.001","90","","90","","90","","5335.8","0.5","295","2","295","2","","","","","","","","6","P 42/n :2","-P 4bc","86","","Bis[4-bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato-κ^3^N,N',O]cobalt(III) nitrate","","- C26 H20 Br2 Co N5 O5 -","- C26 H20 Br2 Co N5 O5 -","- C208 H160 Br16 Co8 N40 O40 -","8","1","SU6156","Sun, Yu-Xi","Bis[4-bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>]cobalt(III) nitrate","Acta Crystallographica Section E","2005","61","2","m335","m337","10.1107/S1600536805001182","","","0.71073","MoKα","","0.0667","0.0392","","","0.0902","0.1045","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205158","7.204","0.002","19.175","0.002","12.716","0.002","90","","95.93","0.02","90","","1747.1","0.6","295","2","295","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[4-Bromo-2-(pyridin-2-ylmethylaminomethyl)phenolato](methanol)copper(II) perchlorate","","- C14 H14 Br Cl Cu N2 O6 -","- C14 H14 Br Cl Cu N2 O6 -","- C56 H56 Br4 Cl4 Cu4 N8 O24 -","4","1","SU6157","Sun, Yu-Xi","[4-Bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato](methanol)copper(II) perchlorate","Acta Crystallographica Section E","2005","61","2","m338","m340","10.1107/S1600536805001194","","","0.71073","MoKα","","0.0652","0.041","","","0.0919","0.1034","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205160","7.838","0.002","9.039","0.002","11.988","0.002","106.95","0.01","102.77","0.01","93.04","0.01","786","0.3","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Aqua[4-bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato]copper(II) nitrate monohydrate","","- C13 H14 Br Cu N3 O6 -","- C13 H14 Br Cu N3 O6 -","- C26 H28 Br2 Cu2 N6 O12 -","2","1","SU6159","Sun, Yu-Xi; Gao, Gen-Zhi; Pei, Hong-Xia; Zhang, Rui","Aqua[4-bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato]copper(II) nitrate monohydrate","Acta Crystallographica Section E","2005","61","2","m370","m372","10.1107/S1600536805001984","","","0.71073","MoKα","","0.0932","0.0502","","","0.0908","0.1054","","","","","","0.983","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205161","7.576","0.001","13.3","0.002","30.306","0.002","90","","90","","90","","3053.7","0.6","298","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Azido[1-(isobutylaminomethyliminomethyl)-2-naphtholato]nickel(II)","","- C15 H17 N5 Ni O -","- C15 H17 N5 Ni O -","- C120 H136 N40 Ni8 O8 -","8","1","SU6160","Sun, Yu-Xi; Gao, Gen-Zhi; Zhang, Rui; Pei, Hong-Xia","Azido[1-(isobutylaminomethyliminomethyl)-2-naphtholato]nickel(II)","Acta Crystallographica Section E","2005","61","2","m397","m398","10.1107/S1600536805001881","","","0.71073","MoKα","","0.0534","0.0433","","","0.1134","0.1208","","","","","","1.077","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205162","7.133","0.0006","8.005","0.0009","8.452","0.0011","99.571","0.009","112.751","0.006","93.146","0.008","435.08","0.09","122","1","122","1","","","","","","","","3","P -1","-P 1","2","2,5-Dimethoxybenzene-1,4-dicarbaldehyde","2,5-Dimethoxybenzene-1,4-dicarbaldehyde","","- C10 H10 O4 -","- C10 H10 O4 -","- C20 H20 O8 -","2","1","SU6161","Christian B. Nielsen; Michael Pittelkow; Henning Osholm Sørensen","2,5-Dimethoxybenzene-1,4-dicarbaldehyde","Acta Crystallographica Section E","2005","61","2","o473","o474","10.1107/S1600536805002229","","","0.71073","MoKα","","0.0784","0.0461","","","0.1114","0.13","","","","","","1.024","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205163","15.045","0.009","22.154","0.012","9.972","0.005","90","","106.05","0.04","90","","3194","3","126","2","126","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Fe(III)Cl(OEP)","Chloro(2,3,7,8,12,13,17,18-octaethylporphyrinato)iron(III)","","- C36 H44 Cl Fe N4 -","- C36 H44 Cl Fe N4 -","- C144 H176 Cl4 Fe4 N16 -","4","1","SU6162","Senge, Mathias O.","Chloro(2,3,7,8,12,13,17,18-octaethylporphyrinato)iron(III)","Acta Crystallographica Section E","2005","61","2","m399","m400","10.1107/S1600536805002461","","","0.71073","MoKα","","0.0673","0.0477","","","0.1242","0.1365","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205164","8.514","0.004","13.361","0.006","14.02","0.005","92.84","0.03","101.53","0.03","105.96","0.03","1493.2","1.2","130","2","130","2","","","","","","","","5","P -1","-P 1","2","Dibenzyl 5-(2-chloroethyl)-3,7-diethyl-2,8-dimethyldipyrromethane-1,9-dicarboxylate","dibenzyl 3,3'-diethyl-4,4'-dimethyl-2,2'-(3-chloropropane-1,1-diyl)dipyrrole- 5,5'-dicarboxylate","","- C33 H37 Cl N2 O4 -","- C33 H37 Cl N2 O4 -","- C66 H74 Cl2 N4 O8 -","2","1","SU6163","Senge, Mathias O.","Dibenzyl 5-(2-chloroethyl)-3,7-diethyl-2,8-dimethyldipyrromethane-1,9-dicarboxylate","Acta Crystallographica Section E","2005","61","2","o506","o508","10.1107/S160053680500245X","","","0.71073","MoKα","","0.0622","0.0446","","","0.1058","0.1169","","","","","","1.015","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205165","7.298","0.001","8.003","0.001","11.985","0.002","100.18","0.01","101.95","0.01","100.86","0.01","655.38","0.17","295","2","298","2","","","","","","","","5","P -1","-P 1","2","","Dichloro[N,N-dimethyl-N'-(pyridin-2-ylmethylidene)ethane-1,2-diamine]zinc(II)","","- C10 H15 Cl2 N3 Zn -","- C10 H15 Cl2 N3 Zn -","- C20 H30 Cl4 N6 Zn2 -","2","1","SU6165","Sun, Yu-Xi","Dichloro[<i>N,N</i>-dimethyl-<i>N</i>'-(pyridin-2-ylmethylidene)ethane-1,2-diamine]zinc(II)","Acta Crystallographica Section E","2005","61","2","m373","m374","10.1107/S1600536805002278","","","0.71073","MoKα","","0.0349","0.0306","","","0.0679","0.0703","","","","","","1.085","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205166","7.1714","0.0004","8.1184","0.0003","26.4299","0.0014","90","","95.721","0.002","90","","1531.09","0.13","294","1","150","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Methyl 2-[(ferrocenylcarbonyl)amino]thiophene-3-carboxylate","","- C17 H15 Fe N O3 S -","- C17 H15 Fe N O3 S -","- C68 H60 Fe4 N4 O12 S4 -","4","1","TK6199","Alley, Steven; Gallagher, John F.; Kenny, Peter T. M.; Lough, Alan J.","Methyl 2-[(ferrocenylcarbonyl)amino]thiophene-3-carboxylate","Acta Crystallographica Section E","2005","61","2","m201","m203","10.1107/S1600536804033355","","","0.71073","MolybdenumKα","","0.048","0.033","","","0.072","0.079","","","","","","1.04","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205167","20.907","0.004","11.951","0.004","26.516","0.005","90","","111.06","0.03","90","","6183","3","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[1-(3-Aminopropyl)-4,7-dithia-1-azacyclononane- κ^4^N,N',S,S']bis(dimethylformamide-κO)nickel(II) bis(tetraphenylborate) acetonitrile disolvate","","- C67 H80 B2 N6 Ni O2 S2 -","- C67 H80 B2 N6 Ni O2 S2 -","- C268 H320 B8 N24 Ni4 O8 S8 -","4","1","TK6203","Blake, Alexander J.; Lippolis, Vito","[1-(3-Aminopropyl)-4,7-dithia-1-azacyclononane-κ^4^<i>N</i>,<i>N</i>',<i>S,S</i>']bis(dimethylformamide-κ<i>O</i>)nickel(II) bis(tetraphenylborate) acetonitrile disolvate","Acta Crystallographica Section E","2005","61","2","m207","m208","10.1107/S1600536804033380","","","0.71073","MoKα","","0.087","0.069","","","0.182","0.205","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205168","11.2502","0.001","6.9682","0.0006","24.014","0.002","90","","93.963","0.002","90","","1878","0.3","180","2","180","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","2,6-Bis[2,4-bis(heptyloxy)phenyl]pyridine","","- C41 H61 N O4 -","- C41 H61 N O4 -","- C82 H122 N2 O8 -","2","0.5","TK6205","Alcock, Nathaniel W.; Rourke, Jonathan P","2,6-Bis[2,4-bis(heptyloxy)phenyl]pyridine","Acta Crystallographica Section E","2005","61","2","o368","o369","10.1107/S1600536805001248","","","0.71073","MoKα","","0.13","0.06","","","0.134","0.168","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205169","9.891","0.004","10.188","0.004","13.592","0.005","106.179","0.007","106.822","0.007","97.75","0.007","1224","0.8","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","N,N-Bis(anthracen-9-ylmethyl)propylamine","","- C33 H29 N -","- C33 H29 N -","- C66 H58 N2 -","2","1","WK6030","Liu, Qing-Xiang; Song, Hai-Bin; Zheng-Ming Li","<i>N</i>,<i>N</i>-Bis(anthracen-9-ylmethyl)propylamine","Acta Crystallographica Section E","2005","61","2","o385","o386","10.1107/S1600536804034026","","","0.71073","MoKα","","0.197","0.077","","","0.158","0.208","","","","","","1.005","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205170","18.838","0.003","16.557","0.002","10.065","0.012","90","","111.354","0.014","90","","2924","4","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","DL-phenylalaninium trichloroacetate","DL-Phenylalaninium trichloroacetate","","- C11 H12 Cl3 N O4 -","- C11 H12 Cl3 N O4 -","- C88 H96 Cl24 N8 O32 -","8","1","WK6038","K. Rajagopal; R. V. Krishnakumar; S. Natarajan","<small>DL</small>-Phenylalaninium trichloroacetate","Acta Crystallographica Section E","2005","61","2","o203","o205","10.1107/S160053680403404X","","","0.71073","MoKα","","0.0744","0.0534","","","0.143","0.1541","","","","","","1.027","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205171","8","0.004","8.753","0.004","9.752","0.005","102.716","0.009","94.939","0.008","94.976","0.009","659.7","0.6","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 2-methoxycarbonylamino-3-phenylpropionate","","- C13 H17 N O4 -","- C13 H17 N O4 -","- C26 H34 N2 O8 -","2","1","WK6039","Bin Tan; Hua Fang; Zan-Bin Wei; Li-Ren Jin","Ethyl 2-methoxycarbonylamino-3-phenylpropionate","Acta Crystallographica Section E","2005","61","2","o298","o300","10.1107/S1600536804034063","","","0.71073","MoKα","","0.072","0.056","","","0.151","0.162","","","","","","1.01","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205172","9.2724","0.0005","11.7943","0.0006","24.4404","0.0011","90","","99.18","0.002","90","","2638.6","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Benzyl 2-amino-6-chloro-9H-purine-9-carboxylate","","- C13 H10 Cl N5 O2 -","- C13 H10 Cl N5 O2 -","- C104 H80 Cl8 N40 O16 -","8","2","WK6041","Adebambo, Kassim F.; Howarth, Nicola; Rosair, Georgina M.","Benzyl 2-amino-6-chloro-9<i>H</i>-purine-9-carboxylate","Acta Crystallographica Section E","2005","61","2","o486","o488","10.1107/S1600536805002047","","","0.71073","MoKα","","0.0482","0.0343","","","0.0883","0.0946","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205173","5.6741","0.0017","5.6741","0.0017","11.249","0.005","90","","90","","90","","362.2","0.2","150","2","150","2","","","","","","","","3","I -4","I -4","82","","","","- Ge Hg2 Se4 -","- Ge Hg2 Se4 -","- Ge2 Hg4 Se8 -","2","0.25","WM6045","Yongkwan Dong; Sangrok Kim; Hoseop Yun","Reinvestigation of Hg~2~GeSe~4~ based on single-crystal data","Acta Crystallographica Section E","2005","61","2","i9","i11","10.1107/S1600536804034105","","","0.7107","MoKα","","","0.0556","","","","0.1449","","","","","","1.078","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205174","9.1272","0.0016","10.282","0.002","9.1902","0.0014","90","","90","","90","","862.5","0.3","293","2","293","2","","","","","","","","3","C m c m","-C 2c 2","63","","Cerium diruthenium decaaluminium","","- Al10 Ce Ru2 -","- Al10 Ce Ru2 -","- Al40 Ce4 Ru8 -","4","0.25","WM6046","Tursina, Anna I.; Nesterenko, Sergei N.; Murashova, Elena V.; Chernyshev, Ilya V.; Noël, Henri; Seropegin, Yuri D.","CeRu~2~Al~10~ with the YbFe~2~Al~10~ structure type","Acta Crystallographica Section E","2005","61","2","i12","i14","10.1107/S1600536805000310","","","0.71073","MoKα","","0.0462","0.0434","","","0.1204","0.1227","","","","","","1.095","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205175","4.1539","0.0003","4.1539","0.0003","16.508","0.002","90","","90","","120","","246.68","0.04","153","2","153","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Cesium ytterbium diselenide","","- Cs Se2 Yb -","- Cs Se2 Yb -","- Cs2 Se4 Yb2 -","2","0.0833333","WM6047","Deng, Bin; Ibers, James A.","CsYbSe~2~","Acta Crystallographica Section E","2005","61","2","i15","i17","10.1107/S1600536805001157","","","0.71073","MoKα","","0.0208","0.0186","","","0.0405","0.0408","","","","","","1.703","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205176","9.1244","0.0006","11.0468","0.0007","13.0895","0.0007","90","","90.152","0.006","90","","1319.36","0.14","296","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Tetratellurium bis[heptachlorodigallate(III)]","","- Cl14 Ga4 Te4 -","- Cl14 Ga4 Te4 -","- Cl28 Ga8 Te8 -","2","0.5","WM6049","Lindsjö, Martin; Kloo, Lars","Tetratellurium bis[heptachlorodigallate(III)], Te~4~[Ga~2~Cl~7~]~2~","Acta Crystallographica Section E","2005","61","2","i18","i19","10.1107/S1600536805001960","","","0.71073","MoKα","","0.0514","0.0322","","","0.0541","0.0599","","","","","","1.11","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205177","5.127","0.002","13.75","0.006","22.503","0.009","90","","90","","90","","1586.4","1.1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(2Z)-2-(anthracen-9-ylmethylene)-5,6-dihydroimidazo[2,1-b]thiazol-3(2H)-one","","- C20 H14 N2 O S -","- C20 H14 N2 O S -","- C80 H56 N8 O4 S4 -","4","1","WN6312","Liang, Zu-Pei; Li, Jian","(2<i>Z</i>)-2-(Anthracen-9-ylmethylene)-5,6-dihydroimidazo[2,1-<i>b</i>]thiazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","2","o220","o221","10.1107/S1600536804033847","","","0.71073","MoKα","","0.1549","0.0743","","","","0.1981","","","","","","1.118","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205178","6.1138","0.0012","7.6933","0.0015","19.824","0.004","90","","90","","90","","932.4","0.3","293","2","293","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","3,8-Dimethyl-1,6-dioxa-4,9-diaza-5λ^5^-phosphaspiro[4.4]nonane-2,7-dione","","- C6 H11 N2 O4 P -","- C6 H11 N2 O4 P -","- C24 H44 N8 O16 P4 -","4","0.5","WN6313","Yu, Lin; Liu, Zhao; Fang, Hua; Zhao, Yu-Fen","(3<i>S</i>,8<i>S</i>)-3,8-Dimethyl-1,6-dioxa-4,9-diaza-5λ^5^-phosphaspiro[4.4]nonane-2,7-dione","Acta Crystallographica Section E","2005","61","2","o261","o262","10.1107/S160053680403421X","","","0.71073","MoKα","","0.0885","0.0685","","","0.1787","0.1979","","","","","","1.066","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205179","27.665","0.009","5.1444","0.0016","13.907","0.004","90","","98.401","0.005","90","","1958","1","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(4S)-4-(Methoxycarbonylmethylaminocarbonyl)-4-(3,4,5- trimethoxybenzamido)butanoic acid","","- C18 H24 N2 O9 -","- C18 H24 N2 O9 -","- C72 H96 N8 O36 -","4","1","WN6314","Li, Xun; Xu, Wen-Fang; Wu, Ji-Feng; Wang, Jun-Li; Yuan, Yu-Mei","(4<i>S</i>)-4-(Methoxycarbonylmethylaminocarbonyl)-4-(3,4,5-trimethoxybenzamido)butanoic acid","Acta Crystallographica Section E","2005","61","2","o349","o351","10.1107/S1600536805001339","","","0.71073","MoKα","","0.0895","0.0606","","","0.1405","0.1546","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205180","9.5294","0.0009","8.4805","0.0008","33.362","0.003","90","","90","","90","","2696.1","0.4","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-Oxo-2-phenylethyl morpholine-4-carbodithioate","","- C13 H15 N O2 S2 -","- C13 H15 N O2 S2 -","- C104 H120 N8 O16 S16 -","8","1","WN6317","Liang-Zhong Xu; Kai Li; Guan-Ping Yu; Guo-Dong Si; Cheng-Long Yu","2-Oxo-2-phenylethyl morpholine-4-carbodithioate","Acta Crystallographica Section E","2005","61","2","o215","o216","10.1107/S1600536804033999","","","0.71073","MoKα","","0.0525","0.0268","","","0.0645","0.0957","","","","","","0.866","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205181","13.48","0.003","9.796","0.002","13.757","0.003","90","","97.556","0.003","90","","1800.8","0.7","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,5-Dimethyl-2-phenyl-4-[(E,E)-3-phenylprop-2-enylideneamino]- 1H-pyrazol-3(2H)-one","","- C20 H19 N3 O -","- C20 H19 N3 O -","- C80 H76 N12 O4 -","4","1","WN6320","Li, Zong-Xiao; Zhang, Xin-Li","1,5-Dimethyl-2-phenyl-4-[(<i>E,E</i>)-3-phenylprop-2-enylideneamino]-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","2","o375","o377","10.1107/S1600536805001340","","","0.71073","MoKα","","0.1039","0.0492","","","0.1112","0.1451","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205182","4.0781","0.0006","16.344","0.003","18.664","0.003","90","","90","","90","","1244","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-(4-chlorophenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one","","- C15 H11 Cl O2 -","- C15 H11 Cl O2 -","- C60 H44 Cl4 O8 -","4","1","WN6321","T. Ravishankar; K. Chinnakali; S. Nanjundan; P. Selvam; Hoong-Kun Fun; Xiao-Lan Yu","1-(4-Chlorophenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2005","61","2","o405","o407","10.1107/S1600536805001686","","","0.71073","MoKα","","0.0587","0.0448","","","0.1003","0.1078","","","","","","1.043","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205183","13.4346","0.0008","11.4998","0.0007","16.6055","0.001","90","","90","","90","","2565.5","0.3","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","1-(4-hydroxyphenyl)-3-(4-methoxyphenyl)prop-2-ene-1-one","","- C16 H14 O3 -","- C16 H14 O3 -","- C128 H112 O24 -","8","1","WN6322","Sathiya Moorthi, S.; Chinnakali, K.; Nanjundan, S.; Radhika, R.; Fun, Hoong-Kun; Yu, Xiao-Lan","1-(4-Hydroxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2005","61","2","o480","o482","10.1107/S1600536805001698","","","0.71073","MoKα","","0.0516","0.044","","","0.1193","0.126","","","","","","1.067","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205184","11.7495","0.0013","5.4876","0.0006","20.165","0.002","90","","95.918","0.002","90","","1293.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-Bromophenyl)-3-(3-hydroxyphenyl)prop-2-ene-1-one","","- C15 H11 Br O2 -","- C15 H11 Br O2 -","- C60 H44 Br4 O8 -","4","1","WN6324","S. Sathiya Moorthi; K. Chinnakali; S. Nanjundan; C. Sreekuttan Unnithan; Hoong-Kun Fun; Xiao-Lan Yu","1-(4-Bromophenyl)-3-(3-hydroxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2005","61","2","o483","o485","10.1107/S1600536805002370","","","0.71073","MoKα","","0.0512","0.0346","","","0.083","0.0911","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205185","4.9785","0.0006","21.127","0.002","10.9004","0.0013","90","","102.209","0.002","90","","1120.6","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2'-(2-Thienylmethylidene)-2-hydroxybenzohydrazide","","- C12 H10 N2 O2 S -","- C12 H10 N2 O2 S -","- C48 H40 N8 O8 S4 -","4","1","WW6323","Pan, Fu-You; Yang, Jian-Guo","2'-(2-Thienylmethylidene)-2-hydroxybenzohydrazide","Acta Crystallographica Section E","2005","61","2","o352","o353","10.1107/S1600536804034099","","","0.71073","MoKα","","0.0609","0.0517","","","0.1489","0.1568","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205186","7.0492","0.0009","10.6716","0.0014","11.7464","0.0015","90","","103.426","0.002","90","","859.49","0.19","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","","1,10-phenanthrolin-1-ium 5-sulfosalicylate","","- C19 H14 N2 O6 S -","- C19 H14 N2 O6 S -","- C38 H28 N4 O12 S2 -","2","1","WW6336","Fan, Sai-Rong; Xiao, Hong-Ping; Zhu, Long-Guan","A cation‒anion complex: 1,10-phenanthrolin-1-ium 5-sulfonatosalicylic acid","Acta Crystallographica Section E","2005","61","2","o253","o255","10.1107/S1600536804034245","","","0.71073","MoKα","","0.0433","0.0429","","","0.1057","0.106","","","","","","1.18","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205187","6.4744","0.0016","23.758","0.006","7.5236","0.0019","90","","108.715","0.003","90","","1096.1","0.5","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","catena-Poly [tetraqua cadmium(II)-μ-hexane-1,6-diamineK~2~N:N'] terephthalate dihydrate]","","- C14 H32 Cd N2 O10 -","- C14 H32 Cd N2 O10 -","- C28 H64 Cd2 N4 O20 -","2","0.5","WW6340","Meng, Xiang-Gao; Lin, Zhi-Dong","<i>catena</i>-Poly[[tetraaquacadmium(II)-μ-hexane-1,6-diamine-κ^2^<i>N</i>:<i>N</i>'] terephthalate dihydrate]","Acta Crystallographica Section E","2005","61","2","m263","m264","10.1107/S1600536804034233","","","0.71073","MoKα","","0.0377","0.0364","","","0.0839","0.0845","","","","","","1.215","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205188","7.805","0.003","10.705","0.005","11.805","0.005","107.729","0.007","98.068","0.007","91.09","0.008","928.2","0.7","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","1-(2,6-Dihydroxyphenyl)butanone","","- C10 H12 O3 -","- C10 H12 O3 -","- C40 H48 O12 -","4","2","WW6341","Hua-Rong Huang; Xiao-Long Feng; Zhi-Gang She; Yong-Cheng Lin; L. L. P. Vrijmoed; E. B. Gareth Jones","1-(2,6-Dihydroxyphenyl)butanone","Acta Crystallographica Section E","2005","61","2","o282","o283","10.1107/S160053680500022X","","","0.71073","MoKα","","0.0881","0.0492","","","0.122","0.1432","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205189","8.3046","0.0004","9.5443","0.0004","12.0048","0.0008","81.22","0.003","70.03","0.002","83.678","0.002","882.1","0.08","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[[bis(1H-imidazole-κN^3^)zinc(II)]-μ-terephthalato-κO:O'] trihydrate]","","- C14 H18 N4 O7 Zn -","- C14 H18 N4 O7 Zn -","- C28 H36 N8 O14 Zn2 -","2","1","WW6342","Lin, Dong-Dong; Yin, Kai-Liang; Xu, Duan-Jun","<i>catena</i>-Poly[[[bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)zinc(II)]-μ-terephthalato-κ^2^<i>O</i>:<i>O</i>'] trihydrate]","Acta Crystallographica Section E","2005","61","2","m260","m262","10.1107/S1600536805000164","","","0.71073","MoKα","","0.031","0.027","","","0.069","0.071","","","","","","1.123","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205190","10.2362","0.0012","8.9429","0.0011","10.3855","0.0012","90","","91.887","0.002","90","","950.2","0.2","295","2","295","2","","","","","","","","6","P 1 c 1","P -2yc","7","","2-(1H-Benzotriazol-1-yl)-3-(4-chlorophenyl)-3-hydroxy-N-phenylprop- 2-enethioamide","","- C21 H15 Cl N4 O S -","- C21 H15 Cl N4 O S -","- C42 H30 Cl2 N8 O2 S2 -","2","1","WW6347","Xu, Liangzhong; Yang, Shuanghua; Zhu, Chongyi; Li, Kai; Liu, Faqian","2-(1<i>H</i>-Benzotriazol-1-yl)-3-(4-chlorophenyl)-3-hydroxy-<i>N</i>-phenylprop-2-enethioamide","Acta Crystallographica Section E","2005","61","2","o259","o260","10.1107/S160053680500019X","","","0.71073","MoKα","","0.0563","0.0349","","","0.082","0.09","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205191","4.8223","0.0015","5.4732","0.0016","25.484","0.007","90","","90","","90","","672.6","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2-hydroxy-1-phenylethanone","","- C8 H8 O2 -","- C8 H8 O2 -","- C32 H32 O8 -","4","1","YA6231","Pengying Zhao; Qiyun Shao; Weiyi Zhou; Jie Li; Chunbao Li","2-Hydroxy-1-phenylethanone","Acta Crystallographica, Section E","2005","61","2","o328","o329","10.1107/S1600536805000760","","","0.71073","MoKα","","0.063","0.036","","","0.102","0.142","","","","","","1.23","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205192","6.328","0.002","7.696","0.003","35.175","0.012","90","","92.678","0.006","90","","1711.2","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,10-Phenanthrolin-1-ium 2-carboxy-4-nitrobenzoate","","- C20 H13 N3 O6 -","- C20 H13 N3 O6 -","- C80 H52 N12 O24 -","4","1","YA6232","Guo, Ming-Lin","1,10-Phenanthrolin-1-ium 2-carboxy-4-nitrobenzoate","Acta Crystallographica Section E","2005","61","2","o431","o433","10.1107/S1600536805001765","","","0.71073","MoKα","","0.1","0.056","","","0.122","0.146","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205193","19.4776","0.0016","14.0453","0.0011","21.1035","0.0017","90","","90","","90","","5773.3","0.8","273","2","273","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","bis(butane-1,4-diammonium) bis(hydrogenphosphato)pentamolybdate monohydrate,","","- C8 H32 Mo5 N4 O24 P2 -","- C8 H32 Mo5 N4 O24 P2 -","- C64 H256 Mo40 N32 O192 P16 -","8","1","AC6148","Shailesh Upreti; A. Ramanan","Butane-1,4-diammonium diphosphopentamolybdate: a new inorganic‒organic hybrid solid","Acta Crystallographica Section E","2005","61","3","m414","m416","10.1107/S1600536805001856","","","0.71073","MoKα","","0.0273","0.0269","","","0.0747","0.0751","","","","","","1.283","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205194","8.237","0.003","8.438","0.003","14.59","0.006","83.554","0.007","75.631","0.007","84.998","0.007","974.3","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N-Benzoylthiosemicarbazide","","- C8 H9 N3 O S -","- C8 H9 N3 O S -","- C32 H36 N12 O4 S4 -","4","2","AC6151","Bian, He-Dong; Guo, Gui-Quan; Yu, Qing; Liang, Hong; Yang, Xiao-E; Zhu, Li-Gang","<i>N</i>-Benzoylthiosemicarbazide","Acta Crystallographica Section E","2005","61","3","o639","o640","10.1107/S1600536805003867","","","0.71073","MoKα","","0.0738","0.0422","","","0.0992","0.1241","","","","","","1.086","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205195","15.3509","0.0006","11.6315","0.0004","5.9802","0.0002","90","","90","","90","","1067.79","0.07","123","2","123","2","","","","","","","","4","P n a 21","P 2c -2n","33","","2-(1-Piperidinyl)-1,3-benzothiazole","","- C12 H14 N2 S -","- C12 H14 N2 S -","- C48 H56 N8 S4 -","4","1","AC6153","Alvarez, Ricardo G.; Kennedy, Alan R.; Khalaf, Abedawn I.; Suckling, Colin J.; Waigh, Roger D.","2-(1-Piperidinyl)-1,3-benzothiazole","Acta Crystallographica Section E","2005","61","3","o569","o570","10.1107/S160053680500320X","","","0.71073","MoKα","","0.0361","0.0284","","","0.0617","0.0647","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205196","6.039","0.0012","7.221","0.0014","8.561","0.0017","84.48","0.03","81.33","0.03","71.08","0.03","348.67","0.14","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C3 H4 B Cl3 N2 -","- C3 H4 B Cl3 N2 -","- C6 H8 B2 Cl6 N4 -","2","1","AC6154","R. Angharad Baber; Andrew E. A. Bull; Jonathan P. H. Charmant; Nicholas C. Norman; A. Guy Orpen","<i>N</i>-Imidazole‒boron trichloride adduct","Acta Crystallographica Section E","2005","61","3","o553","o554","10.1107/S1600536805002631","","","0.71073","MoKα","","0.0344","0.0296","","","0.068","0.07","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205197","10.044","0.006","11.398","0.003","13.82","0.003","90","","109.79","0.04","90","","1488.7","1.1","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","10-(4-Fluorobenzylidene)anthrone","","- C21 H13 F O -","- C21 H13 F O -","- C84 H52 F4 O4 -","4","1","AC6156","Wei Zhou; Weixiao Hu; Luping Lv; Chunnian Xia","10-(4-Fluorobenzylidene)anthrone","Acta Crystallographica Section E","2005","61","3","o592","o593","10.1107/S1600536805002655","","","0.71073","MoKα","","0.0506","0.0333","","","0.0934","0.1032","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205198","8.6894","0.0007","24.3903","0.0015","7.8153","0.0006","90","","100.46","0.006","90","","1628.8","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(2-Benzoylphenoxy)phthalonitrile","","- C21 H12 N2 O2 -","- C21 H12 N2 O2 -","- C84 H48 N8 O8 -","4","1","AC6158","Akbal, Tufan; Akdemir, Nesuhi; Ağar, Erbil; Kantar, Cihan; Erdönmez, Ahmet","4-(2-Benzoylphenoxy)phthalonitrile","Acta Crystallographica Section E","2005","61","3","o683","o684","10.1107/S160053680500440X","","","0.71073","MoKα","","0.0425","0.0332","","","0.0827","0.0852","","","","","","1.043","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205199","18.223","0.001","5.5837","0.0004","11.5842","0.0007","90","","101.725","0.004","90","","1154.12","0.13","110","2","110","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ethyl 2,3,5,6-tetramethylbenzoate","","- C13 H18 O2 -","- C13 H18 O2 -","- C52 H72 O8 -","4","1","AC6159","Pinkus, A. G.; Klausmeyer, Kevin K.; Feazell, Rodney P.; Lin, Ellen C. H. Y.","Ethyl 2,3,5,6-tetramethylbenzoate","Acta Crystallographica Section E","2005","61","3","o662","o663","10.1107/S1600536805004319","","","0.71073","MoKα","","0.0567","0.0387","","","0.0961","0.1076","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205200","6.941","0.0007","8.141","0.0009","11.212","0.0006","90","","90.994","0.006","90","","633.46","0.1","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4-dimorpholinobenzene","","- C14 H20 N2 O2 -","- C14 H20 N2 O2 -","- C28 H40 N4 O4 -","2","0.5","AC6160","Quail, J. Wilson; Doroudi, Alireza; Das, Umashankar; Dimmock, Jonathan R.","1,4-Dimorpholinobenzene","Acta Crystallographica Section E","2005","61","3","o693","o695","10.1107/S160053680500454X","","","0.71073","MoKα","","0.083","0.0519","","","0.1008","0.1154","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205201","18.466","0.003","16.745","0.002","13.914","0.0019","90","","129.174","0.002","90","","3335.3","0.8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[μ-1-(2-pyridyl-κN)ethanone 4-phenylthiosemicarbazonato-κ^2^N^1^,S]bis[iodomercury(II)]","","- C28 H26 Hg2 I2 N8 S2 -","- C28 H26 Hg2 I2 N8 S2 -","- C112 H104 Hg8 I8 N32 S8 -","4","0.5","BR6172","Yamin, Bohari M.; Yusof, M. Sukeri M.","Bis[μ-1-(2-pyridyl-κ<i>N</i>)ethanone 4-phenylthiosemicarbazonato-κ^2^<i>N</i>^1^,<i>S</i>]bis[iodomercury(II)]","Acta Crystallographica Section E","2005","61","3","m454","m456","10.1107/S1600536805002898","","","0.71073","MoKα","","0.033","0.026","","","0.066","0.068","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205202","7.0074","0.0009","7.339","0.001","7.796","0.001","81.24","0.001","71.08","0.001","88.15","0.001","374.78","0.09","301","2","301","2","","","","","","","","5","P -1","-P 1","2","","diammonium zinc(II) dihydrogendiphosphate dihydrate","","- H16 N2 O16 P4 Zn -","- H16 N2 O16 P4 Zn -","- H16 N2 O16 P4 Zn -","1","0.5","BR6177","Essehli, Rachid; Lachkar, Mohammed; Svoboda, Ingrid; Fuess, Hartmut; El Bali, Brahim","Synthesis, crystal structure and vibrational spectra of a new diammonium zinc(II) dihydrogendiphosphate dihydrate, (NH~4~)~2~Zn(H~2~P~2~O~7~)~2~·2H~2~O","Acta Crystallographica Section E","2005","61","3","i32","i34","10.1107/S1600536805004642","","","0.71073","MoKα","","0.0328","0.0318","","","0.0896","0.0904","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205203","7.1952","0.0001","12.572","0.0002","5.8035","0.0001","90","","90","","90","","524.973","0.014","300","","300","","","","","","","","","5","P b n m","-P 2c 2ab","62","","europium lanthanum barium zinc oxide","","- Ba Eu1.8 La0.2 O5 Zn -","- Ba Eu1.8 La0.2 O5 Zn -","- Ba4 Eu7.2 La0.8 O20 Zn4 -","4","0.5","BR6178","Hernández-Pérez, José Apuleyo; Villafuerte-Castrejón, María-Elena; Bucio, Lauro","Eu~1.8~La~0.2~BaZnO~5~: a Rietveld refinement using X-ray powder diffraction","Acta Crystallographica Section E","2005","61","3","i23","i25","10.1107/S1600536805002886","","","1.54175","CuKα","","","","","","","","","","1.67","","","","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205204","7.0276","0.0007","7.5566","0.0006","10.2883","0.0008","90","","90.665","0.012","90","","546.32","0.08","296","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 Co K2 N6 Na -","- C6 Co K2 N6 Na -","- C12 Co2 K4 N12 Na2 -","2","0.5","BR6179","Ilyukhin, Andrey B.; Kotov, Vitalii Yu.","Dipotassium sodium hexacyanocobalt(III)","Acta Crystallographica Section E","2005","61","3","i26","i27","10.1107/S160053680500334X","","","0.71073","MoKα","","","0.0193","","","","0.0555","","","","","","0.998","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205205","34.037","0.003","8.3818","0.0007","13.0137","0.0011","90","","103.502","0.001","90","","3610.1","0.5","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(1,2-di-4-pyridylethene)bis(5-hydroxylisophthalato)zirconium(II) monohydrate","","- C40 H32 N4 O11 Zr -","- C40 H32 N4 O11 Zr -","- C160 H128 N16 O44 Zr4 -","4","0.5","BR6180","Ya-Juan Zhao; Ruo-Wang Liu; Xin-Hua Li","Bis(1,2-di-4-pyridylethene)bis(5-hydroxyisophthalato)zirconium(II) monohydrate","Acta Crystallographica Section E","2005","61","3","m535","m537","10.1107/S1600536805003697","","","0.71073","MoKα","","0.0719","0.064","","","0.1843","0.194","","","","","","1.124","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205206","7.4749","0.0006","17.426","0.002","14.443","0.002","90","","101.087","0.008","90","","1846.2","0.4","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","trans-4-(Ferrocenylideneamino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one","","- C22 H21 Fe N3 O -","- C22 H21 Fe N3 O -","- C88 H84 Fe4 N12 O4 -","4","1","BR6181","Wu, Hong-Fei; Wang, Hong-Xing","<i>trans</i>-4-(Ferrocenylideneamino)-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","3","m580","m581","10.1107/S1600536805004344","","","0.71073","MoKα","","0.0467","0.0329","","","0.0733","0.0761","","","","","","1.001","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205207","4.5079","0.0013","12.556","0.004","7.135","0.002","90","","111.094","0.004","90","","376.79","0.19","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Cerium(III) hydroxide sulfate","","- Ce H O5 S -","- Ce H O5 S -","- Ce4 H4 O20 S4 -","4","1","BR6182","Yan Yang; Li-Hong Zhu; Ming-Hua Zeng; Xiao-Long Feng","Cerium(III) hydroxide sulfate, Ce(OH)SO~4~","Acta Crystallographica Section E","2005","61","3","i41","i43","10.1107/S1600536805005179","","","0.71073","MoKα","","0.0165","0.0154","","","0.0395","0.04","","","","","","1.23","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205208","22.266","0.0005","10.658","0.0005","7.492","0.0005","90","","103.743","0.005","90","","1727.03","0.15","295","2","295","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Bis(3-carboxyanilinium) hexafluorostannate(IV)","","","- C14 H16 F6 N2 O4 Sn -","- C14 H16 F6 N2 O4 Sn -","- C56 H64 F24 N8 O16 Sn4 -","4","0.5","BR6183","Bouacida, Sofiane; Merazig, Hocine; Beghidja, Adel; Beghidja, Chahrazed","Bis(3-carboxyanilinium) hexafluorostannate(IV)","Acta Crystallographica Section E","2005","61","3","m577","m579","10.1107/S160053680500512X","","","0.71073","MoKα","","0.0334","0.0269","","","0.0602","0.0627","","","","","","1.098","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205209","9.883","0.002","10.103","0.002","15.892","0.002","90","","106.59","0.01","90","","1520.7","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(3R,5S)-1-Benzyl 2-tert-butyl 4-[N,N'-bis(tert-butyloxycarbonyl)hydrazino]-5-oxopyrrolidine-1,5-dicarboxylate","","- C27 H39 N3 O9 -","- C27 H39 N3 O9 -","- C54 H78 N6 O18 -","2","1","BT6586","Krzysztof Kaczmarek; Wojciech M. Wolf; Janusz Zabrocki","(2<i>S</i>,4<i>R</i>)-1-Benzyl 2-<i>tert</i>-butyl 4-[<i>N</i>,<i>N</i>'-bis(<i>tert</i>-butyloxycarbonyl)hydrazino]-5-oxopyrrolidine-1,2-dicarboxylate","Acta Crystallographica Section E","2005","61","3","o629","o631","10.1107/S1600536805003880","","","1.54178","CuKα","","0.1419","0.0522","","","0.1154","0.1581","","","","","","1.09","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205210","19.115","0.002","12.012","0.001","22.071","0.002","90","","90.024","0.001","90","","5067.7","0.8","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(μ-5-chloro-2-hydroxyacetophenone 4-nitrobenzoylhydrazonato)bis[dipyridinecadmium(II)]","","- C50 H40 Cd2 Cl2 N10 O8 -","- C50 H40 Cd2 Cl2 N10 O8 -","- C200 H160 Cd8 Cl8 N40 O32 -","4","0.5","BT6595","Ali, Hapipah M.; Kamalul Aripin, Nurul Fadhilah; Ng, Seik Weng","Bis(μ-5-chloro-2-hydroxyacetophenone 4-nitrobenzoylhydrazonato)bis[dipyridinecadmium(II)]","Acta Crystallographica Section E","2005","61","3","m433","m434","10.1107/S1600536805002953","","","0.71073","MoKα","","0.075","0.058","","","0.124","0.131","","","","","","1.15","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205211","12.486","0.002","9.443","0.001","16.839","0.002","90","","108.289","0.002","90","","1885.1","0.4","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-Poly[[[diaquahexapyridine-μ~2~-sulfato-dicobalt(II)]-μ-sulfato] tetrahydrate]","","- C30 H42 Co2 N6 O14 S2 -","- C30 H42 Co2 N6 O14 S2 -","- C60 H84 Co4 N12 O28 S4 -","2","0.5","BT6596","Ali, Hapipah M.; Puvaneswary, Subramaniam; Ng, Seik Weng","<i>catena</i>-Poly[[[diaquahexapyridine-μ-sulfato-dicobalt(II)]-μ-sulfato] tetrahydrate]","Acta Crystallographica Section E","2005","61","3","m474","m475","10.1107/S1600536805003429","","","0.71073","MoKα","","0.0591","0.0475","","","0.106","0.1114","","","","","","1.137","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205212","6.066","0.001","8.643","0.002","13.272","0.003","104.87","0.03","97.27","0.03","93.29","0.03","664.2","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[diaqua[3-(2-pyridyl)-1H-pyrazole-κN^2^]cadmium(II)]- μ-squarato-κ^2^O:O']","","- C12 H11 Cd N3 O6 -","- C12 H11 Cd N3 O6 -","- C24 H22 Cd2 N6 O12 -","2","1","BT6598","Huo, Li-Hua; Cheng, Xiao Li; Zhao, Hui; Ng, Seik Weng","<i>catena</i>-Poly[[diaqua[3-(2-pyridyl)-1<i>H</i>-pyrazole-κ<i>N</i>^2^]cadmium(II)]-μ-squarato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","3","m460","m462","10.1107/S1600536805003041","","","0.71073","MoKα","","0.024","0.022","","","0.072","0.073","","","","","","1.34","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205213","13.4048","0.0011","6.1275","0.0004","30.239","0.002","90","","94.81","0.003","90","","2475","0.3","120","2","120","2","","","","","","","","3","C 1 2 1","C 2y","5","","3β-Taraxerol","","- C30 H50 O -","- C30 H50 O -","- C120 H200 O4 -","4","1","BT6599","Kouam, Simeon F.; Flörke, Ulrich; Krohn, Karsten; Akhtar, M. Nadeem; Ngadjui, Bonaventure T.; Abegaz, Berhanu M.","3β-Taraxerol from <i>Bridelia micrantha</i>","Acta Crystallographica Section E","2005","61","3","o599","o600","10.1107/S1600536805003934","","","0.71073","MoKα","","0.0703","0.0519","","","0.1043","0.1097","","","","","","0.981","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205214","18.448","0.002","9.9631","0.0004","20.029","0.002","90","","108.422","0.005","90","","3492.7","0.5","193","2","193","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3-(1H-Indol-3-yl)-4-(3,4,5-trimethoxyphenyl)-2,5-dihydro-1H-pyrrole-2,5-dione","","- C21 H18 N2 O5 -","- C21 H18 N2 O5 -","- C168 H144 N16 O40 -","8","1","BT6600","Christian Peifer; Schollmeyer, Dieter; Gerd Dannhardt","3-(1<i>H</i>-Indol-3-yl)-4-(3,4,5-trimethoxyphenyl)-2,5-dihydro-1<i>H</i>-pyrrole-2,5-dione","Acta Crystallographica Section E","2005","61","3","o721","o723","10.1107/S1600536805004605","","","1.54178","CuKα","","0.0448","0.0441","","","0.1198","0.1205","","","","","","1.101","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205215","7.994","0.002","20.04","0.004","13.644","0.004","90","","106.586","0.012","90","","2094.8","0.9","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5,6,7-Trimethoxy-2,3-dihydro-1H,8H-benzo[a]pyrrolo[3,4-c]carbazole-1,3-dione dimethyl sulfoxide solvate","","- C23 H22 N2 O6 S -","- C23 H22 N2 O6 S -","- C92 H88 N8 O24 S4 -","4","1","BT6601","Christian Peifer; Schollmeyer, Dieter; Gerd Dannhardt","5,6,7-Trimethoxy-2,3-dihydro-1<i>H</i>,8<i>H</i>-benzo[<i>a</i>]pyrrolo[3,4-<i>c</i>]carbazole-1,3-dione dimethyl sulfoxide solvate","Acta Crystallographica Section E","2005","61","3","o724","o725","10.1107/S160053680500485X","","","1.54178","CuKα","","0.1118","0.0756","","","0.1702","0.1874","","","","","","1.113","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205216","8.1986","0.0005","14.0252","0.0009","23.482","0.001","90","","90","","90","","2700.1","0.3","273","2","273","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Bharangin triacetate","6,10-bis(acetyloxy)-8-isopropyl-4,4,11a-trimethyl-2-oxo-2,3,4,6,11,11a- hexahydrobenzo[5,6]cyclohepta[1,2-b]pyran-9-yl acetate","","- C26 H32 O8 -","- C26 H32 O8 -","- C104 H128 O32 -","4","1","BT6602","Ravikumar, K.; Sridhar, B.; Marthanda Murthy, M.","A stereoisomer of bharangin triacetate","Acta Crystallographica Section E","2005","61","3","o687","o689","10.1107/S1600536805004617","","","0.71073","MoKα","","0.0632","0.0596","","","0.1551","0.158","","","","","","1.103","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205217","9.339","0.003","5.766","0.003","24.662","0.009","90","","90.07","0.03","90","","1328","0.9","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","cytosinium 3,5-dinitrosalicylate","6-amino-2-oxo-2,3-dihydropyrimidinium 3,5-dinitrosalicylate","","- C11 H9 N5 O8 -","- C11 H9 N5 O8 -","- C44 H36 N20 O32 -","4","1","BT6603","Graham Smith; Urs D. Wermuth; Peter C. Healy","Cytosinium 3,5-dinitrosalicylate","Acta Crystallographica Section E","2005","61","3","o746","o748","10.1107/S160053680500499X","","","0.71069","MoKα","","0.105","0.0444","","","0.1193","0.1597","","","","","","0.926","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205218","9.966","0.002","12.079","0.002","16.345","0.002","90","","92.42","0.02","90","","1965.8","0.6","143","2","143","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,3-Di-tert-butyl-6-(trimethylsilylethynyl)fulvene","","- C19 H30 Si -","- C19 H30 Si -","- C76 H120 Si4 -","4","1","BT6604","Berger, Harald; Bubenitschek, Peter; Hopf, Henning; Jones, Peter G.","1,3-Di-<i>tert</i>-butyl-6-(trimethylsilylethynyl)fulvene","Acta Crystallographica Section E","2005","61","3","o710","o711","10.1107/S1600536805004745","","","0.71073","MoKα","","0.0692","0.0512","","","0.1242","0.1387","","","","","","1.032","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205219","9.1329","0.0008","18.882","0.002","8.8856","0.0007","90","","103.264","0.001","90","","1491.4","0.2","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[diethylenetriaminium [ferrate(III)-tri-μ-sulfato-κ^6^O:O'] monohydrate]","","- C4 H18 Fe N3 O13 S3 -","- C4 H18 Fe N3 O13 S3 -","- C16 H72 Fe4 N12 O52 S12 -","4","1","BT6605","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","<i>catena</i>-Poly[diethylenetriaminium [ferrate(III)-tri-μ-sulfato-κ^6^<i>O</i>:<i>O</i>'] monohydrate]","Acta Crystallographica Section E","2005","61","3","m593","m595","10.1107/S1600536805005349","","","0.71073","MoKα","","0.059","0.044","","","0.101","0.109","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205220","8.7918","0.0007","6.9963","0.0005","25.032","0.001","90","","90.289","0.002","90","","1539.7","0.18","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-Poly[hexamethylenediaminium [ferrate(III)-μ-hydroxo-κ^2^O:O-di-μ-sulfato-κ^4^O:O'] monohydrate]","","- C6 H21 Fe N2 O10 S2 -","- C6 H21 Fe N2 O10 S2 -","- C24 H84 Fe4 N8 O40 S8 -","4","1","BT6606","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","<i>catena</i>-Poly[hexamethylenediaminium [ferrate(III)-μ-hydroxo-κ^2^<i>O</i>:<i>O</i>-di-μ-sulfato-κ^4^<i>O</i>:<i>O</i>'] monohydrate]","Acta Crystallographica Section E","2005","61","3","m596","m597","10.1107/S1600536805005350","","","0.71073","MoKα","","0.053","0.035","","","0.091","0.1","","","","","","0.994","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205221","10.249","0.001","13.648","0.001","16.082","0.002","90","","102.045","0.002","90","","2200","0.4","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis[diethylenetriaminium(3+)] tris(sulfate) monohydrate","","- C8 H34 N6 O13 S3 -","- C8 H34 N6 O13 S3 -","- C32 H136 N24 O52 S12 -","4","0.5","BT6607","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","Bis[diethylenetriaminium(3+)] tris(sulfate) monohydrate","Acta Crystallographica Section E","2005","61","3","o772","o773","10.1107/S1600536805005362","","","0.71073","MoKα","","0.074","0.058","","","0.143","0.154","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205222","6.3192","0.0008","22.253","0.003","5.4903","0.0007","90","","90","","90","","772.05","0.17","295","2","295","2","","","","","","","","5","P n n m","-P 2 2n","58","","Trimethylenetetraaminium(4+) bis(sulfate) monohydrate","","- C6 H24 N4 O9 S2 -","- C6 H24 N4 O9 S2 -","- C12 H48 N8 O18 S4 -","2","0.25","BT6608","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","Triethylenetetraminium(4+) bis(sulfate) monohydrate","Acta Crystallographica Section E","2005","61","3","o774","o775","10.1107/S1600536805005477","","","0.71073","MoKα","","0.081","0.07","","","0.174","0.185","","","","","","1.14","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2205223","7.465","0.0015","8.067","0.0016","12.411","0.003","90","","98.16","0.03","90","","739.8","0.3","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(imidazolium) hexachlorotin(IV)","","- C6 H10 Cl6 N4 Sn -","- C6 H10 Cl6 N4 Sn -","- C12 H20 Cl12 N8 Sn2 -","2","0.5","BV6013","Zhang, Hui; Fang, Liang; Dronskowski, Richard; Kruse, Klaus; Yuan, Runzhang","Bis(imidazolium) hexachlorostannate(IV)","Acta Crystallographica Section E","2005","61","3","m543","m544","10.1107/S1600536805004770","","","0.71073","MoKα","","0.0204","0.0183","","","0.0453","0.0462","","","","","","1.07","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205224","4.7272","0.0001","7.6955","0.0003","10.1387","0.0004","100.743","0.0013","96.0038","0.0015","99.3371","0.0018","354.09","0.02","150","","150","","","","","","","","","3","P -1","-P 1","2","","n-Butyl acetate","","- C6 H12 O2 -","- C6 H12 O2 -","- C12 H24 O4 -","2","1","CF6393","Howard A. Shallard-Brown; David J. Watkin; Andrew R. Cowley","<i>n</i>-Butyl acetate","Acta Crystallographica Section E","2005","61","3","o561","o562","10.1107/S1600536805000371","","","0.71073","MoKα","","0.0567","0.0399","","0.104","0.097","0.104","","","","","","0.9722","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205225","7.195","0.002","7.106","0.002","9.131","0.003","90","","92.866","0.005","90","","466.3","0.2","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","3-(Imidazolidin-2-ylidene)-6-methyl-3,4,5,6-tetrahydro-2H-pyran-2,4-dione","","- C9 H12 N2 O3 -","- C9 H12 N2 O3 -","- C18 H24 N4 O6 -","2","0.5","CF6397","Jing-Jun Hao; Hu Xu; Hai-Bing Song; You-Ming Wang; Zheng-Ming Li","3-(Imidazolidin-2-ylidene)-6-methyl-3,4,5,6-tetrahydro-2<i>H</i>-pyran-2,4-dione","Acta Crystallographica Section E","2005","61","3","o749","o750","10.1107/S1600536805004812","","","0.71073","MoKα","","0.0689","0.0446","","","0.1212","0.1377","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205226","9.653","0.002","9.78","0.002","19.179","0.004","90","","90","","90","","1810.6","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","phenylacy (2S,4S)-N-tert-butoxycarbonyl-4-hydroxyprolinate","Phenylacyl (2S,4S)-1-tert-butoxycarbonyl-4-hydroxyprolinate","","- C18 H23 N O6 -","- C18 H23 N O6 -","- C72 H92 N4 O24 -","4","1","CF6401","Chabaud, Pauline; Worf, Monica; Courcambeck, Jérôme; Camplo, Michel; Pèpe, Gérard","Phenacyl (2<i>S</i>,4<i>S</i>)-1-<i>tert</i>-butoxycarbonyl-4-hydroxyprolinate","Acta Crystallographica Section E","2005","61","3","o792","o794","10.1107/S1600536805005404","","","0.71073","MoKα","","0.0439","0.0418","","","0.1308","0.1388","","","","","","0.899","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205227","9.7976","0.0009","14.3385","0.0013","11.9807","0.001","90","","94.534","0.004","90","","1677.8","0.3","299","1","299","1","","","","","","","","4","P 1 21 1","P 2yb","4","","N,N'-Bis[(R)-2-hydroxy-2-phenylethyl]-N,N'-bis[(S)-1-phenylethyl]pyridine-2,6- dicarboxamide","","- C39 H39 N3 O4 -","- C39 H39 N3 O4 -","- C78 H78 N6 O8 -","2","1","CF6402","Sosa-Rivadeneyra, Martha; Quintero, Leticia; Anaya de Parrodi, Cecilia; Juaristi, Eusebio; Bernès, Sylvain","<i>N,N</i>'-Bis[(<i>R</i>)-2-hydroxy-2-phenylethyl]-<i>N,N</i>'-bis[(<i>S</i>)-1-phenylethyl]pyridine-2,6-dicarboxamide: stabilization of an asymmetric conformer through the formation of a double intramolecular hydrogen bond","Acta Crystallographica Section E","2005","61","3","o536","o538","10.1107/S160053680500228X","","","0.71073","MoKα","","0.0439","0.0358","","","0.0914","0.0967","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205228","15.532","0.004","11.119","0.003","23.247","0.005","90","","90","","90","","4014.8","1.7","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-tert-Butoxy-1-phenyl-1-(2,2,6,6-tetramethylpiperidin-1-yloxy)ethane","","- C21 H35 N O2 -","- C21 H35 N O2 -","- C168 H280 N8 O16 -","8","1","CF6403","Batsanov, Andrei S.; Reid, Alistair J.; Cameron, Neil","2-<i>tert</i>-Butoxy-1-phenyl-1-(2,2,6,6-tetramethylpiperidin-1-yloxy)ethane","Acta Crystallographica Section E","2005","61","3","o716","o717","10.1107/S1600536805004976","","","0.71073","MoKα","","0.0451","0.0389","","","0.1064","0.1144","","","","","","1.064","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205229","21.662","0.002","16.726","0.002","7.405","0.001","90","","90","","90","","2683","0.5","295","2","295","2","","","","","","","","5","C m c a","-C 2ac 2","64","","catena-Poly[[μ-4,4'-bipyridine-bis[aquacopper(II)]]-di-μ-2-nitroterephthalato]","","- C26 H18 Cu2 N4 O14 -","- C26 H18 Cu2 N4 O14 -","- C104 H72 Cu8 N16 O56 -","4","","CF6404","He, Hong-Yin; Zhu, Long-Guan; Ng, Seik Weng","<i>catena</i>-Poly[[[μ-4,4'-bipyridine-bis[aquacopper(II)]]-di-μ-2-nitroterephthalato]","Acta Crystallographica Section E","2005","61","3","m601","m602","10.1107/S1600536805005751","","","0.71073","MoKα","","0.087","0.05","","","0.125","0.137","","","","","","0.92","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2205230","6.8108","0.0008","11.0797","0.0012","13.3766","0.0015","75.862","0.002","84.841","0.002","81.296","0.002","966.09","0.19","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(4-nitrophenyl)methyleneimino]- 1H-pyrazole-3-carbonitrile","","- C18 H8 Cl2 F3 N5 O2 -","- C18 H8 Cl2 F3 N5 O2 -","- C36 H16 Cl4 F6 N10 O4 -","2","1","CF6405","Zhong, Ping; Yang, Zhiping; Shi, Qian","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(4-nitrophenyl)methyleneimino]-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","3","o786","o787","10.1107/S1600536805005659","","","0.71073","MoKα","","0.07","0.0579","","","0.1523","0.1615","","","","","","1.038","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205231","12.818","0.003","13.026","0.003","16.554","0.004","90","","106.07","0.02","90","","2656","1.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[N,N'-Bis(2,4-dimethylbenzene)-2,3-dimethyl-1,4-diazabuta-1,3-diene]- fac-tricarbonyl(trifluoroacetato)rhenium(I)","","- C25 H24 F3 N2 O5 Re -","- C25 H24 F3 N2 O5 Re -","- C100 H96 F12 N8 O20 Re4 -","4","1","CF6407","Kia, Reza; Mirkhani, Valiollah; Deák, Andrea; Kálmán, Alajos","[<i>N</i>,<i>N</i>'-Bis(2,4-dimethylbenzene)-2,3-dimethyl-1,4-diazabuta-1,3-diene]-<i>fac</i>-tricarbonyl(trifluoroacetato)rhenium(I)","Acta Crystallographica Section E","2005","61","3","m566","m567","10.1107/S1600536805005003","","","0.71073","MoKα","","0.1059","0.0417","","","0.0785","0.0869","","","","","","0.924","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205232","19.191","0.005","7.719","0.002","12.64","0.003","90","","94.845","0.018","90","","1865.7","0.8","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-(2-chloro-1,4-dihydro-1,4-dioxonaphthalen-3-ylamino)-4-phenylthiazole-5- carboxylate","","- C22 H15 Cl N2 O4 S -","- C22 H15 Cl N2 O4 S -","- C88 H60 Cl4 N8 O16 S4 -","4","1","CF6409","Daniel E. Lynch; Ian McClenaghan","Ethyl 2-(2-chloro-1,4-dihydro-1,4-dioxonaphthalen-3-ylamino)-4-phenylthiazole-5-carboxylate","Acta Crystallographica Section E","2005","61","3","o790","o791","10.1107/S1600536805005647","","","0.71073","MoKα","","0.1162","0.0939","","","0.2312","0.2507","","","","","","1.143","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205233","40.922","0.006","6.8025","0.0009","15.151","0.002","90","","90","0.002","90","","4217.6","1","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaquabis(propane-1,2-diamine-κ^2^N,N')copper(II) terephthalate dihydrate","","- C14 H32 Cu N4 O8 -","- C14 H32 Cu N4 O8 -","- C112 H256 Cu8 N32 O64 -","8","1","CI6501","Lin, Zhi-Dong; Liu, Li-Ming; Lu, Jin-Yu; Meng, Xiang-Gao","Diaquabis(propane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')copper(II) terephthalate dihydrate","Acta Crystallographica Section E","2005","61","3","m590","m592","10.1107/S1600536805002977","","","0.71073","MoKα","","0.0569","0.0465","","","0.1319","0.1407","","","","","","1.096","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205234","10.2104","0.0014","12.1592","0.0016","13.9932","0.0019","66.705","0.002","70.878","0.002","70.7","0.002","1466.6","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Bis(μ-4-bromoisophthalato)bis[bis(1,10-phenanthroline)manganese(II)] tetrahydrate","","- C64 H46 Br2 Mn2 N8 O12 -","- C64 H46 Br2 Mn2 N8 O12 -","- C64 H46 Br2 Mn2 N8 O12 -","1","0.5","CI6516","Hong-Ping Xiao; Mao-Lin Hu; Ji-Xin Yuan","Bis(μ-4-bromoisophthalato)bis[bis(1,10-phenanthroline)manganese(II)] tetrahydrate","Acta Crystallographica Section E","2005","61","3","m443","m445","10.1107/S1600536805003004","","","0.71073","MoKα","","0.0985","0.0754","","","0.1429","0.1525","","","","","","1.203","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205235","4.877","0.003","8.104","0.006","11.832","0.007","105.6","0.07","91.87","0.07","102.17","0.07","438.3","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","2-Methyl-7-oxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-3-ium chloride","","- C7 H9 Cl N4 O -","- C7 H9 Cl N4 O -","- C14 H18 Cl2 N8 O2 -","2","1","CI6518","Chernyshev, Ilya V.; Tursina, Anna I.","2-Methyl-7-oxo-5,6,7,8-tetrahydropyrimido[4,5-<i>d</i>]pyrimidin-3-ium chloride, a product of the thermal decomposition of nimustine hydrochloride (ACNU)","Acta Crystallographica Section E","2005","61","3","o544","o546","10.1107/S1600536805002874","","","0.71073","MoKα","","0.1478","0.0376","","","0.0662","0.0863","","","","","","0.969","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205236","8.398","0.003","8.68","0.003","13.558","0.004","93.725","0.005","91.749","0.004","106.977","0.004","942","0.5","571","2","571","2","","","","","","","","6","P -1","-P 1","2","","k^2^O-copper(II)","","- C38 H30 Cl2 Cu N10 O8 -","- C38 H30 Cl2 Cu N10 O8 -","- C38 H30 Cl2 Cu N10 O8 -","1","0.5","CI6521","Zhang, Shu-Ping; Liu, Zhao-Di; Ma, Ji-Long; Yang, Song; Shao, Si-Chang","<i>trans</i>-Bis[4-(4-methylphenyl)-3,5-di-2-pyridyl-4<i>H</i>-1,2,4-triazole]diperchlorato-κ^2^<i>O</i>-copper(II)","Acta Crystallographica Section E","2005","61","3","m423","m424","10.1107/S1600536805002540","","","0.71073","MoKα","","0.0631","0.0423","","","0.0968","0.11","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205237","7.374","0.002","7.707","0.002","10.928","0.003","83.34","0.004","82.215","0.004","63.269","0.003","548.5","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-Benzyloxy-3-nitropyridine","","- C12 H10 N2 O3 -","- C12 H10 N2 O3 -","- C24 H20 N4 O6 -","2","1","CI6522","Cui, Yu; Liu, Hui-Min; Zhang, Wen-Qin","2-Benzyloxy-3-nitropyridine","Acta Crystallographica Section E","2005","61","3","o685","o686","10.1107/S1600536805004204","","","0.71073","MoKα","","0.0648","0.0401","","","0.1045","0.1127","","","","","","1.017","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205238","12.598","0.003","13.021","0.003","13.652","0.003","116.04","0.03","101.84","0.03","106.21","0.03","1787.3","1.2","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","bis(2-oxidonaphthalene-1-carbaldehyde benzoylhydrazonato)vanadium(IV) dichloromethane hexane hemisolvate","","- C40 H33 Cl2 N4 O4 V -","- C40 H33 Cl2 N4 O4 V -","- C80 H66 Cl4 N8 O8 V2 -","2","1","CI6524","Gao, Shan; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng","A trigonal prismatic coordination geometry for vanadium in bis(2-oxidonaphthalene-1-carbaldehyde benzoylhydrazonato)vanadium(IV) dichloromethane hexane hemisolvate","Acta Crystallographica Section E","2005","61","3","m519","m521","10.1107/S1600536805004174","","","0.71073","MoKα","","0.077","0.056","","","0.16","0.174","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205239","21.394","0.002","7.796","0.002","6.918","0.002","90","","93.7","0.02","90","","1151.4","0.5","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-[(4-Fluorophenyl)methylenehydrazinocarbonyl]-1H-1,2,4-triazole monohydrate","","- C10 H10 F N5 O2 -","- C10 H10 F N5 O2 -","- C40 H40 F4 N20 O8 -","4","1","CI6525","Fu-You Pan; Jian-Guo Yang","3-[(4-Fluorophenyl)methylenehydrazinocarbonyl]-1<i>H</i>-1,2,4-triazole monohydrate","Acta Crystallographica Section E","2005","61","3","o712","o713","10.1107/S1600536805004162","","","0.71073","MoKα","","0.2202","0.0569","","","0.1315","0.1888","","","","","","1.011","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205240","10.0183","0.0008","12.1239","0.001","13.4174","0.0011","91.415","0.002","101.451","0.002","112.473","0.001","1466.8","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-(1-Benzoyl-1-phenylethyl)-3-phenylsulfanyl-1-phenylsulfonyl-1H-indole","","- C35 H27 N O3 S2 -","- C35 H27 N O3 S2 -","- C70 H54 N2 O6 S4 -","2","1","CI6526","Malathy Sony, S. M.; Palani, K.; Charles, P.; Ponnuswamy, M. N.; Sureshbabu, N.; Srinivasan, P. C.; Nethaji, M.","2-(1-Benzoyl-1-phenylethyl)-3-phenylsulfanyl-1-phenylsulfonyl-1<i>H</i>-indole","Acta Crystallographica Section E","2005","61","3","o578","o580","10.1107/S1600536805003569","","","0.71073","MoKα","","0.0851","0.0615","","","0.1518","0.1678","","","","","","1.023","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205241","5.9532","0.0008","8.1287","0.0001","38.848","0.005","90","","90","","90","","1879.9","0.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Purpuriol","[6-(benzoyloxy)-1,4,5-trihydroxycyclohex-2-en-1-yl]methyl benzoate","","- C21 H20 O7 -","- C21 H20 O7 -","- C84 H80 O28 -","4","1","CI6527","Supattra Angchuan; Suchada Chantrapromma; Hoong-Kun Fun; Chatchanok Karalai","[6-(Benzoyloxy)-1,4,5-trihydroxycyclohex-2-en-1-yl]methyl benzoate","Acta Crystallographica Section E","2005","61","3","o699","o701","10.1107/S1600536805004575","","","0.71073","MoKα","","0.0627","0.0549","","","0.1176","0.1208","","","","","","1.201","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205242","9.4496","0.0004","9.4496","0.0004","15.3237","0.0004","90","","90","","120","","1185.01","0.08","110","2","110","2","","","","","","","","6","P -3 c 1","-P 3 2""c","165","","Tris(biacetyl dihydrazone-κ^2^N,N')zinc(II) bis(perchlorate)","","- C12 H30 Cl2 N12 O8 Zn -","- C12 H30 Cl2 N12 O8 Zn -","- C24 H60 Cl4 N24 O16 Zn2 -","2","0.166667","CI6528","Helena Elengoz; Rinat Shoshnik; Israel Goldberg","Tris(biacetyl dihydrazone-κ^2^<i>N,N</i>')zinc(II) bis(perchlorate) at 110K","Acta Crystallographica Section E","2005","61","3","m538","m540","10.1107/S1600536805004757","","","0.71073","MoKα","","0.0512","0.0354","","","0.0814","0.0897","","","","","","0.982","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205243","9.5905","0.0007","9.5905","0.0007","15.2874","0.0008","90","","90","","120","","1217.72","0.14","110","2","110","2","","","","","","","","6","P -3 c 1","-P 3 2""c","165","","Tris(biacetyl dihydrazone-κ^2^N,N')cadmium(II) bis(perchlorate) at 110 K","","?","- C12 H30 Cd Cl2 N12 O8 -","- C24 H60 Cd2 Cl4 N24 O16 -","2","0.166667","CI6529","Einat Tirosh; Rozi Maman; Israel Goldberg","Tris(biacetyl dihydrazone-κ^2^<i>N</i>,<i>N</i>')cadmium(II) bis(perchlorate) at 110K","Acta Crystallographica Section E","2005","61","3","m541","m542","10.1107/S1600536805004769","","","0.71073","MoKα","","0.0459","0.0324","","","0.0839","0.0904","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205244","9.066","0.0018","10.283","0.002","11.889","0.002","90","","99.07","0.03","90","","1094.5","0.4","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Phenyl-1-(propan-2-ylidene)thiosemicarbazide","","- C10 H13 N3 S -","- C10 H13 N3 S -","- C40 H52 N12 S4 -","4","1","CV6449","Fangfang Jian; Zhengshuai Bai; Hailian Xiao; Kai Li","4-Phenyl-1-(propan-2-ylidene)thiosemicarbazide","Acta Crystallographica Section E","2005","61","3","o653","o654","10.1107/S1600536805004320","","","0.71073","MoKα","","0.0482","0.0373","","","0.1105","0.1185","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205245","9.3365","0.0011","22.824","0.005","9.3508","0.0012","90","","98.629","0.008","90","","1970.1","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-[(2,6-Diisopropylphenyl)iminomethyl]-2-naphthol","","- C23 H25 N O -","- C23 H25 N O -","- C92 H100 N4 O4 -","4","1","CV6451","Lin, Jin; Cui, Guang-Hua; Li, Jian-Rong; Xu, Shan-Sheng","3-{[(2,6-Diisopropylphenyl)imino]methyl}-2-naphthol","Acta Crystallographica Section E","2005","61","3","o627","o628","10.1107/S1600536805002035","","","0.71073","MoKα","","0.1176","0.0536","","","0.1332","0.1656","","","","","","1.012","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205246","9.196","0.002","9.407","0.002","13.322","0.003","90","","90","","90","","1152.4","0.4","295","2","295","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","2,6-Diammonio-4-toluenesulfonate chloride dihydrate","","- C7 H15 Cl N2 O5 S -","- C7 H15 Cl N2 O5 S -","- C28 H60 Cl4 N8 O20 S4 -","4","0.5","CV6455","Gao, Shan; Huo, Li-Hua; Ng, Seik Weng","2,6-Diammonio-4-toluenesulfonate chloride dihydrate","Acta Crystallographica Section E","2005","61","3","o612","o613","10.1107/S1600536805003922","","","0.71073","MoKα","","0.041","0.039","","","0.127","0.13","","","","","","1.11","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205247","4.7521","0.0002","8.87","0.0004","13.1941","0.0006","73.916","0.002","81.771","0.002","74.706","0.002","513.98","0.04","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","2,3,5,6-Tetramethylpyrazine‒p-nitrophenol (1/2)","","- C20 H22 N4 O6 -","- C20 H22 N4 O6 -","- C20 H22 N4 O6 -","1","0.5","CV6456","Xiao-Qing Cai; Mao-Lin Hu; Ya-Juan Zhao; Ya-Qian Cheng; Shun Wang","2,3,5,6-Tetramethylpyrazine‒<i>p</i>-nitrophenol (1/2)","Acta Crystallographica Section E","2005","61","3","o614","o615","10.1107/S160053680500382X","","","0.71073","MoKα","","0.0809","0.0767","","","0.1667","0.1696","","","","","","1.273","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205248","17.1636","0.0009","16.518","0.0009","14.6151","0.0008","90","","100.798","0.001","90","","4070.1","0.4","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[[[diaqua(2-sulfonatobenzoato)nickel(II)]-μ-1,2-di-4- pyridylethylene] 0.25-hydrate]","","- C19 H18.5 N2 Ni O7.25 S -","- C19 H18 N2 Ni O7.25 S -","- C152 H144 N16 Ni8 O58 S8 -","8","1","CV6457","Xiao, Hong-Ping; Li, Xin-Hua; Hu, Mao-Lin","<i>catena</i>-Poly[[[diaqua(2-sulfonatobenzoato)nickel(II)]-μ-1,2-di-4-pyridylethylene] 0.25-hydrate]","Acta Crystallographica Section E","2005","61","3","m506","m508","10.1107/S1600536805003831","","","0.71073","MoKα","","0.0346","0.0315","","","0.0814","0.083","","","","","","1.03","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205249","8.9306","0.0011","10.0106","0.0012","14.4694","0.0017","90","","94.02","0.01","90","","1290.4","0.3","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-[(Methoxyglycyl)carbonyl]tetrathiafulvalene","","- C10 H9 N O3 S4 -","- C10 H9 N O3 S4 -","- C40 H36 N4 O12 S16 -","4","1","CV6459","Batsanov, Andrei S.; Viles, Sarah L.; Moore, Adrian J.","4-[(Methoxyglycyl)carbonyl]tetrathiafulvalene","Acta Crystallographica Section E","2005","61","3","o648","o650","10.1107/S160053680500396X","","","0.71073","MoKα","","0.0342","0.0277","","","0.0718","0.0754","","","","","","1.044","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205250","7.5493","0.0008","9.786","0.001","13.148","0.001","69.753","0.001","80.542","0.001","71.34","0.001","861.85","0.14","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Poly[[(1,10-phenanthroline)lead(II)]-μ~5~-1,3-benzenedicarboxylato]","","- C20 H12 N2 O4 Pb -","- C20 H12 N2 O4 Pb -","- C40 H24 N4 O8 Pb2 -","2","1","CV6460","Wang, Hai-Dong; He, Hong-Yin; Wang, Yue-Jian; Zhu, Long-Guan; Ng, Seik Weng","Poly[[(1,10-phenanthroline)lead(II)]-μ~5~-1,3-benzenedicarboxylato]","Acta Crystallographica Section E","2005","61","3","m531","m532","10.1107/S1600536805004599","","","0.71073","MoKα","","0.034","0.028","","","0.056","0.059","","","","","","0.96","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205251","16.285","0.0004","11.6795","0.0003","10.7413","0.0003","90","","103.635","0.001","90","","1985.42","0.09","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,3-Bis(2-cyanoethylsulfanyl)-6,7-bis(methylsulfanyl)tetrathiafulvalene","","- C14 H14 N2 S8 -","- C14 H14 N2 S8 -","- C56 H56 N8 S32 -","4","1","CV6462","Bond, Andrew D.; Jeppesen, Jan O.","2,3-Bis(2-cyanoethylsulfanyl)-6,7-bis(methylsulfanyl)tetrathiafulvalene","Acta Crystallographica Section E","2005","61","3","o765","o766","10.1107/S1600536805005489","","","0.71073","MoKα","","0.0542","0.0328","","","0.0818","0.0865","","","","","","1.137","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205252","9.7162","0.0001","14.3502","0.0002","15.8887","0.0001","71.175","0.003","79.856","0.003","78.059","0.001","2037.12","0.05","273","1","273","1","","","","","","","","6","P -1","-P 1","2","","dichloro[(RS)-1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl- κN^4^)pentan-3-ol]copper(II) ethanol tetrasolvate","","- C72 H112 Cl6 Cu N12 O8 -","- C72 H112 Cl6 Cu N12 O8 -","- C72 H112 Cl6 Cu N12 O8 -","1","0.5","DN6189","Pei-Zhi Zhang; Jun Wu","A copper(II) complex of the fungicide tebuconazole","Acta Crystallographica Section E","2005","61","3","m560","m562","10.1107/S1600536805004939","","","0.71069","MoKα","","0.0778","0.0505","","","0.1081","0.1177","","","","","","1.014","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205253","14.2339","0.0008","7.7622","0.0004","17.801","0.001","90","","110.94","0.001","90","","1836.87","0.17","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Poly[[cis-diaqua(2,2'-bipyridine)copper(II)]-μ-3-carboxylato-4- hydroxybenzenesulfonato]","","- C17 H16 Cu N2 O8 S -","- C17 H16 Cu N2 O8 S -","- C68 H64 Cu4 N8 O32 S4 -","4","1","DN6199","Fan, Sai-Rong; Zhu, Long-Guan; Xiao, Hong-Ping; Ng, Seik Weng","Poly[[<i>cis</i>-diaqua(2,2'-bipyridine)copper(II)]-μ-3-carboxylato-4-hydroxybenzenesulfonato]","Acta Crystallographica Section E","2005","61","3","m509","m511","10.1107/S1600536805004022","","","0.71073","MoKα","","0.0566","0.0518","","","0.11","0.1122","","","","","","1.197","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205254","25.149","0.004","7.976","0.005","5.916","0.004","90","","90","","90","","1186.7","1.1","173","2","173","2","","","","","","","","4","P c a 21","P 2c -2ac","29","Phenyl p-toluenesulfonate","Phenyl 4-toluenesulfonate","","- C13 H12 O3 S -","- C13 H12 O3 S -","- C52 H48 O12 S4 -","4","1","ER6006","Vadivelu Manivannan; Nagarajan Vembu; Maruthai Nallu; Kandasamy Sivakumar; Anthony Linden","Phenyl 4-toluenesulfonate: supramolecular aggregation through weak C—H···O and C—H···π interactions","Acta Crystallographica Section E","2005","61","3","o690","o692","10.1107/S1600536805001029","","","0.71069","MoKα","","0.0786","0.0669","","","0.1622","0.1767","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205255","8.418","0.003","11.517","0.005","15.363","0.006","90","","100.25","0.007","90","","1465.7","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Chloro[2-(2,2'-bipyridyl-6-yl)-5-methylphenyl]platinum(II)","","- C17 H13 Cl N2 Pt -","- C17 H13 Cl N2 Pt -","- C68 H52 Cl4 N8 Pt4 -","4","1","ER6007","Qian-Yong Cao; Wen-Fu Fu; Xi-Juan Zhao","Chloro[2-(2,2'-bipyridyl-6-yl)-5-methylphenyl]platinum(II)","Acta Crystallographica Section E","2005","61","3","m427","m429","10.1107/S1600536805002746","","","0.71073","MoKα","","0.0481","0.0324","","","0.074","0.0808","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205256","8.8693","0.001","9.3982","0.001","9.7112","0.001","70.446","0.004","71.335","0.004","81.831","0.008","722.12","0.14","120","","120","","","","","","","","","4","P -1","-P 1","2","α-naphthyl p-toluenesulfonate","1-naphthyl 4-toluenesulfonate","","- C17 H14 O3 S -","- C17 H14 O3 S -","- C34 H28 O6 S2 -","2","1","FL6137","Vadivelu Manivannan; Nagarajan Vembu; Maruthai Nallu; Kandasamy Sivakumar; Frank R. Fronczek","1-Napthyl 4-toluenesulfonate: supramolecular aggregation through weak C—H···O and C—H···π interactions","Acta Crystallographica Section E","2005","61","3","o528","o530","10.1107/S160053680500276X","","","0.71073","MoKα","","0.0439","0.0356","","","0.0879","0.0924","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205257","14.51","0.004","11.223","0.004","17.887","0.005","90","","113.53","0.02","90","","2670.6","1.5","100","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","fac-Tricarbonyl(2,9-dimethyl-1,10-phenanthroline)(2,6-dimethylphenyl isocyanide)rhenium(I) hexafluorophosphate","","- C26 H21 F6 N3 O3 P Re -","- C26 H21 F6 N3 O3 P Re -","- C104 H84 F24 N12 O12 P4 Re4 -","4","1","FL6138","John M. Villegas; Stanislav R. Stoyanov; Curtis E. Moore; David M. Eichhorn; D. Paul Rillema","<i>fac</i>-Tricarbonyl(2,9-dimethyl-1,10-phenanthroline)(2,6-dimethylphenyl isocyanide)rhenium(I) hexafluorophosphate","Acta Crystallographica Section E","2005","61","3","m533","m534","10.1107/S1600536805004678","","","0.71073","MoKα","","","0.0211","","","","0.0514","","","","","","1.089","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2205258","9.7378","0.001","10.579","0.0009","15.2761","0.0015","90","","90","","90","","1573.7","0.3","180","2","180","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","mepivacaine hydrochloride","(2R)-2-(2,6-dimethylphenylaminocarbonyl)-1-methylpiperidinium chloride","","- C15 H23 Cl N2 O -","- C15 H23 Cl N2 O -","- C60 H92 Cl4 N8 O4 -","4","1","FL6144","Bambagiotti Alberti, Massimo; Bruni, Bruno; Di Vaira, Massimo; Giannellini, Valerio","(<i>R</i>)-(‒)-Mepivacaine hydrochloride enantiomer: a low-temperature study","Acta Crystallographica Section E","2005","61","3","o585","o586","10.1107/S1600536805003363","","","1.5418","CuKα","","0.0243","0.0224","","","0.0465","0.0468","","","","","","0.956","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205259","19.382","0.008","5.303","0.002","8.492","0.003","90","","93.126","0.006","90","","871.5","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(R,S)-1,4-bis(benzylsulfinyl)butane","","- C18 H22 O2 S2 -","- C18 H22 O2 S2 -","- C36 H44 O4 S4 -","2","0.5","FL6145","Jian-Rong Li; Ruo-Hua Zhang; Xian-He Bu","(<i>R</i>,<i>S</i>)-1,4-Bis(benzylsulfinyl)butane","Acta Crystallographica Section E","2005","61","3","o581","o582","10.1107/S1600536805003351","","","0.71073","MoKα","","0.1232","0.0685","","","0.1481","0.1652","","","","","","1.034","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205260","11.5181","0.0018","13.8876","0.0015","13.9889","0.001","93.532","0.007","95.868","0.009","109.014","0.009","2093.7","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Poly[[bis(triphenylphosphine)mercury(II)]-μ-thiocyanato-cadmium(II)- tri-μ-thiocyanato]","","- C40 H30 Cd Hg N4 P2 S4 -","- C40 H30 Cd Hg N4 P2 S4 -","- C80 H60 Cd2 Hg2 N8 P4 S8 -","2","1","FL6146","Wang, Xin Qiang; Yu, Wen Tao; Xu, Dong; Sun, Hai Qing","Poly[[bis(triphenylphosphine)mercury(II)]-μ-thiocyanato-cadmium(II)-tri-μ-thiocyanato]","Acta Crystallographica Section E","2005","61","3","m548","m550","10.1107/S160053680500468X","","","0.71073","MoKα","","0.0454","0.0343","","","0.0747","0.0791","","","","","","1.051","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205261","17.041","0.004","4.8657","0.001","11.656","0.003","90","","130.91","0.003","90","","730.4","0.3","298","2","298","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","threo-3,4-dihydroxyhexane-2,5-dione","","- C6 H10 O4 -","- C6 H10 O4 -","- C24 H40 O16 -","4","0.5","FL6147","Fang Sheng; Chao-Hong He; Xian-Hui Liang; Wei-Ke Su","<i>threo</i>-3,4-Dihydroxyhexane-2,5-dione","Acta Crystallographica Section E","2005","61","3","o788","o789","10.1107/S1600536805005556","","","0.71073","MoKα","","0.0535","0.0479","","","0.123","0.1284","","","","","","1.047","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205262","10.0955","0.0007","9.85","0.0006","13.3756","0.0008","90","","111.226","0.005","90","","1239.85","0.14","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-Methyl-N'-(1-methylethylidene)imidazo[2,1-b][1,3]thiazole-5-carbohydrazide monohydrate","","- C10 H14 N4 O2 S -","- C10 H14 N4 O2 S -","- C40 H56 N16 O8 S4 -","4","1","FL6148","Mehmet Akkurt; Sema Öztürk Yıldırım; Fusun Ur; Zafer Cesur; Nesrin Cesur; Orhan Büyükgüngör","6-Methyl-<i>N</i>'-(1-methylethylidene)imidazo[2,1-<i>b</i>][1,3]thiazole-5-carbohydrazide monohydrate","Acta Crystallographica Section E","2005","61","3","o718","o720","10.1107/S160053680500509X","","","0.71073","MoKα","","0.0524","0.0391","","","0.0999","0.1074","","","","","","1.046","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205263","10.8447","0.0006","8.3527","0.0005","17.443","0.001","90","","96.257","0.001","90","","1570.62","0.16","200","2","200","2","","","","","","","","4","P 1 21 1","P 2yb","4","","2,3,4-Tri-O-acetyl-β-L-fucopyranosyl azide","","- C12 H17 N3 O7 -","- C12 H17 N3 O7 -","- C48 H68 N12 O28 -","4","2","FL6149","Norris, Peter; Zeller, Matthias","2,3,4-Tri-<i>O</i>-acetyl-β-<small>L</small>-fucopyranosyl azide","Acta Crystallographica Section E","2005","61","3","o729","o730","10.1107/S1600536805005106","","","0.71073","MoKα","","0.0407","0.0386","","","0.1075","0.1096","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205264","24.541","0.005","11.537","0.002","14.897","0.003","90","","119.05","0.03","90","","3687.2","1.6","105","2","105","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Pentazocine HCl","2-Hydroxy-5,9-dimethyl-2-(3-methylbuten-2-yl)-6,7-benzomorphanium chloride","","- C19 H28 Cl N O -","- C19 H28 Cl N O -","- C152 H224 Cl8 N8 O8 -","8","1","GH6013","Arvid Mostad.","A second polymorphic form of pentazocine hydrochloride at 105K","Acta Crystallographica Section E","2005","61","3","o726","o728","10.1107/S1600536805004903","","","0.71073","MoKα","","0.0401","0.0356","","","0.0973","0.1023","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205265","6.143","0.001","25.34","0.005","7.483","0.001","90","","97.58","0.03","90","","1154.7","0.3","298","2","298","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Catena-poly [aqua dicinnamate cadmium-u-1,4-diazabicyclo[2.2.2]octane]","","- C24 H28 Cd N2 O5 -","- C24 H28 Cd N2 O5 -","- C48 H56 Cd2 N4 O10 -","2","0.5","HB6110","Qu, Yang; Liu, Zhao-Di; Zhu, Hai-Liang; Tan, Min-Yu","<i>catena</i>-Poly[[aquadicinnamatocadmium]-μ-1,4-diazabicyclo[2.2.2]octane]","Acta Crystallographica Section E","2005","61","3","m420","m422","10.1107/S1600536804034282","","","0.71073","MoKα","","0.0481","0.0436","","","0.1129","0.1158","","","","","","1.098","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205266","29.654","0.018","8.53","0.005","13.801","0.008","90","","95.829","0.01","90","","3473","4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tris(pyridine-2-carboxylato-κ^2^0,N)cobalt(III) monohydrate","","- C18 H14 Co N3 O7 -","- C18 H14 Co N3 O7 -","- C144 H112 Co8 N24 O56 -","8","1","HB6144","Fu, Ai-Yun; Wang, Da-Qi","Tris(pyridine-2-carboxylato-κ^2^<i>O</i>,<i>N</i>)cobalt(III) monohydrate","Acta Crystallographica Section E","2005","61","3","m481","m482","10.1107/S160053680500317X","","","0.71073","MoKα","","0.0967","0.0501","","","0.0597","0.0656","","","","","","0.954","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205267","8.0529","0.0003","10.1125","0.0004","10.3508","0.0004","88.706","0.002","77.492","0.002","89.568","0.002","822.7","0.06","150","1","150","1","","","","","","","","4","P -1","-P 1","2","","(4-tert-butylphenyl)phospha[1]ferrocenophane","","- C20 H21 Fe P -","- C20 H21 Fe P -","- C40 H42 Fe2 P2 -","2","1","HB6147","Cyr, Paul w.; Lough, Alan J.; Manners, Ian","(4-<i>tert</i>-Butylphenyl)phospha[1]ferrocenophane","Acta Crystallographica Section E","2005","61","3","m457","m459","10.1107/S1600536805003089","","","0.71073","MoKα","","0.0737","0.0626","","","0.1595","0.1654","","","","","","1.115","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205268","21.027","0.005","6.3196","0.0017","13.382","0.004","90","","102.354","0.016","90","","1737.1","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-poly[[aqua(nitrato-κ^2^O,O')copper(II)]-μ-pyrazine-2-carboxylato- κ^3^N^1^,O:N^4^]","","- C5 H5 Cu N3 O6 -","- C5 H5 Cu N3 O6 -","- C40 H40 Cu8 N24 O48 -","8","1","HB6148","Bo Zheng; Gang Liu; Lei Gou; Dao-Yong Wang; Huai-Ming Hu","A one-dimensional coordination polymer of copper(II) with 2-pyrazinecarboxylate","Acta Crystallographica Section E","2005","61","3","m499","m501","10.1107/S1600536805003788","","","0.71073","MoKα","","0.1006","0.0473","","","0.0957","0.1106","","","","","","0.813","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205269","21.645","0.008","14.15","0.01","16.48","0.01","90","","97.51","0.03","90","","5004","5","296","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","μ-Oxo-κ^2^O:O-bis[bis(1,10-phenanthroline-κ^2^N,N')(sulfato-κO)iron(III)] octahydrate","","- C48 H48 Fe2 N8 O17 S2 -","- C48 H48 Fe2 N8 O17 S2 -","- C192 H192 Fe8 N32 O68 S8 -","4","0.5","HB6149","Odoko, Mamiko; Okabe, Nobuo","μ-Oxo-κ^2^<i>O</i>:<i>O</i>-bis[bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(sulfato-κ<i>O</i>)iron(III)] octahydrate","Acta Crystallographica Section E","2005","61","3","m587","m589","10.1107/S1600536805005660","","","0.7107","MoKα","","","0.0374","","","","0.1156","","","","","","1.119","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205270","9.3183","0.0007","10.073","0.0009","12.4423","0.0009","90","","90","","90","","1167.87","0.16","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Trirubidium cobalt tetrachloride nitrate(V), Rb~3~CoCl~4~NO~3~","","- Cl4 Co N O3 Rb3 -","- Cl4 Co N O3 Rb3 -","- Cl16 Co4 N4 O12 Rb12 -","4","0.5","HB6150","Ouarsal, Rachid; Lachkar, Mohammed; Bolte, Michael; El Bali, Brahim","Trirubidium cobalt tetrachloride nitrate(V), Rb~3~CoCl~4~NO~3~","Acta Crystallographica Section E","2005","61","3","i44","i45","10.1107/S1600536805004289","","","0.71073","MoKα","","0.0248","0.02","","","0.0416","0.0428","","","","","","1.015","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205271","9.5936","0.0005","11.3569","0.0005","13.9792","0.0007","90","","108.023","0.001","90","","1448.35","0.12","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[N-methylpiperazinium(2+) [[bis(oxalato-κ^2^-O,O')zirconate(IV)]-μ~2~-oxalato-κ^4^O,O':O'',O''']]","","- C11 H14 N2 O12 Zr -","- C11 H14 N2 O12 Zr -","- C44 H56 N8 O48 Zr4 -","4","1","HB6152","Fu, Yun-Long; Ren, Jia-Lin; Ng, Seik Weng","<i>catena</i>-Poly[<i>N</i>-methylpiperazinium(2+) [[bis(oxalato-κ^2^<i>O</i>,<i>O</i>')zirconate(IV)]-μ~2~-oxalato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>''']]","Acta Crystallographica Section E","2005","61","3","m491","m493","10.1107/S1600536805003806","","","0.71073","MoKα","","0.021","0.019","","","0.053","0.054","","","","","","1.06","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205272","9.58","0.002","13.416","0.002","10.743","0.002","90","","90","","90","","1380.7","0.4","295","","295","","","","","","","","","7","I b a m","-I 2 2c","72","","catena-poly[[[bis(ethylenediamine)platinum(II)]-μ-chloro- [bis(ethylenediamine)platinum(IV)]-μ-chloro] tetrakis(tetrafluoroborate)]","","- C8 H32 B4 Cl2 F16 N8 Pt2 -","- C8 H32 B4 Cl2 F16 N8 Pt2 -","- C16 H64 B8 Cl4 F32 N16 Pt4 -","2","0.125","HB6153","Matsushita, Nobuyuki","A one-dimensional Cl-bridged Pt^II^/Pt^IV^ mixed-valence complex, <i>catena</i>-poly[[[bis(ethylenediamine)platinum(II)]-μ-chloro-[bis(ethylenediamine)platinum(IV)]-μ-chloro] tetrakis(tetrafluoroborate)]","Acta Crystallographica Section E","2005","61","3","m514","m516","10.1107/S1600536805004113","","","0.71069","MoKα","","0.0474","0.0263","","","0.0609","0.0678","","","","","","1.068","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205273","8.975","0.0001","20.4196","0.0003","21.9152","0.0004","90","","90","","90","","4016.31","0.1","105","2","105","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Disodium cytidine-5'-monophosphate 6.07-hydrate methanol 0.27-solvate","","- C9.25 H22 N3 Na2 O14.38 P -","- C9.273 H21.8958 N3 Na2 O14.3799 P -","- C74.184 H175.166 N24 Na16 O115.039 P8 -","8","2","HB6154","Gonzalez, Susana Villa; Larsen, Kristofer; Nelson, William H.; Sagstuen, Einar; Görbitz, Carl Henrik","Disodium cytidine-5'-monophosphate 6.07-hydrate methanol 0.27-solvate","Acta Crystallographica Section E","2005","61","3","m554","m556","10.1107/S160053680500471X","","","0.71073","MoKα","","0.0369","0.0343","","","0.091","0.0924","","","","","","1.069","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205274","8.824","0.002","8.824","0.002","27.733","0.01","90","","90","","90","","2159.4","1","293","2","293","2","","","","","","","","3","P 43","P 4cw","78","avicennin B","3,4-Dihydro-8-hydroxy-3,5-dimethyl-7-methoxyisocoumarin","","- C12 H14 O4 -","- C12 H14 O4 -","- C96 H112 O32 -","8","2","HG6126","Jun, Wang; Hua-Rong Huang; Xiao-Long Feng; Yong-Cheng Lin; Shi-Ning Zhou","3,4-Dihydro-8-hydroxy-3,5-dimethyl-7-methoxyisocoumarin (avicennin B)","Acta Crystallographica Section E","2005","61","3","o784","o785","10.1107/S1600536805002771","","","0.71073","MoKα","","0.0487","0.0381","","","0.1038","0.1107","","","","","","1.067","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205275","14.1367","0.0012","7.9021","0.0008","16.8034","0.0016","90","","104.907","0.003","90","","1813.9","0.3","180","2","180","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","N,N-bis(2-pyridiniomethyl)glycine diperchlorate","","- C14 H17 Cl2 N3 O10 -","- C14 H17 Cl2 N3 O10 -","- C56 H68 Cl8 N12 O40 -","4","1","HG6129","Nielsen, Anne; Bond, Andrew D.; McKenzie, Christine J.","<i>N,N</i>-Bis(2-pyridiniomethyl)glycine diperchlorate","Acta Crystallographica Section E","2005","61","3","o516","o517","10.1107/S1600536805002503","","","0.71073","MoKα","","0.0854","0.0531","","","0.1267","0.143","","","","","","1.067","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205276","7.836","0.001","8.228","0.001","14.046","0.002","90","","94.106","0.002","90","","903.3","0.2","158","2","158","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-bromo-2-chloroindan-1-one","","- C9 H6 Br Cl O -","- C9 H6 Br Cl O -","- C36 H24 Br4 Cl4 O4 -","4","1","HG6134","Yu, Pen-Shao; Thomas, Gareth D.; Blackman, Allan G.; Tan, Eng Wui","<i>trans</i>-3-Bromo-2-chloroindan-1-one","Acta Crystallographica Section E","2005","61","3","o651","o652","10.1107/S1600536805004150","","","0.71069","MoKα","","0.0378","0.0349","","","0.0918","0.0937","","","","","","1.132","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205277","11.1168","0.0003","14.2464","0.0003","11.8709","0.0003","90","","92.113","0.001","90","","1878.77","0.08","293","2","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H26 N3 O -","- C22 H26 N3 O -","- C88 H104 N12 O4 -","4","2","HG6137","Qing Yuan; Shan-Zhong Jian; Yan-Guang Wang","4-(9-Acridin-9-ylamino)-2,2,6,6-tetramethylpiperidine <i>N</i>-oxide","Acta Crystallographica Section E","2005","61","3","o565","o566","10.1107/S1600536805003375","","","0.71073","MoKα","","","0.0443","","","","0.1197","","","","","","1.008","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205278","13.119","0.002","13.314","0.002","14.918","0.003","98.917","0.004","90.842","0.004","110.201","0.004","2409.3","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","ttt-(PPh3)2Cl2(CNbz)2Ru(II)","trans-trans-trans-(Dibenzylisocyanide-κC)dichlorobis(triphenylphosphine- κP)ruthenium(II) dichloromethane hemisolvate","","- C53 H46 Cl4 N2 P2 Ru -","- C53 H46 Cl4 N2 P2 Ru -","- C106 H92 Cl8 N4 P4 Ru2 -","2","1","HG6141","Look, Jennifer L.; Horwood, Owen P. M.; Levendis, Demetrius C.; Coville, Neil J.","<i>trans</i>-<i>trans</i>-<i>trans</i>-Bis(benzyl isocyanide-κ<i>C</i>)dichlorobis(triphenylphosphine-κ<i>P</i>)ruthenium(II) dichloromethane solvate","Acta Crystallographica Section E","2005","61","3","m606","m608","10.1107/S1600536805005052","","","0.71073","MoKα","","0.1004","0.0502","","","0.1121","0.1318","","","","","","1.005","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205279","11.398","0.004","18.283","0.006","11.659","0.004","90","","115.69","0.005","90","","2189.5","1.3","190","2","190","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[lithium(I)-μ-1-tert-butyl-3-(3-pyridyl)-N,N'-bis(trimethylsilyl) propane-1,3-diiminato]","","- C18 H32 Li N3 Si2 -","- C18 H32 Li N3 Si2 -","- C72 H128 Li4 N12 Si8 -","4","1","HG6142","Xia Chen; Li Wang; Jian-Ping Guo; Shu-Ping Huang; Dian-Sheng Liu","<i>catena</i>-Poly[lithium(I)-μ-1-<i>tert</i>-butyl-3-(3-pyridyl)-<i>N</i>,<i>N</i>'-bis(trimethylsilyl)propane-1,3-diiminato]","Acta Crystallographica Section E","2005","61","3","m574","m576","10.1107/S1600536805005210","","","0.71073","MoKα","","0.118","0.0545","","","0.0593","0.0654","","","","","","0.838","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205280","10.05","0.003","16.492","0.005","10.737","0.005","90","","101.94","0.02","90","","1741.1","1.1","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl 2-methyl-5-oxo-4-(2-thienyl)-1,5,7,8,9,10-hexahydro-4H- pyrido[2',3':3,4]pyrrolo[1,2-a][1,3]diazepine-3-carboxylate","","- C18 H19 N3 O3 S -","- C18 H19 N3 O3 S -","- C72 H76 N12 O12 S4 -","4","1","HG6144","Vrábel, Viktor; Kožíšek, Jozef; Marchalín, Štefan; Svoboda, Ingrid","Methyl 2-methyl-5-oxo-4-(2-thienyl)-1,5,7,8,9,10-hexahydro-4<i>H</i>-pyrido[2',3':3,4]pyrrolo[1,2-<i>a</i>][1,3]diazepine-3-carboxylate","Acta Crystallographica Section E","2005","61","3","o733","o735","10.1107/S1600536805005209","","","0.71069","MoKα","","0.0849","0.058","","","0.167","0.1905","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205281","5.3155","0.0014","8.108","0.002","11.737","0.003","90","","90.196","0.01","90","","505.8","0.2","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","meso-1,2-bis(pyridin-2-yl)-ethane-1,2-diol","","- C12 H12 N2 O2 -","- C12 H12 N2 O2 -","- C24 H24 N4 O4 -","2","0.5","HG6145","Bjernemose, Jens K.; Bond, Andrew D.","<i>meso</i>-1,2-Bis(pyridin-2-yl)ethane-1,2-diol","Acta Crystallographica Section E","2005","61","3","o741","o742","10.1107/S1600536805005222","","","0.71073","MoKα","","0.0724","0.0588","","","0.1381","0.1473","","","","","","1.108","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205282","7.321","0.002","8.234","0.002","8.354","0.002","62.05","0.03","65.34","0.03","74.04","0.03","402.3","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","3-Ammonio-4-methoxybenzenesulfonate","","- C7 H9 N O4 S -","- C7 H9 N O4 S -","- C14 H18 N2 O8 S2 -","2","1","IS6043","Gao, Shan; Huo, Li-Hua; Ng, Seik Weng","3-Ammonio-4-methoxybenzenesulfonate","Acta Crystallographica Section E","2005","61","3","o539","o540","10.1107/S160053680500293X","","","0.71073","MoKα","","0.03","0.028","","","0.083","0.084","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205283","20.792","0.003","8.247","0.001","15.097","0.002","90","","111.778","0.002","90","","2403.9","0.6","295","2","295","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","3-[(4-Hydroxy-3-methoxyphenyl)methylene]-2,4-pentanedione","","- C13 H14 O4 -","- C13 H14 O4 -","- C104 H112 O32 -","8","1","IS6044","Pei, Li-Xia; Bu, Xian-Zhang; Gu, Lian-Quan; Ng, Seik Weng","3-[(4-Hydroxy-3-methoxyphenyl)methylene]-2,4-pentanedione","Acta Crystallographica Section E","2005","61","3","o541","o543","10.1107/S1600536805002941","","","0.71073","MoKα","","0.052","0.041","","","0.126","0.137","","","","","","1.01","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205284","25.342","0.005","44.671","0.005","5.7889","0.0009","90","","90","","90","","6553.3","1.8","293","2","293","2","","","","","","","","4","F d d 2","F 2 -2d","43","","tetrakis[(4-bromobenzyloxy)methyl]methane","","- C33 H32 Br4 O4 -","- C33 H32 Br4 O4 -","- C264 H256 Br32 O32 -","8","0.5","IS6045","Laliberté, Dominic; Raymond, Nathalie; Maris, Thierry; Wuest, James D.","Pentaerythrityl tetrakis(4-bromobenzyl ether)","Acta Crystallographica Section E","2005","61","3","o601","o603","10.1107/S160053680500351X","","","1.54178","CuKα","","0.0569","0.0547","","","0.1631","0.1653","","","","","","1.078","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205285","8.9105","0.0007","9.0601","0.0007","10.5488","0.0008","66.158","0.001","68.752","0.001","88.391","0.001","718.94","0.1","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[tetrapyridinecopper(II)]-μ~2~-naphthalene-1,5-disulfonato]","","- C30 H26 Cu N4 O6 S2 -","- C30 H26 Cu N4 O6 S2 -","- C30 H26 Cu N4 O6 S2 -","1","0.5","IS6047","Gao, Shan; Huo, Li-Hua; Zhu, Zhi-Bao; Ng, Seik Weng","<i>catena</i>-Poly[[tetrapyridinecopper(II)]-μ~2~-naphthalene-1,5-disulfonato]","Acta Crystallographica Section E","2005","61","3","m476","m477","10.1107/S1600536805003156","","","0.71073","MoKα","","0.055","0.047","","","0.128","0.133","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205286","12.2223","0.0018","15.017","0.002","11.3182","0.0016","90","","92.026","0.003","90","","2076.1","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[(2,2'-bipyridine)nickel(II)]-μ-4,4'-oxydibenzoato]","","- C24 H16 N2 Ni O5 -","- C24 H16 N2 Ni O5 -","- C96 H64 N8 Ni4 O20 -","4","1","IS6048","Hong-Ping Xiao; Ya-Qian Cheng; Xin-Hua Li","<i>catena</i>-Poly[[(2,2'-bipyridine)nickel(II)]-μ-4,4'-oxydibenzoato]","Acta Crystallographica Section E","2005","61","3","m469","m470","10.1107/S1600536805003405","","","0.71073","MoKα","","0.061","0.0463","","","0.0921","0.0976","","","","","","1.062","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205287","12.3571","0.0011","12.6397","0.0012","15.3369","0.0012","67.286","0.003","89.668","0.003","75.133","0.002","2124","0.3","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Tris(phenanthroline-κ^2^N,N')nickel(II) dibromosuccinate pentahydrate","","- C40 H40 Br2 N6 Ni O11 -","- C40 H40 Br2 N6 Ni O11 -","- C80 H80 Br4 N12 Ni2 O22 -","2","1","IS6049","Dai-Xi Li; Duan-Jun Xu; Yuan-Zhi Xu","Tris(phenanthroline-κ^2^<i>N,N</i>')nickel(II) dibromosuccinate heptahydrate","Acta Crystallographica Section E","2005","61","3","m471","m473","10.1107/S1600536805003399","","","0.71073","MoKα","","0.079","0.052","","","0.12","0.133","","","","","","1.012","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205288","8.1208","0.0017","11.307","0.004","13.022","0.003","83.58","0.02","82.954","0.019","79.53","0.02","1162","0.6","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Azido(2,2'-bipyridine)(η^5^-pentamethylcyclopentadienyl)iridium(III) hexafluorophosphate","","- C20 H23 F6 Ir N5 P -","- C20 H23 F6 Ir N5 P -","- C40 H46 F12 Ir2 N10 P2 -","2","1","IS6050","Suzuki, Takayoshi","Azido(2,2'-bipyridine)(η^5^-pentamethylcyclopentadienyl)iridium(III) hexafluorophosphate","Acta Crystallographica Section E","2005","61","3","m488","m490","10.1107/S1600536805003727","","","0.71069","MoKα","","0.0674","0.0493","","","0.1263","0.1381","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205289","10.0156","0.0002","12.0767","0.0002","20.6483","0.0005","90","","90","","90","","2497.52","0.09","260","2","260","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","3,5-dinitrobenzoic acid DMSO solvate","3,5-dinitrobenzoic acid‒dimethyl sulfoxide (1/1)","","- C9 H10 N2 O7 S -","- C9 H10 N2 O7 S -","- C72 H80 N16 O56 S8 -","8","1","JH6000","Abthorpe, M.; Trask, A. V.; Jones, W.","3,5-Dinitrobenzoic acid‒dimethyl sulfoxide (1/1)","Acta Crystallographica Section E","2005","61","3","o609","o611","10.1107/S1600536805003818","","","0.71073","MoKα","","0.0666","0.0454","","","0.1201","0.134","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205290","12.6986","0.0008","12.5724","0.0006","18.9151","0.001","90","","95.635","0.004","90","","3005.2","0.3","150","","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","4-Chloro-3-(2,3,5-trimethylphenoxy)phthalonitrile","","- C17 H13 Cl N2 O -","- C17 H13 Cl N2 O -","- C136 H104 Cl8 N16 O8 -","8","2","KP6035","Yazıcı, Serap; Akdemir, Nesuhi; Ağar, Erbil; Kantar, Cihan; Şenel, İsmet","4-Chloro-3-(2,3,5-trimethylphenoxy)phthalonitrile","Acta Crystallographica Section E","2005","61","3","o782","o783","10.1107/S1600536805003193","","","0.71073","MoKα","","0.053","0.0416","","","0.1128","0.1163","","","","","","1.051","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205291","11.784","0.002","14.838","0.003","29.143","0.006","90","","93.26","0.03","90","","5087.4","1.7","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Heptaammonium disodium decatungstolanthanate hexadecahydrate","","- H60 La N7 Na2 O52 W10 -","- La N7 Na2 O52 W10 -","- La4 N28 Na8 O208 W40 -","4","0.5","KP6036","Almeida Paz, Filipe A.; Balula, Maria Salete S.; Cavaleiro, Ana M. V.; Klinowski, Jacek; Nogueira, Helena I. S.","A lanthanum(III) complex with a lacunary polyoxotungstate: Na~2~(NH~4~)~7~[La(W~5~O~18~)~2~]·16H~2~O","Acta Crystallographica Section E","2005","61","3","i28","i31","10.1107/S1600536805003557","","","0.71073","MoKα","","0.0367","0.031","","","0.0781","0.0812","","","","","","1.084","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205292","9.0002","0.0005","15.0542","0.0007","27.4541","0.0014","90","","90","","90","","3719.8","0.3","105","2","105","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","L-Asparaginyl-L-valine","","- C9 H19.67 N3 O5.33 -","- C9 H19.6667 N3 O5.33333 -","- C108 H236 N36 O64 -","12","3","KP6037","Hanne Therese Bonge; Marianne Lenes Rosenberg; Marit Riktor; Görbitz, Carl Henrik","<small>L</small>-Asparaginyl-<small>L</small>-valine 1.33-hydrate","Acta Crystallographica Section E","2005","61","3","o524","o527","10.1107/S1600536805001868","","","0.71073","MoKα","","0.0406","0.0317","","","0.0816","0.0862","","","","","","1.052","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205293","9.537","0.001","9.95","0.001","11.363","0.001","94.156","0.002","107.839","0.002","113.535","0.002","917.31","0.16","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Poly[[[(2,2'-bipyridine)copper(II)]-hemi(μ~2~-2-nitroterephthalato)hemi(μ~4~- 2-nitroterephthalato)] monohydrate]","","- C18 H13 Cu N3 O7 -","- C18 H13 Cu N3 O7 -","- C36 H26 Cu2 N6 O14 -","2","1","KP6038","Ma, Ai-Qing; Zhu, Long-Guan; Ng, Seik Weng","Poly[[[(2,2'-bipyridine)copper(II)]-hemi-μ~2~-2-nitroterephthalato-hemi-μ~4~-2-nitroterephthalato] monohydrate]","Acta Crystallographica Section E","2005","61","3","m483","m484","10.1107/S1600536805003466","","","0.71073","MoKα","","0.0802","0.0518","","","0.0995","0.1083","","","","","","0.905","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205294","9.2495","0.0009","10.0013","0.001","17.2359","0.0016","90","","90","","90","","1594.4","0.3","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Methyl 4-O-benzyl-6-deoxy-2,3-O-isopropylidene-α-L-talopyranoside","","- C17 H24 O5 -","- C17 H24 O5 -","- C68 H96 O20 -","4","1","KP6039","Maust, Mathew T.; Norris, Peter; Zeller, Matthias","Methyl 4-<i>O</i>-benzyl-6-deoxy-2,3-<i>O</i>-isopropylidene-α-<small>L</small>-talopyranoside","Acta Crystallographica Section E","2005","61","3","o643","o644","10.1107/S1600536805003600","","","0.71073","MoKα","","0.0398","0.039","","","0.0979","0.0987","","","","","","1.15","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205295","6.808","0.002","18.77","0.009","8.256","0.003","90","","105.84","0.03","90","","1014.9","0.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5,6,7,8-tetrahydro-4aH-thieno[3,2-b]quinolizin-4(10H)-one","","- C11 H13 N O S -","- C11 H13 N O S -","- C44 H52 N4 O4 S4 -","4","1","KP6040","Vrábel, Viktor; Kožíšek, Jozef; Marchalín, Štefan; Žák, Zdirad","5,6,7,8-Tetrahydro-4a<i>H</i>-thieno[3,2-<i>b</i>]quinolizin-4(10<i>H</i>)-one","Acta Crystallographica Section E","2005","61","3","o573","o574","10.1107/S1600536805003454","","","0.71073","MoKα","","0.0524","0.0374","","","0.1026","0.1137","","","","","","1.012","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205296","10.259","0.002","8.775","0.002","21.813","0.004","90","","101.93","0.03","90","","1921.3","0.7","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","poly[[triaquabarium(II)]-di-μ~3~-3-carboxybenzenesulfonato]","","- C14 H16 Ba O13 S2 -","- C14 H16 Ba O13 S2 -","- C56 H64 Ba4 O52 S8 -","4","1","KP6042","Gao, Shan; Zhu, Zhi-Biao; Huo, Li-Hua; Ng, Seik Weng","Polymeric triaquabis(μ~3~-3-carboxybenzenesulfonato)barium(II)","Acta Crystallographica Section E","2005","61","3","m517","m518","10.1107/S1600536805004265","","","0.71073","MoKα","","0.019","0.017","","","0.046","0.046","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205297","22.274","0.004","5.715","0.001","10.443","0.002","90","","92.56","0.03","90","","1328","0.4","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","poly[[diaquabarium(II)]-μ~6~-1,5-naphthalenedisulfonato]","","- C10 H10 Ba O8 S2 -","- C10 H10 Ba O8 S2 -","- C40 H40 Ba4 O32 S8 -","4","0.5","KP6043","Gao, Shan; Zhu, Zhi-Biao; Huo, Li-Hua; Ng, Seik Weng","Polymeric diaqua(μ~6~-1,5-naphthalenedisulfonato)barium(II)","Acta Crystallographica Section E","2005","61","3","m528","m530","10.1107/S1600536805004514","","","0.71073","MoKα","","0.027","0.027","","","0.065","0.065","","","","","","1.12","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205298","6.5692","0.0014","12.365","0.003","13.878","0.003","67.312","0.004","80.447","0.004","86.74","0.004","1025.6","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]- 5-[(4-dimethylaminobenzylidene)amino]-1H-pyrazole-3-carbonitrile","","- C20 H14 Cl2 F3 N5 -","- C20 H14 Cl2 F3 N5 -","- C40 H28 Cl4 F6 N10 -","2","1","KP6044","Chen, Dimei; Yang, Zhiping; Zhong, Ping; Hu, Maolin","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(4-dimethylaminobenzylidene)amino]-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","3","o702","o703","10.1107/S1600536805004654","","","0.71073","MoKα","","0.0774","0.0659","","","0.176","0.1858","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205299","8.5222","0.0008","10.6245","0.0007","12.3742","0.0012","90","","93.697","0.011","90","","1118.08","0.17","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","tris(1,2-dimethoxyethane-κ^2^O,O')diiodostrontium(II)","","- C12 H30 I2 O6 Sr -","- C12 H30 I2 O6 Sr -","- C24 H60 I4 O12 Sr2 -","2","1","LH6326","Weber, Frank; Wolmershäuser, Gotthelf; Sitzmann, Helmut","The tris(dimethoxyethane) adduct of strontium iodide","Acta Crystallographica Section E","2005","61","3","m512","m513","10.1107/S1600536804031617","","","0.71073","MoKα","","0.0436","0.0374","","","0.0888","0.0917","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205300","8.901","0.001","10.506","0.0012","14.5942","0.0015","92.522","0.009","104.923","0.008","106.33","0.008","1255.5","0.3","296","","296","","","","","","","","","4","P -1","-P 1","2","","5-(4-Methoxybenzoyl)-4-(4-methoxyphenyl)-1-[1-(4- methoxyphenyl)ethylideneamino]pyrimidin-2(1H)-one","","- C28 H25 N3 O5 -","- C28 H25 N3 O5 -","- C56 H50 N6 O10 -","2","1","LH6345","Özçelik, Suzan; Dinçer, Muharrem; Sarıpınar, Emin; Yılmaz, Çiğdem","5-(4-Methoxybenzoyl)-4-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)ethylideneamino]pyrimidin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2005","61","3","o622","o624","10.1107/S1600536805003703","","","0.71073","MoKα","","0.0851","0.0405","","","0.0798","0.0889","","","","","","1.005","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205301","16.097","0.002","3.7144","0.0005","21.725","0.002","90","","110.758","0.007","90","","1214.6","0.3","93.2","","","","","","","","","","","4","P 1 2/a 1","-P 2ya","13","","","","- C16 H10 N4 O2 -","- C16 H10 N4 O2 -","- C64 H40 N16 O8 -","4","1","LH6350","Imoda, Tomohiko; Hirota, Tsuyoshi; Takahashi, Hiroo; Mizuguchi, Jin","3,6-Di-2-pyridylpyrrolo[3,4-<i>c</i>]pyrrole-1,4(2<i>H</i>,5<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","3","o616","o618","10.1107/S1600536805002126","","","1.5418","CuKα","","","0.0913","","","","0.3457","","","","","","1.905","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205302","28.723","0.015","7.269","0.005","26.824","0.009","90","","123.61","0.03","90","","4664","5","225","2","225","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Tetrakis(4-carboxyphenyl)methane‒dimethyl sulfoxide‒toluene (1/4/1)","4,4',4'',4'''-methanetetrayltetracarboxylic acid‒dimethyl sulfoxide‒toluene (1/4/1)","","- C44 H52 O12 S4 -","- C44 H52 O12 S4 -","- C176 H208 O48 S16 -","4","0.5","LH6355","Nadia Malek; Thierry Maris; Michel Simard; James D. Wuest","Tetrakis(4-carboxyphenyl)methane‒dimethyl sulfoxide‒toluene (1/4/1)","Acta Crystallographica Section E","2005","61","3","o518","o520","10.1107/S1600536805002485","","","1.54178","CuKα","","0.079","0.0657","","","0.182","0.1903","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205303","8.111","0.003","12.999","0.007","16.256","0.005","90","","100.76","0.03","90","","1683.8","1.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(1RS,2SR,7RS,8RS)-N-Benzoyltricyclo[6.2.2.0^2,7^]dodeca-9,11-diene-1,10- dicarboximide","","- C21 H19 N O3 -","- C21 H19 N O3 -","- C84 H76 N4 O12 -","4","1","LH6356","McSweeney, Nigel; Pratt, Albert C.; Long, Conor; Howie, R. Alan","(1<i>RS</i>,2<i>S</i><i>R</i>,7<i>RS</i>,8<i>RS</i>)-<i>N</i>-Benzoyltricyclo[6.2.2.0^2,7^]dodeca-9,11-diene-1,10-dicarboximide","Acta Crystallographica Section E","2005","61","3","o547","o549","10.1107/S1600536805002758","","","0.71073","MoKα","","0.1699","0.0876","","","0.1637","0.1922","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205304","18.725","0.004","19.623","0.004","15.647","0.003","90","","113.82","0.01","90","","5259.6","1.9","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Aqua{2-[(E)-(3,5-dibromo-2-oxidophenyl)methyleneamino]ethanesulfonato- κ^3^O,N,O'}(1,10-phenanthroline-κ^2^N,N')nickel(II) ethanol solvate","","- C23 H23 Br2 N3 Ni O6 S -","- C23 H23 Br2 N3 Ni O6 S -","- C184 H184 Br16 N24 Ni8 O48 S8 -","8","1","LH6357","Shu-Hua Zhang; Yi-Min Jiang; L. Zheng; Kai-Bei Yu","Aqua{2-[(<i>E</i>)-(3,5-dibromo-2-oxidophenyl)methyleneamino]ethanesulfonato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>'}(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')nickel(II) ethanol solvate","Acta Crystallographica Section E","2005","61","3","m446","m448","10.1107/S1600536805003119","","","0.71073","MoKα","","0.114","0.0442","","","0.0838","0.0933","","","","","","0.801","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205305","8.453","0.0015","8.656","0.0012","10.7923","0.0012","105.221","0.01","98.919","0.012","116.4","0.013","647.9","0.2","295","2","295","2","","","","","","","","4","P -1","-P 1","2","(3-Mesyl-4-methoxyphenyl)glyoxylic acid methyl ester","Methyl [4-methoxy-3-(methylsulfonyloxy)benzoyl]formate","","- C11 H12 O7 S -","- C11 H12 O7 S -","- C22 H24 O14 S2 -","2","1","LH6359","Schollmeyer, Dieter; Christian Peifer; Gerd Dannhardt","Methyl [4-methoxy-3-(methylsulfonyloxy)benzoyl]formate","Acta Crystallographica Section E","2005","61","3","o583","o584","10.1107/S1600536805003478","","","1.54178","CuKα","","0.0461","0.0442","","","0.1226","0.1244","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205306","14.0827","0.0017","17.674","0.003","7.2238","0.0004","90","","90","","90","","1798","0.4","295","2","295","2","","","","","","","","4","P n a 21","P 2c -2n","33","","4-(3-hydroxy-4-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)-2,5-dihydro- 1H-pyrrole-2,5-dione","","- C20 H19 N O7 -","- C20 H19 N O7 -","- C80 H76 N4 O28 -","4","1","LH6360","Schollmeyer, Dieter; Christian Peifer; Gerd Dannhardt","4-(3-Hydroxy-4-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)-2,5-dihydro-1<i>H</i>-pyrrole-2,5-dione","Acta Crystallographica Section E","2005","61","3","o604","o606","10.1107/S1600536805003685","","","1.54178","CuKα","","0.0624","0.0513","","","0.1352","0.1452","","","","","","1.073","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205307","18.8196","0.0007","18.4938","0.0008","13.5023","0.0006","90","","90","","90","","4699.4","0.3","180","2","180","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","Acetato(methanol)[N-phenyl-N,N-bis(2-pyridylmethyl)amine]copper(II) hexafluorophosphate","","- C21 H24 Cu F6 N3 O3 P -","- C21 H24 Cu F6 N3 O3 P -","- C168 H192 Cu8 F48 N24 O24 P8 -","8","1","LH6362","Nielsen, Anne; Bond, Andrew D.; McKenzie, Christine J.","Acetato(methanol)[<i>N</i>-phenyl-<i>N,N</i>-bis(2-pyridylmethyl)amine]copper(II) hexafluorophosphate","Acta Crystallographica Section E","2005","61","3","m478","m480","10.1107/S160053680500348X","","","0.71073","MoKα","","0.0565","0.04","","","0.1132","0.1196","","","","","","1.047","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205308","7.259","0.0006","25.872","0.003","7.425","0.0015","90","","90","","90","","1394.5","0.3","298","2","298","2","","","","","","","","4","P n m a","-P 2ac 2n","62","Terpyridine Dioxide Dihydrate","2,2':6',2''-Terpyridine 1,1''-dioxide dihydrate","","- C15 H15 N3 O4 -","- C15 H15 N3 O4 -","- C60 H60 N12 O16 -","4","0.5","LH6363","Wheeler, Kraig A.; McKay, Scott E.; Lashlee III, Robert W.","2,2':6',2''-Terpyridine 1,1''-dioxide dihydrate","Acta Crystallographica Section E","2005","61","3","o645","o647","10.1107/S1600536805003855","","","0.71073","MoKα","","0.0856","0.052","","","0.1335","0.1559","","","","","","1.058","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205309","14.059","0.003","16.336","0.002","7.356","0.003","90","","90","","90","","1689.4","0.8","295","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Methyl (2,3,4-tetra-O-acetyl-β-D-glucopyranosyl azide)uronate","Methyl 2,3,4-tetra-O-acetyl-1-azido-1-deoxy-β-D-glucopyranuronate","","- C13 H17 N3 O9 -","- C13 H17 N3 O9 -","- C52 H68 N12 O36 -","4","1","LH6365","Brendon L. Wilkinson; Laurent F. Bornaghi; Todd A. Houston; Sally-Ann Poulsen; Peter C. Healy","Methyl 2,3,4-tri-<i>O</i>-acetyl-1-azido-1-deoxy-β-<small>D</small>-glucopyranuronate at room temperature","Acta Crystallographica Section E","2005","61","3","o738","o740","10.1107/S1600536805004381","","","0.7107","MoKα","","0.1009","0.0405","","","0.1021","0.1239","","","","","","1.012","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205310","11.6984","0.0002","13.0662","0.0002","13.941","0.0003","111.507","0.0009","90.647","0.0009","115.49","0.0009","1752.94","0.06","160","1","160","1","","","","","","","","6","P -1","-P 1","2","","Chloro{μ-2-[(E)-1-(2-oxido-3- methylphenyl)ethylideneamino]acetato}pentaphenylditin(IV)","","- C41 H36 Cl N O3 Sn2 -","- C41 H36 Cl N O3 Sn2 -","- C82 H72 Cl2 N2 O6 Sn4 -","2","1","LH6366","Linden, Anthony; Basu Baul, Tushar S.; Masharing, Cheerfulman","Chloro{μ-2-[(<i>E</i>)-1-(2-oxido-3-methylphenyl)ethylideneamino]acetato}pentaphenylditin(IV)","Acta Crystallographica Section E","2005","61","3","m557","m559","10.1107/S1600536805004666","","","0.71073","MoKα","","0.062","0.0445","","","0.1074","0.1132","","","","","","1.199","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205311","16.4538","0.0019","5.3346","0.0005","17.952","0.002","90","","114.709","0.009","90","","1431.5","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-[2-(5-Ethylpyridin-2-yl)ethoxy]benzaldehyde oxime","","- C16 H18 N2 O2 -","- C16 H18 N2 O2 -","- C64 H72 N8 O8 -","4","1","LH6368","Gaonkar, Santhosh L.; Yathirajan, Hemmige S.; Lokanatharai, Kuriya M.; Nagaraj, Basavegowda; Bolte, Michael","4-[2-(5-Ethylpyridin-2-yl)ethoxy]benzaldehyde oxime","Acta Crystallographica Section E","2005","61","3","o751","o752","10.1107/S1600536805005192","","","0.71073","MoKα","","0.0651","0.0491","","","0.1203","0.1287","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205312","18.0117","0.0005","20.208","0.0006","12.8156","0.0005","90","","90","","90","","4664.6","0.3","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Bis(1,1,1,5,5,5-hexafluoroacetylacetonato-κ^2^O,O')bis(tetrahydrofuran- κN)iron(II)","","- C18 H18 F12 Fe O6 -","- C18 H18 F12 Fe O6 -","- C144 H144 F96 Fe8 O48 -","8","2","LH6396","Preuss, Kathryn E.; Wu, Jian; Jennings, Michael, C.","Bis(1,1,1,5,5,5-hexafluoroacetylacetonato-κ^2^<i>O,O</i>')bis(tetrahydrofuran-κ<i>N</i>)iron(II)","Acta Crystallographica Section E","2005","61","3","m430","m432","10.1107/S1600536805002734","","","0.71073","MoKα","","0.0656","0.0435","","","0.1014","0.1125","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205313","8.6677","0.001","18.5082","0.0018","8.9746","0.001","90","","111.95","0.009","90","","1335.4","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-(2-Bromo-4,5-dimethoxybenzyl)thiazolidine-2,4-dione","","- C12 H12 Br N O4 S -","- C12 H12 Br N O4 S -","- C48 H48 Br4 N4 O16 S4 -","4","1","NC6020","Yathirajan, Hemmige S.; Gaonkar, Santhosh L.; Lokanatha Rai, Kuriya M.; Bolte, Michael","3-(2-Bromo-4,5-dimethoxybenzyl)thiazolidine-2,4-dione","Acta Crystallographica Section E","2005","61","3","o655","o656","10.1107/S1600536805004137","","","0.71073","MoKα","","0.037","0.0319","","","0.0759","0.0776","","","","","","1.158","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205314","10.4244","0.001","15.9819","0.0016","6.0919","0.0007","90","","90","","90","","1014.92","0.18","173","2","173","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Di-tert-butylphosphine oxide","","- C8 H19 O P -","- C8 H19 O P -","- C32 H76 O4 P4 -","4","0.5","NC6021","Dornhaus, Franz; Lerner, Hans-Wolfram; Bolte, Michael","Di-<i>tert</i>-butylphosphine oxide","Acta Crystallographica Section E","2005","61","3","o657","o658","10.1107/S1600536805004332","","","0.71073","MoKα","","0.0429","0.0386","","","0.1102","0.114","","","","","","1.064","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205315","7.6974","0.0006","7.8682","0.0006","19.1907","0.0016","79.823","0.006","84.248","0.007","64.22","0.006","1029.77","0.15","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","4'-[2-Butyl-4-chloro-5-(hydroxyiminomethyl)-1H-imidazol-3-ylmethyl]biphenyl- 2-carbonitrile","","- C22 H21 Cl N4 O -","- C22 H21 Cl N4 O -","- C44 H42 Cl2 N8 O2 -","2","1","NC6022","Yathirajan, Hemmige S.; Nagaraj, Basavegowda; Narasegowda, Rajenahally S.; Bolte, Michael","4'-[2-Butyl-4-chloro-5-(hydroxyiminomethyl)-1<i>H</i>-imidazol-3-ylmethyl]biphenyl-2-carbonitrile","Acta Crystallographica Section E","2005","61","3","o714","o715","10.1107/S1600536805004988","","","0.71073","MoKα","","0.047","0.0429","","","0.1024","0.1052","","","","","","1.118","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205316","7.2545","0.001","7.2018","0.0009","7.7886","0.0013","90","","97.819","0.012","90","","403.14","0.1","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","Nipecotic acid hydrochloride","3-carboxypiperidinium chloride","","- C6 H12 Cl N O2 -","- C6 H12 Cl N O2 -","- C12 H24 Cl2 N2 O4 -","2","1","NC6023","Narasegowda, Rajenahally S.; Yathirajan, Hemmige S.; Bolte, Michael","Nipecotic acid hydrochloride","Acta Crystallographica Section E","2005","61","3","o763","o764","10.1107/S1600536805005337","","","0.71073","MoKα","","0.0225","0.0221","","","0.057","0.0573","","","","","","1.103","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205317","10.615","0.0006","14.914","0.0005","17.3961","0.0009","90","","102.263","0.004","90","","2691.2","0.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-[4'-(Bromomethyl)biphenyl-2-yl]-2-trityl-2H-tetrazole","","- C33 H25 Br N4 -","- C33 H25 Br N4 -","- C132 H100 Br4 N16 -","4","1","NC6024","Nagaraj, Basavegowda; Narasegowda, Rajenahally S.; Yathirajan, Hemmige S.; Gaonkar, Santhosh L.; Bolte, Michael","5-[4'-(Bromomethyl)biphenyl-2-yl]-2-trityl-2<i>H</i>-tetrazole","Acta Crystallographica Section E","2005","61","3","o767","o768","10.1107/S1600536805005490","","","0.71073","MoKα","","0.0543","0.0443","","","0.0979","0.1023","","","","","","1.091","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205318","9.2861","0.0011","9.5829","0.0012","18.438","0.003","90","","90.75","0.004","90","","1640.6","0.4","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Nitrato-κO)(1,10-phenanthroline-κ^2^N,N')(picolinato N-oxide- κ^2^O,O')copper(II)","","- C18 H12 Cu N4 O6 -","- C18 H12 Cu N4 O6 -","- C72 H48 Cu4 N16 O24 -","4","1","NG6094","Lei Gou; Xiong-Wei Qu; Bo Zheng; Dao-Yong Wang; Huai-Ming Hu","(Nitrato-κ<i>O</i>)(1,10-phenanthroline-κ^2^<i>N,N</i>')(picolinato <i>N</i>-oxide-κ^2^<i>O,O</i>')copper(II)","Acta Crystallographica Section E","2005","61","3","m441","m442","10.1107/S1600536805002515","","","0.71073","MoKα","","0.0499","0.0339","","","0.0756","0.0786","","","","","","0.91","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205319","13.237","0.003","6.6598","0.0013","9.6849","0.0019","90","","92.27","0.03","90","","853.1","0.3","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Hexaaquazinc(II) naphthalene-1,5-disulfonate'","","- C10 H18 O12 S2 Zn -","- C10 H18 O12 S2 Zn -","- C20 H36 O24 S4 Zn2 -","2","0.5","NG6100","Huo, Li-Hua; Gao, Shan; Xu, Shixiao; Zhao, Hui","Hexaaquazinc(II) naphthalene-1,5-disulfonate","Acta Crystallographica Section E","2005","61","3","m449","m450","10.1107/S1600536805003120","","","0.71073","MoKα","","0.0238","0.0222","","","0.0605","0.0615","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205320","10.58","0.003","11.356","0.003","11.492","0.003","116.06","0.02","100.32","0.02","104.936","0.014","1128.4","0.6","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[bis(1H-benzimidazole-κN^3^)zinc(II)]-μ-3-carboxyphenoxyacetato- κ^2^O:O']","","- C23 H18 N4 O5 Zn -","- C23 H18 N4 O5 Zn -","- C46 H36 N8 O10 Zn2 -","2","1","NG6101","Gao, Shan; Huo, Li-Hua; Liu, Ji-Wei; Gu, Chang-Sheng","<i>catena</i>-Poly[[bis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)zinc(II)]-μ-3-carboxyphenoxyacetato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","3","m494","m495","10.1107/S1600536805003661","","","0.71073","MoKα","","0.1082","0.0604","","","0.1321","0.1512","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205321","9.5043","0.0019","9.812","0.002","11.584","0.002","70.73","0.03","67.49","0.03","83.26","0.03","942","0.4","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[aqua(1,10-phenanthroline-κ^2^N,N')cobalt(II)]-μ-4- carboxyphenoxyacetato-κ^3^O,O':O'']","","- C21 H16 Co N2 O6 -","- C21 H16 Co N2 O6 -","- C42 H32 Co2 N4 O12 -","2","1","NG6102","Gao, Shan; Huo, Li-Hua; Gu, Chang-Sheng; Liu, Ji-Wei; Zhao, Jing-Gui","<i>catena</i>-Poly[[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II)]-μ-4-carboxyphenoxyacetato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>'']","Acta Crystallographica Section E","2005","61","3","m496","m498","10.1107/S1600536805003673","","","0.71073","MoKα","","0.0612","0.0514","","","0.1297","0.136","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205322","7.8331","0.0013","8.2205","0.0014","12.894","0.002","88.237","0.004","83.013","0.004","79.382","0.003","810","0.2","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","Bis(pyridinium) tetrabromocobaltate(II)","","- C10 H12 Br4 Co N2 -","- C10 H12 Br4 Co N2 -","- C20 H24 Br8 Co2 N4 -","2","1","NG6109","Zhang, Hui; Fang, Liang; Yuan, Runzhang","Bis(pyridinium) tetrabromocobaltate(II)","Acta Crystallographica Section E","2005","61","3","m609","m610","10.1107/S1600536805005714","","","0.71073","MoKα","","0.1284","0.0609","","","0.1218","0.1574","","","","","","0.993","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205323","9.9141","0.0002","43.1674","0.0008","15.7682","0.0003","90","","104.67","0.0005","90","","6528.3","0.2","473.2","","200","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C60.5 H57 Cl Ir4 Mo4 O16 S -","- C60.5 H57 Cl Ir4 Mo4 O16 S -","- C242 H228 Cl4 Ir16 Mo16 O64 S4 -","4","1","OB6455","Lucas, Nigel T.; Humphrey, Mark G.; Willis, Anthony C.","[μ~8~-η^4^-2,5-Bis(oct-1-ynyl)thiophene]bis[octacarbonylbis(η^5^-methylcyclopentadienyl)-<i>tetrahedro</i>-diiridiumdimolybdenum] dichloromethane hemisolvate","Acta Crystallographica Section E","2005","61","3","m463","m464","10.1107/S160053680500214X","","","0.7107","MoKα","","0.0378","0.0263","","0.0365","","0.0337","","","0.97","","","1","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205324","23.26","0.002","13.872","0.002","15.182","0.003","90","","93.79","0.04","90","","4888","1.3","298","2","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C44 H44 Mn2 N8 Ni O6 -","- C44 H40 Mn2 N8 Ni O6 -","- C176 H160 Mn8 N32 Ni4 O24 -","4","2","OB6463","Akitsu, Takashiro; Takeuchi, Yuiri; Einaga, Yasuaki","(<i>SP</i>-4-1)-Bis{aqua[(1<i>R</i>,2<i>R</i>)-<i>N</i>,<i>N</i>'-bis(salicylidene)cyclohexane-1,2-diamine-κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>']manganese(III)}-di-μ-cyano-κ^4^<i>N</i>:<i>C</i>-[dicyanonickel(II)]","Acta Crystallographica Section E","2005","61","3","m502","m505","10.1107/S160053680500379X","","","0.7107","MoKα","","","0.0913","","","","0.2896","","","","","","1.065","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205325","8.1127","0.0007","10.9405","0.0009","13.9263","0.0011","77.147","0.007","83.542","0.007","76.749","0.007","1170.54","0.17","296","","296","","","","","","","","","4","P -1","-P 1","2","","5-(4-Methoxybenzoyl)-4-(4-methoxyphenyl)1-[1-(4- methoxyphenyl)ethylidenenamino]pyrimidin-2(1H)-one","","- C27 H23 N3 O5 -","- C27 H23 N3 O5 -","- C54 H46 N6 O10 -","2","1","OB6471","Özçelik, Suzan; Dinçer, Muharrem; Sarıpınar, Emin; Yılmaz, Çiğdem","5-(4-Methoxybenzoyl)-4-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)ethylidenenamino]pyrimidin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2005","61","3","o637","o638","10.1107/S1600536805004149","","","0.71073","MoKα","","0.0843","0.051","","","0.1283","0.1431","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205326","32.394","0.004","21.167","0.003","13.013","0.0015","90","","93.467","0.002","90","","8906","2","288","2","288","2","","","","","","","","6","C 1 c 1","C -2yc","9","","Tris{trans-4-[p-(N,N-diethylamino)styryl]-N-methylpyridinium} dodecatungstophosphate","","- C54 H69 N6 O40 P W12 -","- C54 H69 N6 O40 P W12 -","- C216 H276 N24 O160 P4 W48 -","4","1","OB6472","Xuejie Tan; Sixiu Sun; Shu-Lian Liu; Jian-Ping Ma; Dian-Xiang Xing","Tris{<i>trans</i>-4-[<i>p</i>-(<i>N</i>,<i>N</i>-diethylamino)styryl]-<i>N</i>-methylpyridinium} dodecatungstophosphate","Acta Crystallographica Section E","2005","61","3","m437","m440","10.1107/S1600536805002928","","","0.71073","MoKα","","0.102","0.0779","","","0.194","0.2137","","","","","","1.066","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205327","8.711","0.002","18.005","0.003","12.5175","0.0018","90","","107.66","0.02","90","","1870.7","0.6","290","2","290","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-{3-[(E)-(3,4-Dimethoxyphenyl)ethenyl]-5,5-dimethylcyclohex-2- enylidene}malononitrile","","- C21 H22 N2 O2 -","- C21 H22 N2 O2 -","- C84 H88 N8 O8 -","4","1","OB6473","Tsonko Kolev; Denitsa Yancheva; Boris Shivachev; Rosica Petrova; Michael Spiteller","2-{3-[(<i>E</i>)-(3,4-Dimethoxyphenyl)ethenyl]-5,5-dimethylcyclohex-2-enylidene}malononitrile","Acta Crystallographica Section E","2005","61","3","o550","o552","10.1107/S1600536805003016","","","0.71073","MoKα","","0.1885","0.0579","","","0.0945","0.1242","","","","","","0.964","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205328","9.986","0.003","11.682","0.003","12.222","0.004","117.17","0.02","103.69","0.02","92.56","0.02","1213","0.7","93.2","","","","","","","","","","","3","P -1","-P 1","2","","1,4:8,11:15,18:22,25-Tetraethano-29H,31H-tetrabenzo[b,g,l,q]porphine toluene trisolvate","","- C65 H62 N4 -","- C65 H62 N4 -","- C65 H62 N4 -","1","0.5","OB6474","Aramaki, Shinji; Sakai, Yoshimasa; Yanagisawa, Hiroyuki; Mizuguchi, Jin","1,4:8,11:15,18:22,25-Tetraethano-29<i>H</i>,31<i>H</i>-tetrabenzo[<i>b</i>,<i>g</i>,<i>l</i>,<i>q</i>]porphine toluene trisolvate","Acta Crystallographica Section E","2005","61","3","o659","o661","10.1107/S1600536805004228","","","1.5418","CuKα","","","0.0734","","","","0.1974","","","","","","1.259","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205329","7.8042","0.0011","7.3159","0.0011","21.753","0.003","90","","90","","90","","1242","0.3","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","1,3-Bis(pyrimidin-2-ylsulfanyl)propan-2-one","","- C11 H10 N4 O S2 -","- C11 H10 N4 O S2 -","- C44 H40 N16 O4 S8 -","4","0.5","OB6475","Wu, Ben-Lai; Lou, Ben-Yong; Han, Lei; Hong, Mao-Chun","1,3-Bis(pyrimidin-2-ylsulfanyl)propan-2-one","Acta Crystallographica Section E","2005","61","3","o594","o595","10.1107/S1600536805003715","","","0.71073","MoKα","","0.0944","0.0615","","","0.0949","0.1062","","","","","","1.151","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2205330","4.903","0.006","29.26","0.04","13.96","0.02","90","","97.65","0.06","90","","1985","5","93.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C52 H40 N4 O6 -","- C52 H40 N4 O6 -","- C104 H80 N8 O12 -","2","0.5","OB6476","Hino, Kazuyuki; Mizuguchi, Jin","<i>N</i>,<i>N</i>'-Bis[2-(4-pyridyl)ethyl]perylene-3,4:9,10-bis(dicarboximide) <i>m</i>-cresol disolvate","Acta Crystallographica Section E","2005","61","3","o672","o674","10.1107/S1600536805004447","","","1.5419","CuKα","","","0.1003","","","","0.1183","","","","","","0.995","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205331","42.071","0.001","8.6042","0.0001","19.9088","0.0001","90","","96.096","0.002","90","","7165.98","0.19","296.2","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Chloro(4,7-diphenyl-1,10-phenanthroline)(2,2':6',2''-terpyridine)ruthenium(II) hexafluorophosphate","","- C39 H27 Cl F6 N5 P Ru -","- C39 H27 Cl F6 N5 P Ru -","- C312 H216 Cl8 F48 N40 P8 Ru8 -","8","1","OB6477","Naokazu Yoshikawa; Nobuko Kanehisa; Yasushi Kai; Hiroshi Takashima; Keiichi Tsukahara","Chloro(4,7-diphenyl-1,10-phenanthroline)(2,2':6',2''-terpyridine)ruthenium(II) hexafluorophosphate","Acta Crystallographica Section E","2005","61","3","m545","m547","10.1107/S1600536805004691","","","0.7107","MoKα","","","0.083","","","","0.2008","","","","","","1.738","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205332","6.6461","0.0005","14.2172","0.001","14.9057","0.001","90","","100.261","0.001","90","","1385.9","0.17","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-[(2-Chloro-5-phenyl-3-pyridinyl)(hydroxy)methyl]acrylonitrile","","- C15 H11 Cl N2 O -","- C15 H11 Cl N2 O -","- C60 H44 Cl4 N8 O4 -","4","1","OB6479","G. Y. S. K. Swamy; K. Ravikumar; P. Narender; V. Jayathirtha Rao","2-[(2-Chloro-5-phenyl-3-pyridinyl)(hydroxy)methyl]acrylonitrile","Acta Crystallographica Section E","2005","61","3","o706","o707","10.1107/S1600536805004551","","","0.71073","MoKα","","0.0454","0.0404","","","0.1144","0.1189","","","","","","1.056","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205333","12.5354","0.0007","12.6028","0.0007","14.312","0.0008","90","","90","","90","","2261","0.2","273","2","273","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","2-[(2-Chloro-5-ethyl-3-pyridinyl)(hydroxy)methyl]acrylonitrile","","- C11 H11 Cl N2 O -","- C11 H11 Cl N2 O -","- C88 H88 Cl8 N16 O8 -","8","1","OB6480","G. Y. S. K. Swamy; K. Ravikumar; P. Narender; V. Jayathirtha Rao","2-[(2-Chloro-5-ethyl-3-pyridinyl)(hydroxy)methyl]acrylonitrile","Acta Crystallographica Section E","2005","61","3","o708","o709","10.1107/S1600536805004563","","","0.71073","MoKα","","0.0464","0.0409","","","0.1219","0.1271","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205334","6.513","0.002","12.182","0.002","12.2","0.002","89.36","0.01","81.11","0.01","76.81","0.02","930.8","0.4","93.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C50 H36 N4 O6 -","- C50 H36 N4 O6 -","- C50 H36 N4 O6 -","1","0.5","OB6481","Mizuguchi, Jin; Hino, Kazuyuki","<i>N,N</i>'-Bis[2-(4-pyridyl)ethyl]perylene-3,4:9,10-bis(dicarboximide) phenol disolvate","Acta Crystallographica Section E","2005","61","3","o669","o671","10.1107/S1600536805004459","","","1.5418","CuKα","","","0.0389","","","","0.0984","","","","","","0.782","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205335","10.282","0.002","17.433","0.003","11.664","0.002","90","","106.51","0.01","90","","2004.5","0.6","93.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C46 H40 Cl6 N4 -","- C46 H40 Cl6 N4 -","- C92 H80 Cl12 N8 -","2","0.5","OB6482","Aramaki, Shinji; Sakai, Yoshimasa; Yanagisawa, Hiroyuki; Senju, Takatoshi; Mizuguchi, Jin","(1<i>RS</i>,4<i>S</i><i>R</i>,8<i>S</i><i>R</i>,11<i>RS</i>,15<i>S</i><i>R</i>,18<i>RS</i>,22<i>RS</i>,25<i>S</i><i>R</i>)-1,4:8,11:15,18:22,25-Tetraethano-29<i>H</i>,31<i>H</i>-tetrabenzo[<i>b,g,l,q</i>]porphine chloroform disolvate","Acta Crystallographica Section E","2005","61","3","o675","o677","10.1107/S1600536805004435","","","1.5418","CuKα","","","0.125","","","","0.311","","","","","","1.324","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205336","13.436","0.004","8.811","0.002","13.924","0.004","90","","102.03","0.004","90","","1612.2","0.8","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","mer-Bis(diethylenetriamine)zinc(II) dichloride monohydrate","","- C8 H28 Cl2 N6 O Zn -","- C8 H28 Cl2 N6 O Zn -","- C32 H112 Cl8 N24 O4 Zn4 -","4","1","OB6483","Liu, Bing; Huo, Fang-Jun; Jiang, Xiao-Ming; Yang, Bing-Sheng","<i>mer</i>-Bis(diethylenetriamine)zinc(II) dichloride monohydrate","Acta Crystallographica Section E","2005","61","3","m598","m600","10.1107/S160053680500560X","","","0.71073","MoKα","","0.0598","0.0412","","","0.0764","0.0812","","","","","","0.954","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205337","14.425","0.001","7.6138","0.0005","18.129","0.001","90","","111.776","0.001","90","","1849","0.2","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-Poly[[cis-diaqua(2,2'-bipyridine)cobalt(II)]-μ-3-carboxylato-4- hydroxybenzenesulfonato]","","- C17 H16 Co N2 O8 S -","- C17 H16 Co N2 O8 S -","- C68 H64 Co4 N8 O32 S4 -","4","1","OM6227","Fan, Sai-Rong; Zhu, Long-Guan; Xiao, Hong-Ping; Ng, Seik Weng","<i>catena</i>-Poly[[<i>cis</i>-diaqua(2,2'-bipyridine)cobalt(II)]-μ-3-carboxylato-4-hydroxybenzenesulfonato]","Acta Crystallographica Section E","2005","61","3","m435","m436","10.1107/S1600536805002904","","","0.71073","MoKα","","0.074","0.072","","","0.167","0.168","","","","","","1.34","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205338","12.008","0.003","25.192","0.006","7.0192","0.0012","90","","90","","90","","2123.3","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","16β-Bromo-17α-hydroxypregn-4-ene-3,20-dione methanol solvate","","- C22 H33 Br O4 -","- C22 H33 Br O4 -","- C88 H132 Br4 O16 -","4","1","RN6036","Shi Wang; Yongli Wang; Qiang Nie; Aishuang Xiang; Lina Zhou","16β-Bromo-17α-hydroxypregn-4-ene-3,20-dione methanol solvate","Acta Crystallographica Section E","2005","61","3","o563","o564","10.1107/S1600536805002813","","","0.71073","MoKα","","0.0905","0.0662","","","0.1754","0.1922","","","","","","1.052","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205339","6.893","0.001","7.078","0.001","24.754","0.005","96.41","0.03","90.83","0.03","108.49","0.03","1136.6","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[]tetraaqua(3-carboxy-4-hydroxybenzenesulfonato)strontium(II)]- μ~3~-3-carboxy-4-hydroxybenzenesulfonato] dihydrate]","","- C14 H22 O18 S2 Sr -","- C14 H22 O18 S2 Sr -","- C28 H44 O36 S4 Sr2 -","2","1","RN6039","Dao-Li An; Shan Gao; Li-Hua Huo; Jian-Rong Li","<i>catena</i>-Poly[[[tetraaqua(3-carboxy-4-hydroxybenzenesulfonato)strontium(II)]-μ~3~-3-carboxy-4-hydroxybenzenesulfonato] dihydrate]","Acta Crystallographica Section E","2005","61","3","m417","m419","10.1107/S1600536805002801","","","0.71073","MoKα","","0.0358","0.0275","","","0.0595","0.0619","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205340","8.1951","0.0019","8.762","0.002","10.619","0.003","82.472","0.003","77.181","0.003","79.873","0.003","728.5","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Diaquabis(2,5-di-3-pyridyl-1,3,4-oxadiazole)dithiocyanatomanganese(II)","","- C26 H20 Mn N10 O6 S2 -","- C26 H20 Mn N10 O4 S2 -","- C26 H20 Mn N10 O4 S2 -","1","0.5","RN6041","Miao Du; Xiu-Juan Jiang; Xiao-Jun Zhao","Diaquabis(2,5-di-3-pyridyl-1,3,4-oxadiazole)dithiocyanatomanganese(II): a three-dimensional supramolecular network formed through O—H···N and C—H···S interactions","Acta Crystallographica Section E","2005","61","3","m485","m487","10.1107/S1600536805003764","","","0.71073","MoKα","","0.0462","0.0346","","","0.0925","0.099","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205341","6.1468","0.0013","11.261","0.002","12.9983","0.0007","114.775","0.01","92.134","0.011","100.408","0.01","797","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","tert-Butyl 4-[2-(methoxycarbonyl)ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate","","- C15 H23 N O4 -","- C15 H23 N O4 -","- C30 H46 N2 O8 -","2","1","RN6042","Ramos Silva, Manuela; Matos Beja, Ana; Paixao, Jose Antonio; Lopes, Susana H.; Cabral, Ana M. T. D. P. V.; Rocha Gonsalves, A. M. d'A.; Sobral, Abilio J. F. N.","<i>tert</i>-Butyl 4-[2-(methoxycarbonyl)ethyl]-3,5-dimethyl-1<i>H</i>-pyrrole-2-carboxylate","Acta Crystallographica Section E","2005","61","3","o575","o577","10.1107/S1600536805003533","","","0.71073","MoKα","","0.0519","0.043","","","0.1199","0.1295","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205342","6.106","0.002","9.293","0.003","11.58","0.004","101.875","0.008","97.89","0.006","98.59","0.008","626.2","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","Tetramethylpyrazine‒endo-norbornene-cis-5,6-dicarboxylic acid (1/2)","","- C13 H16 N O4 -","- C13 H16 N O4 -","- C26 H32 N2 O8 -","2","1","RN6043","Mao-Lin Hu; Zhi-Min Jin; Ya-Juan Zhao; Di-Mei Chen; Shun Wang; Xiao-Qing Cai","Tetramethylpyrazine‒<i>endo</i>-norbornene-<i>cis</i>-5,6-dicarboxylic acid (1/2)","Acta Crystallographica Section E","2005","61","3","o731","o732","10.1107/S1600536805005283","","","0.71073","MoKα","","0.1489","0.0962","","","0.2598","0.3261","","","","","","1.217","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205343","12.838","0.007","16.25","0.009","17.221","0.009","90","","102.376","0.011","90","","3509","3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C38 H54 O5 -","- C38 H54 O5 -","- C152 H216 O20 -","4","1","RZ6032","Zhi-Yun Du; Yu-Fang Wang; Xue-Pu Mao; Jiang-Ke Qin; Wei Qiao; Lin Ma; Lian-Quan Gu","(2<i>E</i>,6<i>E</i>)-2,6-Bis(3,5-di-<i>tert</i>-butyl-4-hydroxybenzylidene)cyclohexanone acetic acid solvate","Acta Crystallographica Section E","2005","61","3","o587","o588","10.1107/S1600536804034208","","","0.71073","MoKα","","0.0743","0.0509","","","0.136","0.1553","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205344","5.9991","0.0015","10.052","0.003","12.161","0.003","81.391","0.004","76.933","0.004","81.214","0.004","700.9","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N-(2-Benzoyl-4-chlorophenyl)-2-chloroacetamide","","- C15 H11 Cl2 N O2 -","- C15 H11 Cl2 N O2 -","- C30 H22 Cl4 N2 O4 -","2","1","RZ6038","Malathy Sony, S. M.; Charles, P.; Ponnuswamy, M. N.; Nethaji, M.","<i>N</i>-(2-Benzoyl-4-chlorophenyl)-2-chloroacetamide","Acta Crystallographica Section E","2005","61","3","o632","o634","10.1107/S1600536805002291","","","0.71073","MoKα","","0.0884","0.0633","","","0.147","0.16","","","","","","1.081","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205345","17.16","0.009","11.68","0.006","18.274","0.01","90","","90","","90","","3663","3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","3-Benzyl-2-methyl-1-phenylsulfonyl-1H-indole","","- C22 H19 N O2 S -","- C22 H19 N O2 S -","- C176 H152 N8 O16 S8 -","8","1","RZ6040","S. M. Malathy Sony; K. Palani; P. Charles; M. N. Ponnuswamy; N. Sureshbabu; P. C. Srinivasan; M. Nethaji","3-Benzyl-2-methyl-1-phenylsulfonyl-1<i>H</i>-indole","Acta Crystallographica Section E","2005","61","3","o521","o523","10.1107/S1600536805002825","","","0.71073","MoKα","","0.0542","0.0448","","","0.1332","0.1426","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205346","13.669","0.007","11.392","0.006","18.315","0.009","90","","92.697","0.007","90","","2849","3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Ethyl 4-(4-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate","","- C14 H16 N2 O4 -","- C14 H16 N2 O4 -","- C112 H128 N16 O32 -","8","1","RZ6041","Ming Li; Wei-Si Guo; Li-Rong Wen; Wen-Ying Qi","Ethyl 4-(4-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate","Acta Crystallographica Section E","2005","61","3","o531","o533","10.1107/S1600536805002837","","","0.71073","MoKα","","0.058","0.0426","","","0.1233","0.1336","","","","","","1.063","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205347","8.425","0.0017","12.577","0.003","13.945","0.003","90","","90","","90","","1477.6","0.6","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Diisothiocyanatobis(2-methyl-1H-imidazole)cobalt(II)","","- C10 H12 Co N6 S2 -","- C10 H12 Co N6 S2 -","- C40 H48 Co4 N24 S8 -","4","0.5","RZ6042","Faqian Liu; Fangfang Jian; Lude Lu; Xujie Yang; Xin Wang; Hailian Xiao","Diisothiocyanatobis(2-methyl-1<i>H</i>-imidazole)cobalt(II)","Acta Crystallographica Section E","2005","61","3","m425","m426","10.1107/S1600536805002849","","","0.71073","MoKα","","0.042","0.0356","","","0.0988","0.1027","","","","","","1.093","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205348","13.3031","0.0006","8.9874","0.0004","17.7551","0.0009","90","","106.408","0.001","90","","2036.35","0.17","180","2","180","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Chloro[N,N'-dimethyl-N,N'-bis(2-pyridylmethyl)ethane-1,2-diamine] oxovanadium(IV) perchlorate","","- C16 H22 Cl2 N4 O5 V -","- C16 H22 Cl2 N4 O5 V -","- C64 H88 Cl8 N16 O20 V4 -","4","1","RZ6044","Egdal, Rune Kirk; Bond, Andrew D.; McKenzie, Christine J.","Chloro[<i>N</i>,<i>N</i>'-dimethyl-<i>N</i>,<i>N</i>'-bis(2-pyridylmethyl)ethane-1,2-diamine]oxovanadium(IV) perchlorate","Acta Crystallographica Section E","2005","61","3","m412","m413","10.1107/S1600536805002692","","","0.71073","MoKα","","0.0578","0.0398","","","0.0975","0.1018","","","","","","0.936","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205349","18.1505","0.001","17.3369","0.001","14.5209","0.0008","90","","95.054","0.001","90","","4551.6","0.4","273","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","scandenin","4-hydroxy-3-(4-hydroxyphenyl)-5-methoxy-8,8-dimethyl-6-(3-methyl-2-butenyl)- 2H,8H-pyrano[2,3f]chromen-2-one","","- C26 H26 O6 -","- C26 H26 O6 -","- C208 H208 O48 -","8","2","RZ6045","K. Ravikumar; B. Sridhar; A. Sridhar Rao; J. Madhusudana Rao","Scandenin","Acta Crystallographica Section E","2005","61","3","o596","o598","10.1107/S1600536805003594","","","0.71073","MoKα","","0.0617","0.0468","","","0.1263","0.1385","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205350","16.151","0.002","11.9923","0.0014","18.094","0.002","90","","109.261","0.002","90","","3308.4","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(4-Methylbenzoyl)-N-phenyl-2-(1H-1,2,4-triazol-1-yl)ethanethioamide","","- C18 H16 N4 O S -","- C18 H16 N4 O S -","- C144 H128 N32 O8 S8 -","8","2","RZ6046","Liang-Zhong Xu; Guo-Dong Si; Zai-Feng Li; Guan-Ping Yu; Yong-Wei Huang","2-(4-Methylbenzoyl)-<i>N</i>-phenyl-2-(1<i>H</i>-1,2,4-triazol-1-yl)ethanethioamide","Acta Crystallographica Section E","2005","61","3","o571","o572","10.1107/S1600536805003417","","","0.71073","MoKα","","0.1085","0.0485","","","0.1133","0.1336","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205351","15.277","0.003","11.81","0.002","8.636","0.0017","90","","121.79","0.03","90","","1324.4","0.6","295","2","295","2","","","","","","","","4","C 1 c 1","C -2yc","9","","3-Benzyl-4-phenyl-1H-1,2,4-triazole-5(4H)-thione","","- C15 H13 N3 S -","- C15 H13 N3 S -","- C60 H52 N12 S4 -","4","1","RZ6047","Fangfang Jian; Zhengshuai Bai; Hailian Xiao; Kai Li","3-Benzyl-4-phenyl-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","3","o557","o558","10.1107/S1600536805003223","","","0.71073","MoKα","","0.0425","0.0391","","","0.1057","0.1091","","","","","","1.083","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205352","11.751","0.0014","5.51","0.0011","18.277","0.0017","90","","96.14","0.02","90","","1176.6","0.3","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","catena-Poly[[diaquacadmium(II)]-μ-benzene-1,4-dioxyacetato-κ^4^O,O':O'',O''']","","- C10 H12 Cd O8 -","- C10 H12 Cd O8 -","- C40 H48 Cd4 O32 -","4","0.5","RZ6049","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui","<i>catena</i>-Poly[[diaquacadmium(II)]-μ-benzene-1,4-dioxyacetato-κ^4^<i>O,O</i>':<i>O</i>'',<i>O</i>''']","Acta Crystallographica Section E","2005","61","3","m451","m453","10.1107/S1600536805003211","","","0.71073","MoKα","","0.0529","0.0459","","","0.1279","0.1502","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205353","6.0641","0.0005","10.6966","0.0009","11.7335","0.001","90","","90","","90","","761.1","0.11","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Iodolevoglucosan","1,6-Anhydro-2-iodo-2-deoxy-β-D-glucopyranose","","- C6 H9 I O4 -","- C6 H9 I O4 -","- C24 H36 I4 O16 -","4","1","RZ6050","Gehle, Dietmar; Flörke, Ulrich; Krohn, Karsten","1,6-Anhydro-2-iodo-2-deoxy-β-<small>D</small>-glucopyranose (Iodolevoglucosan)","Acta Crystallographica Section E","2005","61","3","o664","o666","10.1107/S1600536805004526","","","0.71073","MoKα","","0.0216","0.0201","","","0.0487","0.0495","","","","","","1.037","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205354","8.867","0.0012","9.7248","0.0013","11.227","0.0015","101.006","0.002","105.841","0.002","93.966","0.002","906.6","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-(3-Benzyloxy-4-methoxyphenyl)-5-phenyl-1,3,4-oxadiazole","","- C22 H18 N2 O3 -","- C22 H18 N2 O3 -","- C44 H36 N4 O6 -","2","1","RZ6051","Shang, Zhen-Hua; Li, Wei; Wang, Song-Qing","2-(3-Benzyloxy-4-methoxyphenyl)-5-phenyl-1,3,4-oxadiazole","Acta Crystallographica Section E","2005","61","3","o704","o705","10.1107/S1600536805004861","","","0.71073","MoKα","","0.046","0.0346","","","","0.1038","","","","","","1.063","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205355","8.0127","0.0009","22.524","0.003","9.733","0.001","90","","113.42","0.001","90","","1611.9","0.3","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Aqua(1,10-phenanthroline)(thiodiglycolato)cobalt(II)","","- C16 H14 Co N2 O5 S -","- C16 H14 Co N2 O5 S -","- C64 H56 Co4 N8 O20 S4 -","4","1","RZ6052","Wu, Jian-Yi; Xie, Lin-Ming; He, Hong-Yin; Zhou, Xia; Zhu, Long-Guan","Aqua(1,10-phenanthroline)(thiodiglycolato)cobalt(II)","Acta Crystallographica Section E","2005","61","3","m568","m570","10.1107/S1600536805005076","","","0.71073","MoKα","","0.051","0.0375","","","0.0852","0.0913","","","","","","1.017","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205356","7.1404","0.0006","11.9642","0.0011","13.6188","0.0016","90","","90","","90","","1163.4","0.2","296","","296","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(2-Chloropyridin-3-yl)(4-nitrobenzylidene)amine","","- C12 H8 Cl N3 O2 -","- C12 H8 Cl N3 O2 -","- C48 H32 Cl4 N12 O8 -","4","1","RZ6053","Mehmet Akkurt; Selvi Karaca; Ali Asghar Jarrahpour; Maaroof Zarei; Orhan Büyükgüngör","(2-Chloropyridin-3-yl)(4-nitrobenzylidene)amine","Acta Crystallographica Section E","2005","61","3","o776","o778","10.1107/S1600536805005611","","","0.71073","MoKα","","0.0534","0.0395","","","0.0741","0.0789","","","","","","1.06","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205357","5.3172","0.0004","24.8494","0.0019","9.3896","0.0007","90","","102.938","0.001","90","","1209.14","0.16","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Bis(2-pyridylmethyl)amine‒borane","","- C12 H16 B N3 -","- C12 H16 B N3 -","- C48 H64 B4 N12 -","4","1","SJ6040","Ballester Sanchez, Noelia; Barreira Fontecha, Julia; Wikaira, Jan; McKee, Vickie","Bis(2-pyridylmethyl)amine‒borane","Acta Crystallographica Section E","2005","61","3","o567","o568","10.1107/S1600536805001728","","","0.71073","MoKα","","0.0622","0.0431","","","0.1041","0.1163","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205358","4.8629","0.0014","18.29","0.005","18.403","0.006","90","","94.642","0.006","90","","1631.4","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(Z)-3-[(2,4-Dinitrophenyl)hydrazono]-4,4,4-trifluoro-1-(2-thienyl)butan-1-one","","- C14 H9 F3 N4 O5 S -","- C14 H9 F3 N4 O5 S -","- C56 H36 F12 N16 O20 S4 -","4","1","SJ6044","Zuo-Liang Jing; Ming Yu; Xin Chen; Chun-Hua Diao; Qi-Liang Deng; Zhi Fan","(<i>Z</i>)-3-[(2,4-Dinitrophenyl)hydrazono]-4,4,4-trifluoro-1-(2-thienyl)butan-1-one","Acta Crystallographica Section E","2005","61","3","o534","o535","10.1107/S1600536805002308","","","0.71073","MoKα","","0.1104","0.0488","","","0.1012","0.1209","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205359","11.2958","0.0006","12.748","0.0008","17.5607","0.0008","90","","90","","90","","2528.7","0.2","296","","296","","","","","","","","","4","P b c n","-P 2n 2ab","60","","4-Phenyl-3-(pyridin-4-yl)-1H-1,2,4-triazole-5(4H)-thione","","- C13 H10 N4 S -","- C13 H10 N4 S -","- C104 H80 N32 S8 -","8","1","SJ6046","Sema Öztürk Yıldırım; Mehmet Akkurt; Ahmet Çetin; Ahmet Cansız; Memet Şekerci; Canan Kazak","4-Phenyl-3-(pyridin-4-yl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","3","o619","o621","10.1107/S1600536805003983","","","0.71073","MoKα","","0.056","0.031","","","0.071","0.076","","","","","","0.9","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205360","7.3872","0.0004","27.5675","0.0016","7.6687","0.0004","90","","117.344","0.001","90","","1387.21","0.13","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Diaquabis(biuretato-κ^2^O,O')nickel(II) dichloride","","- C4 H14 Cl2 N6 Ni O6 -","- C4 H14 Cl2 N6 Ni O6 -","- C16 H56 Cl8 N24 Ni4 O24 -","4","1","SJ6047","Lawson, Jeffrey; Harrison, William T. A.","Diaquabis(biuretato-κ^2^<i>O</i>,<i>O</i>')nickel(II) dichloride","Acta Crystallographica Section E","2005","61","3","m525","m527","10.1107/S1600536805004393","","","0.71073","MoKα","","0.0987","0.0471","","","0.0896","0.1011","","","","","","0.964","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205361","18.303","0.006","13.212","0.002","20.023","0.004","90","","109.67","0.02","90","","4559","2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","bis[1,3-bis(diphenylphosphino)propane]nickel(0)","","- C54 H52 Ni P4 -","- C54 H52 Ni P4 -","- C216 H208 Ni4 P16 -","4","0.5","SJ6048","Davies, Sian C.; Duff, Samantha E.; Evans, David J.","Bis[1,3-bis(diphenylphosphino)propane-κ^2^<i>P</i>,<i>P</i>']nickel(0)","Acta Crystallographica Section E","2005","61","3","m571","m573","10.1107/S1600536805005064","","","0.71069","Mo_Kα","","0.0604","0.0357","","","0.0783","0.0924","","","","","","1.066","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205362","13.861","0.003","5.834","0.001","14.903","0.003","90","","110.65","0.03","90","","1127.7","0.4","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-4(Chlorophenyl)-2H-benz[b][1,4]oxazine","","- C14 H10 Cl N O -","- C14 H10 Cl N O -","- C56 H40 Cl4 N4 O4 -","4","1","SJ6049","Vencato, Ivo; Ferri, Pedro H.; Faria, Lourival C.; Santos, Suzana C.; Lariucci, Carlito","3-(4-Chlorophenyl)-2<i>H</i>-benz[<i>b</i>][1,4]oxazine","Acta Crystallographica Section E","2005","61","3","o769","o771","10.1107/S160053680500543X","","","0.71073","MoKα","","0.061","0.043","","","0.114","0.132","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205363","6.746","0.001","12.605","0.004","18.32","0.003","90","","90","","90","","1557.8","0.6","296","2","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C19 H18 O3 -","- C19 H18 O3 -","- C76 H72 O12 -","4","1","SU6164","Binita Suthar; Anthony Fowler; Daniel S. Jones; Craig A. Ogle","1-(3,4,5-Trimethoxyphenyl)naphthalene","Acta Crystallographica Section E","2005","61","3","o607","o608","10.1107/S1600536805003776","","","1.54178","CuKα","","","0.0375","","","","0.0978","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205364","6.9577","0.0014","9.3611","0.0019","10.724","0.002","70.64","0.03","83.96","0.03","82.27","0.03","651.6","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","2,3,5-Trichloro-6-(4-methylpiperidin-1-yl)-1,4-benzoquinone","","- C12 H12 Cl3 N O2 -","- C12 H12 Cl3 N O2 -","- C24 H24 Cl6 N2 O4 -","2","1","SU6166","Bowes, Katharine F.; Cole, Jacqueline M.; Szablewski, Marek","2,3,5-Trichloro-6-(4-methylpiperidin-1-yl)-1,4-benzoquinone: a synchrotron study","Acta Crystallographica Section E","2005","61","3","o696","o698","10.1107/S1600536805004010","","","0.6928","synchrotron","","0.034","0.0327","","","0.091","0.0923","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205365","5.0708","0.0003","9.6094","0.0006","11.9258","0.0008","66.348","0.001","86.081","0.001","80.935","0.002","525.64","0.06","296","1","296","1","","","","","","","","3","P -1","-P 1","2","1,4,11,12-Tetrahydro-9,10-anthraquinone","1,4,11,12-Tetrahydro-9,10-anthraquinone","","- C14 H12 O2 -","- C14 H12 O2 -","- C28 H24 O4 -","2","1","SU6167","Andreas Decken; S. M. Mattar; A. Emwas","1,4,11,12-Tetrahydro-9,10-anthraquinone","Acta Crystallographica Section E","2005","61","3","o641","o642","10.1107/S1600536805004198","","","0.71073","MoKα","","0.0653","0.0478","","","0.1322","0.1384","","","","","","0.984","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205366","13.196","0.002","19.853","0.003","11.985","0.0019","90","","107.47","0.003","90","","2995","0.8","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,7-Bis(4-methoxyphenyl)-1,3,7,triphenyl-2,3,5,6,7,7a-hexahydro-1H- pyrrolo[2,3-d]pyrimidine-2,5,6-trione","","- C38 H29 N3 O5 -","- C38 H29 N3 O5 -","- C152 H116 N12 O20 -","4","1","SU6168","Adams, Harry; Mustafa Saçmaci; Şevket Hakan Üngören; Yunus Akçamur","4,7-Bis(4-methoxyphenyl)-1,3,7-triphenyl-2,3,5,6,7,7a-hexahydro-1<i>H</i>-pyrrolo[2,3-<i>d</i>]pyrimidine-2,5,6-trione","Acta Crystallographica Section E","2005","61","3","o635","o636","10.1107/S1600536805003995","","","0.71073","MoKα","","0.1324","0.0577","","","0.1138","0.1391","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205367","8.5925","0.001","10.6129","0.0013","7.7558","0.0009","90","","114.315","0.002","90","","644.52","0.13","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,1,2,2-Tetrachloro-1,2-diphenylethane","","- C14 H10 Cl4 -","- C14 H10 Cl4 -","- C28 H20 Cl8 -","2","0.5","SU6170","Adriana Garcia-Sanchez; Itzia I. Padilla-Martínez; Francisco J. Martínez-Martínez; Herbert Höpfl; Efrén V. García-Báez","1,1,2,2-Tetrachloro-1,2-diphenylethane","Acta Crystallographica Section E","2005","61","3","o678","o680","10.1107/S1600536805004472","","","0.71073","MoKα","","0.0258","0.0256","","","0.0664","0.0666","","","","","","1.118","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205368","5.4596","0.0001","15.9758","0.0003","17.5111","0.0003","90","","90","","90","","1527.34","0.05","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","6-O-Cyanomethyl-1,2:3,4-di-O-isopropylidene-α-D-galactopyranose","","- C14 H21 N O6 -","- C14 H21 N O6 -","- C56 H84 N4 O24 -","4","1","SU6172","Vratislav Langer; Bohumil Steiner; Ju̇lia Mic̆ová; Miroslav Koós̆","6-<i>O</i>-Cyanomethyl-1,2:3,4-di-<i>O</i>-isopropylidene-α-<small>D</small>-galactopyranose","Acta Crystallographica Section E","2005","61","3","o779","o781","10.1107/S1600536805005544","","","0.71073","MoKα","","0.0566","0.0379","","","0.0833","0.0922","","","","","","1.018","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205369","7.6036","0.0005","8.854","0.0005","8.924","0.0005","70.985","0.001","82.297","0.001","86.86","0.001","562.84","0.06","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Dichlorobis(phenothiazine-κS)palladium(II)","","- C24 H18 Cl2 N2 Pd S2 -","- C24 H18 Cl2 N2 Pd S2 -","- C24 H18 Cl2 N2 Pd S2 -","1","0.5","SU6173","Zhang, Xuanjun; Li, Dan; Zhou, Xiao-Ping; Ng, Seik Weng","Dichlorobis(phenothiazine-κ<i>S</i>)palladium(II)","Acta Crystallographica Section E","2005","61","3","m603","m605","10.1107/S1600536805005799","","","0.71073","MoKα","","0.025","0.024","","","0.064","0.065","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205370","7.333","0.003","13.737","0.003","15.381","0.006","113.04","0.02","94.93","0.04","105.23","0.03","1344.3","0.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","DL-phenylalanine DL-phenylalaninium picrate","DL-Phenylalanine DL-phenylalaninium picrate","","- C24 H25 N5 O11 -","- C24 H25 N5 O11 -","- C48 H50 N10 O22 -","2","1","TK6206","K. Anitha; R. K. Rajaram","<small>DL</small>-Phenylalanine <small>DL</small>-phenylalaninium picrate","Acta Crystallographica Section E","2005","61","3","o589","o591","10.1107/S1600536805003491","","","0.71073","MoKα","","0.208","0.062","","","0.139","0.188","","","","","","0.93","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205371","22.368","0.003","8.4961","0.0011","7.4726","0.001","90","","90","","90","","1420.1","0.3","120","2","120","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","1-Chloromethyl-4-aza-1-azoniabicyclo[2.2.2]octane tetrafluoroborate deuterochloroform solvate","","- C8 H14 B Cl4 D F4 N2 -","- C8 H14 B Cl4 D F4 N2 -","- C32 H56 B4 Cl16 D4 F16 N8 -","4","0.5","TK6209","Batsanov, Andrei S.; Trmcic, Jelena; Sandford, Graham","1-Chloromethyl-4-aza-1-azoniabicyclo[2.2.2]octane tetrafluoroborate deuterochloroform solvate","Acta Crystallographica Section E","2005","61","3","o681","o682","10.1107/S1600536805004411","","","0.71073","MoKα","","0.048","0.04","","","0.093","0.095","","","","","","1.21","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205372","7.3201","0.0008","13.9189","0.0014","15.8356","0.0016","90","","90","","90","","1613.5","0.3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Methyl 2,3,4-tetra-O-acetyl-1-azido-1-deoxy-β-D-glucopyranuronate","","- C13 H17 N3 O9 -","- C13 H17 N3 O9 -","- C52 H68 N12 O36 -","4","1","TK6210","Smith, Craig R.; Norris, Peter; Zeller, Matthias","Methyl 2,3,4-tri-<i>O</i>-acetyl-1-azido-1-deoxy-β-<small>D</small>-glucopyranuronate at 100K","Acta Crystallographica Section E","2005","61","3","o736","o737","10.1107/S1600536805004423","","","0.71073","MoKα","","0.031","0.031","","","0.079","0.08","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205373","9.464","0.0002","12.358","0.0002","9.775","0.0002","90","","117.767","0.0013","90","","1011.6","0.04","170","2","170","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Diaquabis(1,1,4-trimethylthiosemicarbazide)nickel(II) dinitrate","","- C8 H26 N8 Ni O8 S2 -","- C8 H26 N8 Ni O8 S2 -","- C16 H52 N16 Ni2 O16 S4 -","2","0.5","WK6043","Burrows, Andrew D.; Harrington, Ross W.; Mahon, Mary F.","Diaquabis(1,1,4-trimethylthiosemicarbazide)nickel(II) dinitrate","Acta Crystallographica Section E","2005","61","3","m551","m553","10.1107/S1600536805002965","","","0.7107","MoKα","","0.0238","0.0222","","","0.0547","0.0557","","","","","","1.064","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2205374","7.2877","0.0002","11.9265","0.0003","8.1586","0.0002","90","","107.396","0.001","90","","676.68","0.03","120","","120","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(hydroxymethyl)-3,5-dimethylpyrazole","","- C6 H10 N2 O -","- C6 H10 N2 O -","- C24 H40 N8 O4 -","4","1","WK6045","Radosavljević Evans, Ivana; Mészáros Szécsényi, Katalin; Leovac, Vukadin, M.","1-(Hydroxymethyl)-3,5-dimethylpyrazole","Acta Crystallographica Section E","2005","61","3","o625","o626","10.1107/S1600536805003971","","","0.71073","MoKα","","0.047","0.0401","","0.104","0.0999","0.0999","","","","","","0.997","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205375","13.6193","0.0007","17.7307","0.0013","15.8077","0.0009","90","","108.356","0.006","90","","3623","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","tetrapotassium tetratantalum tetraphosphorus tetracosasulfide","","- K2 P2 S12 Ta2 -","- K2 P2 S12 Ta2 -","- K16 P16 S96 Ta16 -","8","2","WM6048","Gutzmann, Andreas; Näther, Christian; Bensch, Wolfgang","K~4~Ta~4~P~4~S~24~","Acta Crystallographica Section E","2005","61","3","i20","i22","10.1107/S1600536805001959","","","0.71073","MoKα","","0.0408","0.0266","","","0.0522","0.055","","","","","","0.968","","","","has coordinates,has Fobs","184482","2020-10-21","18:00:00",""
"2205376","6.3397","0.0003","6.3397","0.0003","3.756","0.0002","90","","90","","90","","150.96","0.013","150","2","150","2","","","","","","","","4","P -4 21 m","P -4 2ab","113","ammonium chlorite","ammonium chlorate(III)","","- Cl H4 N O2 -","- Cl H4 N O2 -","- Cl2 H8 N2 O4 -","2","0.25","WM6052","Smolentsev, Anton I.; Naumov, Dmitry Yu.","Ammonium chlorite, NH~4~ClO~2~, at 150K","Acta Crystallographica Section E","2005","61","3","i38","i40","10.1107/S1600536805005088","","","0.71073","MoKα","","0.0165","0.0162","","","0.0401","0.0402","","","","","","1.262","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205377","10.685","0.0016","10.685","0.0016","10.685","0.0016","90","","90","","90","","1219.9","0.3","273","2","273","2","","","","","","","","6","P -4 3 m","P -4 2 3","215","","Hexapotassium dihydrogen monotitanoundecatungstocobaltate(II) tridecahydrate","","- Co H28 K6 O53 Ti W11 -","- Co K6 O53 Ti0.99996 W10.9999 -","- Co K6 O53 Ti0.99996 W10.9999 -","1","0.0416667","WM6053","Werner Kraus; Holger Stephan; Anita Röllich; Zdenek Matĕjka; Günter Reck","K~6~H~2~[TiW~11~CoO~40~].13H~2~O, with a monotitanoundecatungstocobaltate(II) anion","Acta Crystallographica, Section E","2005","61","3","i35","i37","10.1107/S1600536805005180","","","0.71073","MoKα","","0.0668","0.0386","","","0.0899","0.097","","","","","","0.977","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205378","11.0324","0.0001","23.9623","0.0003","11.2437","0.0001","90","","102.934","0.0008","90","","2896.99","0.05","190","","190","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Chloro{1-[(dimethylamino)methyl-κN]-1H-indole-κC^2^}(triphenylphosphine- κP)palladium(II)","","- C30 H30 Cl3 N2 P Pd -","- C30 H30 Cl3 N2 P Pd -","- C120 H120 Cl12 N8 P4 Pd4 -","4","1","WN6315","Cooper, Richard I.; Cowley, Andrew R.; Capito, Elena; Brown, John M.; Ricci, Alfredo","Chloro{1-[(dimethylamino)methyl-κ<i>N</i>]-1<i>H</i>-indolyl-κ<i>C</i>^2^}(triphenylphosphine-κ<i>P</i>)palladium(II) dichloromethane solvate","Acta Crystallographica Section E","2005","61","3","m585","m586","10.1107/S1600536804033227","","","0.71073","MoKα","","0.0308","0.0249","","0.0587","0.0571","0.0587","","","","","","0.9977","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205379","10.3125","0.0002","10.9019","0.0002","16.4409","0.0005","71.7446","0.0009","75.0748","0.0009","62.033","0.001","1536.81","0.06","150","","150","","","","","","","","","7","P -1","-P 1","2","","Acetato[1-(oxazolin-2-ylmethyl-κN)indol-2-yl](triphenylphosphine)palladium(II) dichloromethane solvate","","- C33 H31 Cl2 N2 O3 P Pd -","- C33 H31 Cl2 N2 O3 P Pd -","- C66 H62 Cl4 N4 O6 P2 Pd2 -","2","1","WN6316","Cowley, Andrew R.; Cooper, Richard I.; Capito, Elena; Brown, John M; Ricci, Alfredo","Acetato[1-(oxazolin-2-ylmethyl-κ<i>N</i>)-1<i>H</i>-indolyl-κ<i>C</i>^2^](triphenylphosphine)palladium(II) dichloromethane solvate","Acta Crystallographica Section E","2005","61","3","m582","m584","10.1107/S1600536804032891","","","0.71073","MoKα","","0.0605","0.0357","","0.0599","0.0396","0.0396","","","","","","1.1005","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205380","9.535","0.003","9.539","0.003","10.093","0.003","103.89","0.02","92.05","0.03","113.5","0.02","808.3","0.5","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","2,2-Dimethyl-6-(4-nitrophenyl)-4-phenyl-1,3-diazabicyclo[3.1.0]hex-3-ene","","- C18 H17 N3 O2 -","- C18 H17 N3 O2 -","- C36 H34 N6 O4 -","2","1","WN6323","Dyakonenko, Viktoria V.; Shishkin, Oleg V.; Zbruev, Alexandr V.; Desenko, Sergey M.","2,2-Dimethyl-6-(4-nitrophenyl)-4-phenyl-1,3-diazabicyclo[3.1.0]hex-3-ene","Acta Crystallographica Section E","2005","61","3","o667","o668","10.1107/S1600536805004484","","","0.71073","MoKα","","0.0723","0.0666","","","0.1895","0.1984","","","","","","1.084","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205381","9.908","0.001","10.442","0.001","16.603","0.002","90","","90","","90","","1717.7","0.3","100","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H23 N S2 -","- C18 H23 N S2 -","- C72 H92 N4 S8 -","4","1","WN6325","Kırılmış, Cumhur; Koca, Murat; Arıcı, Cengiz; W. Heinemann, Frank; Ahmedzade, Misir","3-Butyl-4-(3-methyl-3-phenylcyclobut-1-yl)-1,3-thiazole-2(3<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","3","o555","o556","10.1107/S1600536805003168","","","0.71073","MoKα","","0.0492","0.0348","","","0.0664","0.0701","","","","","","1.023","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205382","4.015","0.003","15.41","0.01","25.73","0.005","90","","91.22","0.07","90","","1591.6","1.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Bromo-2,6-dichloroaniline","","- C6 H4 Br Cl2 N -","- C6 H4 Br Cl2 N -","- C48 H32 Br8 Cl16 N8 -","8","2","WN6327","M. Arun Prasad; Babu Varghese; M. V. Sangaranarayanan","4-Bromo-2,6-dichloroaniline","Acta Crystallographica Section E","2005","61","3","o758","o759","10.1107/S1600536805003521","","","0.71073","MoKα","","0.1656","0.0585","","","0.1513","0.1975","","","","","","0.995","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205383","8.589","0.003","8.686","0.003","11.375","0.004","90","","90","","90","","848.6","0.5","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-Methyl-6,7-dihydropyrrolo[2,3-c]azepine-4,8(1H,5H)-dione","","- C9 H10 N2 O2 -","- C9 H10 N2 O2 -","- C36 H40 N8 O8 -","4","1","WN6329","Xiang-Chao Zeng; Shi-Hai Xu; Jian Gu; Dong-Sheng Deng","1-Methyl-6,7-dihydropyrrolo[2,3-<i>c</i>]azepine-4,8(1<i>H</i>,5<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","3","o795","o796","10.1107/S1600536805005532","","","0.71073","MoKα","","0.0356","0.0316","","","0.0845","0.0883","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205384","5.6459","0.0009","13.973","0.002","16.875","0.003","88.517","0.003","85.574","0.003","81.742","0.003","1313.4","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","3-(3-Hydroxyphenyl)-1-(4-methoxyphenyl)prop-2-en-1-one","","- C16 H14 O3 -","- C16 H14 O3 -","- C64 H56 O12 -","4","2","WN6330","S. Sathiya Moorthi; K. Chinnakali; S. Nanjundan; P. Selvam; Hoong-Kun Fun; Xiao-Lan Yu","3-(3-Hydroxyphenyl)-1-(4-methoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2005","61","3","o743","o745","10.1107/S1600536805004915","","","0.71073","MoKα","","0.0675","0.0551","","","0.1573","0.1694","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205385","8.3045","0.0007","10.5134","0.001","11.8019","0.0011","76.106","0.001","87.116","0.002","72.072","0.002","951.38","0.15","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(4-methylbenzylidene)amino]- 1H-pyrazole-3-carbonitrile","","- C19 H11 Cl2 F3 N4 -","- C19 H11 Cl2 F3 N4 -","- C38 H22 Cl4 F6 N8 -","2","1","WW6349","Zhong, Ping; Yang, Zhiping; Shi, Qian; Li, Shuyan; Tang, Riyuan","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(4-methylbenzylidene)amino]-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","3","o559","o560","10.1107/S1600536805003028","","","0.71073","MoKα","","0.0809","0.0724","","","0.2045","0.2147","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205386","13.122","0.002","12.943","0.002","15.893","0.003","90","","104.517","0.003","90","","2613.1","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(3-tert-buyl-N,5-dimethylsalicylaldiminato)cobalt(II)","","- C26 H36 Co N2 O2 -","- C26 H36 Co N2 O2 -","- C104 H144 Co4 N8 O8 -","4","1","WW6350","Li, Xiaoyan; Huang, Liye; Dong, Shuli; Li, Mu; Sun, Hongjian","Bis(3-tert-buyl-N,5-dimethylsalicylaldiminato)cobalt(II)","Acta Crystallographica, Section E","2005","61","3","o465","o466","10.1107/S1600536805003132","","","0.71073","MoKα","","0.0822","0.0431","","","0.1137","0.142","","","","","","1.064","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205387","10.184","0.002","12.182","0.002","18.987","0.003","90","","90","","90","","2355.6","0.7","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","mer-(2-Formylatocyclohexen-1-olato-κ^2^C^2^,O^1^)iodotris(trimethylphosphine- κP)cobalt(III)","","- C16 H35 Co I O2 P3 -","- C16 H35 Co I O2 P3 -","- C64 H140 Co4 I4 O8 P12 -","4","1","WW6351","Yu, Fengli; Dong, Shuli; Zhou, Jin; Wang, Aichen; Sun, Hongjian; Li, Xiaoyan","<i>mer</i>-(2-Formylatocyclohexen-1-olato-κ^2^<i>C</i>^2^,<i>O</i>^1^)iodotris(trimethylphosphine-κ<i>P</i>)cobalt(III)","Acta Crystallographica Section E","2005","61","3","m467","m468","10.1107/S1600536805003144","","","0.71073","MoKα","","0.0892","0.0526","","","0.1336","0.1517","","","","","","1.081","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205388","5.843","0.0003","12.8501","0.0008","17.5767","0.0011","90","","97.449","0.005","90","","1308.58","0.13","150","","150","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(2-exo,7-exo,9-endo,10-endo)-11-Oxatricyclo[6.2.1.0^2,7^]undec-4-ene-9,10-diyl diacetate","","- C14 H18 O5 -","- C14 H18 O5 -","- C56 H72 O20 -","4","1","WW6356","Mehmet Akkurt; Sema Öztürk Yıldırım; Arif Baran; Hasan Seçen; Orhan Büyükgüngör","(2-<i>exo</i>,7-<i>exo</i>,9-<i>endo</i>,10-<i>endo</i>)-11-Oxatricyclo[6.2.1.0^2,7^]undec-4-ene-9,10-diyl diacetate","Acta Crystallographica Section E","2005","61","3","o760","o762","10.1107/S1600536805005234","","","0.71073","MoKα","","0.037","0.0317","","","0.0813","0.0839","","","","","","1.033","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205389","10.0639","0.0006","12.2445","0.0007","13.9291","0.0008","96.985","0.001","101.406","0.001","98.851","0.001","1641.9","0.17","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","cis-Diaquabis(1,10-phenanthroline)manganese(II) 3-carboxylato-4-hydroxybenzenesulfonate tetrahydrate","","- C31 H32 Mn N4 O12 S -","- C31 H32 Mn N4 O12 S -","- C62 H64 Mn2 N8 O24 S2 -","2","1","WW6357","Fan, Sai-Rong; Zhu, Long-Guan; Xiao, Hong-Ping; Ng, Seik Weng","<i>cis</i>-Diaquabis(1,10-phenanthroline)manganese(II) 3-carboxylato-4-hydroxybenzenesulfonate tetrahydrate","Acta Crystallographica Section E","2005","61","3","m563","m565","10.1107/S1600536805004927","","","0.71073","MoKα","","0.0736","0.0654","","","0.1439","0.1483","","","","","","1.2","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205390","5.469","0.002","7.786","0.003","8.463","0.003","108.604","0.005","92.357","0.006","107.546","0.005","321.9","0.2","288","2","288","2","","","","","","","","4","P -1","-P 1","2","","1,4-Dimethylpyridinium triiodide","","- C7 H10 I3 N -","- C6.64 H10 I3 N1.36 -","- C6.64 H10 I3 N1.36 -","1","0.5","WW6360","Tan, Xue-Jie; Sun, Si-Xiu; Liu, Shu-Lian; Ma, Jian-Ping; Xing, Dian-Xiang","1,4-Dimethylpyridinium triiodide","Acta Crystallographica Section E","2005","61","3","o756","o757","10.1107/S1600536805005301","","","0.71073","MoKα","","0.0634","0.0437","","","0.0947","0.105","","","","","","0.929","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2205391","11.0122","0.0007","11.0122","0.0007","18.8285","0.0014","90","","90","","120","","1977.4","0.2","295","2","295","2","","","","","","","","5","P 32 2 1","P 32 2""","154","","2,2'-Diamino-4,4'-bi-1,3-thiazolium (2R,3R)-tartrate","","- C10 H12 N4 O6 S2 -","- C10 H12 N4 O6 S2 -","- C60 H72 N24 O36 S12 -","6","1","WW6361","Liu, Bing-Xin; Xu, Duan-Jun","2,2'-Diamino-4,4'-bi-1,3-thiazolium (2<i>R</i>,3<i>R</i>)-tartrate","Acta Crystallographica Section E","2005","61","3","o753","o755","10.1107/S1600536805005313","","","0.71073","MoKα","","0.032","0.03","","","0.075","0.076","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205392","6.738","0.003","12.028","0.003","12.063","0.003","70.02","0.03","86.88","0.03","76.45","0.03","892.9","0.5","295","1","295","1","","","","","","","","5","P -1","-P 1","2","","Bis(adamantylamine-κN)bis(1-phenylbutane-1,3-dionato-κO,O')nickel(II)","","- C40 H52 N2 Ni O4 -","- C40 H52 N2 Ni O4 -","- C40 H52 N2 Ni O4 -","1","0.5","YA6237","Ernest Meštrović; Dejan-Krešimir Bučar","Bis(adamantylamine-κ<i>N</i>)bis(1-phenylbutane-1,3-dionato-κ^2^<i>O</i>,<i>O</i>')nickel(II)","Acta Crystallographica Section E","2005","61","3","m522","m524","10.1107/S1600536805004216","","","0.71073","MoKα","","0.055","0.041","","","0.095","0.103","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205393","10.801","0.0017","14.279","0.004","18.074","0.003","90","","103.23","0.013","90","","2713.5","1","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3,6-Diphenyl-1,4-bis(tolyl-4-sulfonyl)-1,4-dihydro-1,2,4,5-tetrazine","","- C28 H24 N4 O4 S2 -","- C28 H24 N4 O4 S2 -","- C112 H96 N16 O16 S8 -","4","1","AC6157","Luping Lv; Weixiao Hu; Hai-Bo Shi; Guo-Wu Rao","3,6-Diphenyl-1,4-bis(<i>p</i>-tolylsulfonyl)-1,4-dihydro-1,2,4,5-tetrazine","Acta Crystallographica Section E","2005","61","4","o1026","o1027","10.1107/S1600536805007622","","","0.71065","MoKα","","0.0881","0.0374","","","0.0979","0.1182","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205394","17.559","0.007","8.959","0.004","19.566","0.008","90","","97.591","0.009","90","","3051","2","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N-[3-(Hydroxymethyl)phenyl]-N'-(4-methoxybenzoyl)thiourea","","- C16 H16 N2 O3 S -","- C16 H16 N2 O3 S -","- C128 H128 N16 O24 S8 -","8","1","AC6161","Ngah, Nurziana; Mohd Fauzi, Noor Fazlina; Yamin, Bohari M.","<i>N</i>-[3-(Hydroxymethyl)phenyl]-<i>N</i>'-(4-methoxybenzoyl)thiourea","Acta Crystallographica Section E","2005","61","4","o1018","o1019","10.1107/S1600536805007853","","","0.71073","MoKα","","0.0616","0.0537","","","0.1233","0.1278","","","","","","1.189","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205395","8.048","0.003","10.039","0.002","7.298","0.002","90","","100.58","0.03","90","","579.6","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,4-bis(bromoacetoxy)butane","butane-1,4-diyl bis(bromoacetate)","","- C8 H12 Br2 O4 -","- C8 H12 Br2 O4 -","- C16 H24 Br4 O8 -","2","0.5","AC6162","Martínez-Palau, Meritxell; Puiggalí, Jordi; Solans, Xavier; Urpí, Lourdes","Butane-1,4-diyl bis(bromoacetate)","Acta Crystallographica Section E","2005","61","4","o1028","o1031","10.1107/S1600536805007609","","","0.71073","MoKα","","0.1739","0.065","","","0.1416","0.1798","","","","","","1.011","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205396","9.6263","0.0003","12.0153","0.0003","15.6375","0.0004","86.334","0.002","79.479","0.002","83.175","0.002","1764.02","0.08","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","Bis(tert-butylimido)[2-(dimethylaminomethyl)pyrrol-1-yl]tungsten(VI)-μ-oxo- bis(tert-butylimido)(η^2^-N,O-tert-butylnitroso)tungsten(VI)","","- C27 H57 N7 O2 W2 -","- C27 H57 N7 O2 W2 -","- C54 H114 N14 O4 W4 -","2","1","AC6163","Uno, Chia-Liang; Kuo, Pei-Cheng; Lee, Hon Man; Huang, Jui-Hsien","Bis(<i>tert</i>-butylimido)[2-(dimethylaminomethyl)pyrrol-1-yl]tungsten(VI)-μ-oxo-bis(<i>tert</i>-butylimido)(η^2^-<i>N,O</i>-<i>tert</i>-butylnitroso)tungsten(VI)","Acta Crystallographica Section E","2005","61","4","m697","m698","10.1107/S1600536805007610","","","0.71073","MoKα","","0.0353","0.0262","","","0.0602","0.063","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205397","8.693","0.0002","8.8976","0.0002","13.1057","0.0003","73.852","0.001","86.15","0.001","83.062","0.001","965.96","0.04","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","erythro-2-(2,6-Dimethoxy-4-methylphenoxy)-1-(4-hydroxy-3,5- dimethoxyphenyl)propane-1,3-diol","","- C20 H26 O8 -","- C20 H26 O8 -","- C40 H52 O16 -","2","1","AC6164","Langer, Vratislav; Lundquist, Knut; Miksche, Gerhard E.","<i>erythro</i>-2-(2,6-Dimethoxy-4-methylphenoxy)-1-(4-hydroxy-3,5-dimethoxyphenyl)propane-1,3-diol","Acta Crystallographica Section E","2005","61","4","o1001","o1003","10.1107/S1600536805007865","","","0.71073","MoKα","","0.0877","0.0493","","","0.1043","0.1205","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205398","18.515","0.003","9.927","0.002","20.948","0.003","90","","94.659","0.003","90","","3837.5","1.1","295","2","295","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","Poly[[[(1,10-phenanthroline)manganese(II)]-μ~3~-2-nitrobenzene-1,4- dicarboxylato] monohydrate]","","- C20 H13 Mn N3 O7 -","- C20 H13 Mn N3 O7 -","- C160 H104 Mn8 N24 O56 -","8","1","AC6166","Zhu, Long-Guan; Xiao, Hong-Ping","Poly[[[(1,10-phenanthroline)manganese(II)]-μ~3~-2-nitrobenzene-1,4-dicarboxylato] monohydrate]","Acta Crystallographica Section E","2005","61","4","m769","m771","10.1107/S1600536805009086","","","0.71073","MoKα","","0.1044","0.0628","","","0.1149","0.1421","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205399","9.4853","0.0003","10.2904","0.0002","12.2872","0.0004","90","","90","","90","","1199.32","0.06","120","2","120","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","6,6,8a-Trimethyl-3a,6,7,8a-tetrahydrobenzo[b]furo[3,2-d]furan-2,4(3H,5H)-dione","","- C13 H16 O4 -","- C13 H16 O4 -","- C52 H64 O16 -","4","1","AT6000","Basavegowda Nagaraj; Hemmige S. Yathirajan; Padmarajaiah Nagaraja; Daniel E. Lynch","6,6,8a-Trimethyl-3a,6,7,8a-tetrahydrobenzo[<i>b</i>]furo[3,2-<i>d</i>]furan-2,4(3<i>H</i>,5<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","4","o1041","o1042","10.1107/S1600536805008093","","","0.71073","MoKα","","0.0288","0.0267","","","0.0659","0.0676","","","","","","1.04","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205400","9.9686","0.0008","12.2843","0.0008","14.7707","0.0003","90","","90","","90","","1808.78","0.19","100","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3-Cyclohexyl-4-(3-methyl-3-phenylcyclobutyl)-1,3-thiazole-2(3H)-thione","","- C20 H25 N S2 -","- C20 H25 N S2 -","- C80 H100 N4 S8 -","4","1","AT6001","Kırılmış, Cumhur; Koca, Murat; Arıcı, Cengiz; W. Heinemann, Frank","3-Cyclohexyl-4-(3-methyl-3-phenylcyclobutyl)-1,3-thiazole-2(3<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","4","o1176","o1177","10.1107/S160053680500930X","","","0.71073","MoKα","","0.0399","0.0314","","","0.067","0.0702","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205401","11.536","0.002","6.427","0.001","13.898","0.003","90","","105.95","0.03","90","","990.8","0.3","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","potassium selenate tellurate","","- H6 K2 O10 Se Te -","- H6 K2 O10 Se Te -","- H24 K8 O40 Se4 Te4 -","4","0.5","BR6184","Dammak, Mohamed; Cousson, Alain; Nierlich, Martine","Dipotassium selenate tellurate","Acta Crystallographica Section E","2005","61","4","i55","i57","10.1107/S1600536805008329","","","0.71073","MoKα","","","0.0185","","","","0.0208","","","","","","1.0363","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205402","16.0504","0.001","16.4302","0.001","26.5331","0.0016","90","","90","","90","","6997.1","0.7","130","2","130","2","","","","","","","","5","I b c a","-I 2b 2c","73","dichlorobis[4-(dimethylamino)phenyl]tellurium","dichlorobis[4-(dimethylamino)phenyl]tellurium","","- C16 H20 Cl2 N2 Te -","- C16 H20 Cl2 N2 Te -","- C256 H320 Cl32 N32 Te16 -","16","1","BR6185","Beckmann, Jens; Dakternieks, Dainis; Duthie, Andrew; Mitchell, Cassandra","An orthorhombic polymorph of dichlorobis[4-(dimethylamino)phenyl]tellurium","Acta Crystallographica Section E","2005","61","4","o986","o987","10.1107/S1600536805007336","","","0.71073","MoKα","","0.024","0.0216","","","0.0554","0.0568","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205403","22.172","0.004","10.5547","0.0016","7.7884","0.0012","90","","106.909","0.005","90","","1743.8","0.5","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","cis-Diaquabis(4-formyl-2-methoxyphenolato)zinc(II)","","- C16 H18 O8 Zn -","- C16 H18 O8 Zn -","- C64 H72 O32 Zn4 -","4","0.5","BR6187","Lin, Zhi-Dong; Lu, Jin-Yu","<i>cis</i>-Diaquabis(4-formyl-2-methoxyphenolato)zinc(II)","Acta Crystallographica Section E","2005","61","4","m743","m745","10.1107/S1600536805008561","","","0.71073","MoKα","","0.048","0.0434","","","0.1226","0.1257","","","","","","1.077","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205404","12.11","0.002","8.1753","0.0015","12.566","0.002","90","","111.963","0.017","90","","1153.8","0.4","100","1","100","1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","caesium chloride 2-(N-morpholinio)ethanesulfonate","","- C6 H13 Cl Cs N O4 S -","- C6 H13 Cl Cs N O4 S -","- C24 H52 Cl4 Cs4 N4 O16 S4 -","4","1","BR6188","Milić, Dalibor; Renić, Marija; Matković-C̆alogović, Dubravka","Caesium chloride 2-(<i>N</i>-morpholinio)ethanesulfonate","Acta Crystallographica Section E","2005","61","4","m757","m758","10.1107/S1600536805009037","","","0.71073","MoKα","","0.064","0.0464","","","0.111","0.1196","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205405","7.6817","0.0004","10.6398","0.0006","13.4992","0.0008","108.529","0.004","92.712","0.004","97.109","0.004","1033.67","0.1","133","2","133","2","","","","","","","","4","P -1","-P 1","2","","2-[Bis(4-methoxyphenyl)methyl]benzyl chloroacetate","","- C24 H23 Cl O4 -","- C24 H23 Cl O4 -","- C48 H46 Cl2 O8 -","2","1","BT6609","Jones, Peter G.; Kuś, Piotr; Łapok, Łukasz","2-[Bis(4-methoxyphenyl)methyl]benzyl chloroacetate","Acta Crystallographica Section E","2005","61","4","o827","o828","10.1107/S1600536805005374","","","0.71073","MoKα","","0.0557","0.0412","","","0.1056","0.1155","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205406","25.824","0.009","18.944","0.008","4.001","0.001","90","","90","","90","","1957.3","1.2","173","2","173","2","","","","","","","","2","P n a 21","P 2c -2n","33","","9-Methylene-10,10-bis(phenylethynyl)fluorene","","- C30 H18 -","- C30 H18 -","- C120 H72 -","4","1","BT6610","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Berger, Harald","9-Methylene-10,10-bis(phenylethynyl)fluorene","Acta Crystallographica Section E","2005","61","4","o829","o830","10.1107/S1600536805005623","","","0.71073","MoKα","","0.0965","0.0445","","","0.0963","0.1265","","","","","","1.098","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205407","9.8155","0.0006","11.723","0.0009","14.0699","0.0012","85.964","0.006","76.178","0.006","80.879","0.006","1551.3","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Nonaaquaneodymium(III) trichloride bis(1,3,5,7-tetraazatricyclo[3.3.1.1^3,7^]decane tetrahydrate","","- C12 H50 Cl3 N8 Nd O13 -","- C12 H48 Cl3 N8 Nd O13 -","- C24 H96 Cl6 N16 Nd2 O26 -","2","1","BT6611","Trzesowska, Agata; Kruszynski, Rafal; Bartczak, Tadeusz Jan; Zalewicz, Malgorzata","Nonaaquaneodymium(III) trichloride bis(1,3,5,7-tetraazatricyclo[3.3.1.1^3,7^]decane tetrahydrate","Acta Crystallographica Section E","2005","61","4","m625","m628","10.1107/S160053680500615X","","","0.71073","MoKα","","0.0271","0.0254","","","0.0681","0.0692","","","","","","1.087","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205408","10.3572","0.0005","11.6812","0.0005","15.5784","0.0007","90","","90","","90","","1884.75","0.15","273","2","273","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","methyl 6α-hydroxy-3,13-clerodadien-15,16-olid-18-oate","","- C21 H30 O5 -","- C21 H30 O5 -","- C84 H120 O20 -","4","1","BT6612","K. Ravikumar; B. Sridhar; Biswanath Das; K. Venkateswarlu","A clerodane diterpenoid from <i>Pulicaria wightiana</i>","Acta Crystallographica Section E","2005","61","4","o854","o856","10.1107/S1600536805005994","","","0.71073","MoKα","","0.0457","0.0433","","","0.1171","0.1204","","","","","","1.037","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205409","10.9984","0.0008","6.3486","0.0004","13.2439","0.0012","90","","99.768","0.004","90","","911.34","0.12","133","2","133","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","(3-Iodo-1-pyridinio)acetate‒iodide‒1-carboxymethyl-3-iodo-1-pyridinium‒ (1:1:1)","","- C14 H13 I3 N2 O4 -","- C14 H13 I3 N2 O4 -","- C28 H26 I6 N4 O8 -","2","0.5","BT6613","Jones, Peter G.; Cots, Berta; Zerbe, Eva-Maria","1-Carboxymethyl-3-iodo-1-pyridinium‒iodide‒(3-iodo-1-pyridinio)acetate (1/1/1)","Acta Crystallographica Section E","2005","61","4","o895","o897","10.1107/S1600536805006045","","","0.71073","MoKα","","0.0451","0.0285","","","0.0492","0.0524","","","","","","0.945","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205410","5.289","0.002","8.678","0.002","13.178","0.005","90","","96.748","0.012","90","","600.7","0.4","150","","150","","","","","","","","","3","P 1 21 1","P 2yb","4","","(3S,6R)-3-benzyloxymethyl-6-methyl-1,4-dioxane-2,5-dione","","- C13 H14 O5 -","- C13 H14 O5 -","- C26 H28 O10 -","2","1","BT6614","Kooijman, Huub; Leemhuis, Mark; Nostrum, Cornelus F. van; Hennink, Wim E.; Spek, Anthony L.","(3<i>S</i>,6<i>R</i>)-3-Benzyloxymethyl-6-methyl-1,4-dioxane-2,5-dione","Acta Crystallographica Section E","2005","61","4","o898","o900","10.1107/S1600536805006902","","","0.71073","MoKα","","0.0378","0.0309","","","0.0732","0.076","","","","","","1.073","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205411","8.944","0.002","5.94","0.001","12.559","0.003","90","","107.905","0.012","90","","634.9","0.2","150","","150","","","","","","","","","3","P 1 21 1","P 2yb","4","","(3S,6S)-3-benzyloxymethyl-6-methyl-1,4-dioxane-2,5-dione","","- C13 H14 O5 -","- C13 H14 O5 -","- C26 H28 O10 -","2","1","BT6615","Kooijman, Huub; Leemhuis, Mark; Nostrum, Cornelus F. van; Hennink, Wim E.; Spek, Anthony L.","(3<i>S</i>,6<i>S</i>)-3-Benzyloxymethyl-6-methyl-1,4-dioxane-2,5-dione","Acta Crystallographica Section E","2005","61","4","o901","o903","10.1107/S1600536805006914","","","0.71073","MoKα","","0.0431","0.0355","","","0.0903","0.0948","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205412","6.4024","0.0004","31.441","0.002","7.366","0.0005","90","","98.33","0.001","90","","1467.12","0.16","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-Methoxysalicylaldehyde 3-methoxybenzoylhydrazone","","- C16 H16 N2 O4 -","- C16 H16 N2 O4 -","- C64 H64 N8 O16 -","4","1","BT6616","Ali, Hapipah M.; Puvaneswary, Subramaniam; Basirun, Wan Jefri; Ng, Seik Weng","5-Methoxysalicylaldehyde 3-methoxybenzoylhydrazone","Acta Crystallographica Section E","2005","61","4","o947","o948","10.1107/S1600536805007154","","","0.71073","MoKα","","0.062","0.041","","","0.11","0.124","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205413","8.938","0.002","10.52","0.003","12.548","0.003","67.726","0.018","89.769","0.018","77.689","0.018","1062.9","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-Hydroxy-6-[(2-hydroxyphenylamino)methylene]cyclohexa-2,4-dienone","","- C13 H11 N O3 -","- C13 H11 N O3 -","- C52 H44 N4 O12 -","4","2","BT6617","Koşar, Başak; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","2-Hydroxy-6-[(2-hydroxyphenylamino)methylene]cyclohexa-2,4-dienone","Acta Crystallographica Section E","2005","61","4","o1097","o1099","10.1107/S160053680500807X","","","0.71073","MoKα","","0.2375","0.0976","","","0.2215","0.2955","","","","","","0.892","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205414","9.589","0.005","9.617","0.005","21.952","0.012","80.81","0.03","80.64","0.04","62.5","0.04","1763.4","1.7","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","9-Methylene-10,10-bis(phenylethynyl)fluorene‒tetracyano-para-quinodimethane (2/3)","","- C96 H48 N12 -","- C96 H48 N12 -","- C96 H48 N12 -","1","0.5","BT6618","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Berger, Harald","9-Methylene-10,10-bis(phenylethynyl)fluorene‒tetracyano-<i>para</i>-quinodimethane (2/3)","Acta Crystallographica Section E","2005","61","4","o957","o959","10.1107/S1600536805007142","","","0.71073","MoKα","","0.1621","0.0483","","","0.1042","0.1567","","","","","","1.012","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205415","10.8604","0.0005","6.6081","0.0003","16.6771","0.0008","90","","108.553","0.001","90","","1134.66","0.09","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Hexobarbitone","5-(1-Cyclohex-en-1-yl)-1,5-dimethylbarbituric acid","","- C12 H16 N2 O3 -","- C12 H16 N2 O3 -","- C48 H64 N8 O12 -","4","1","BT6620","Nichol, Gary S.; Clegg, William","5-(1-Cyclohexen-1-yl)-1,5-dimethylbarbituric acid (hexobarbitone): a low-temperature redetermination","Acta Crystallographica Section E","2005","61","4","o1004","o1006","10.1107/S1600536805007531","","","0.71073","MoKα","","0.0402","0.0355","","","0.0946","0.099","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205416","8.574","0.002","11.467","0.002","18.374","0.003","90","","101.88","0.03","90","","1767.8","0.6","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[[diaqua(imidazole)cadmium(II)]-μ-3-carboxylatophenoxyacetato] trihydrate]","","- C12 H20 Cd N2 O10 -","- C12 H20 Cd N2 O10 -","- C48 H80 Cd4 N8 O40 -","4","1","BT6621","Gao, Shan; Huo, Li-Hua; Deng, Zhao-Peng; Ng, Seik Weng","<i>catena</i>-Poly[[[diaqua(imidazole)cadmium(II)]-μ-3-carboxylatophenoxyacetato] trihydrate]","Acta Crystallographica Section E","2005","61","4","m685","m687","10.1107/S1600536805007518","","","0.71073","MoKα","","0.029","0.024","","","0.062","0.063","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205417","11.3457","0.0007","10.0117","0.0007","14.82","0.001","90","","91.372","0.001","90","","1682.92","0.19","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","poly[[cobalt(II)-di-μ~3~-formato] dimethylformamide 0.33-solvate","","- C3 H4.33 Co N0.33 O4.33 -","- C3 H4.33333 Co N0.333333 O4.33333 -","- C36 H52 Co12 N4 O52 -","12","3","BT6622","Fu, Yun-Long; Ji, Min; Shen, Xiu-Li; Ng, Seik Weng","Polymeric cobalt(II) diformate dimethylformamide 0.33-solvate","Acta Crystallographica Section E","2005","61","4","m688","m690","10.1107/S1600536805007786","","","0.71073","MoKα","","0.042","0.033","","","0.075","0.079","","","","","","0.97","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205418","8.0912","0.0006","9.6445","0.0007","11.3013","0.0008","105.477","0.001","106.119","0.001","99.227","0.001","789.9","0.1","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Bis(3-bromo-1-oxidoanthraquinone-κO^1^,O^9^)bis(pyridine-κN)zinc(II)","","- C38 H22 Br2 N2 O6 Zn -","- C38 H22 Br2 N2 O6 Zn -","- C38 H22 Br2 N2 O6 Zn -","1","0.5","BT6623","Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Koushik, Saha; Hj. Lajis, Nordin; Basirun, Wan Jefri; Ng, Seik Weng","Bis(3-bromo-1-oxidoanthraquinone-κ^2^<i>O</i>^1^,<i>O</i>^9^)bis(pyridine-κ<i>N</i>)zinc(II)","Acta Crystallographica Section E","2005","61","4","m691","m692","10.1107/S1600536805007592","","","0.71073","MoKα","","0.061","0.044","","","0.118","0.131","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205419","10.603","0.0006","9.778","0.0006","25.203","0.002","90","","90","","90","","2612.9","0.3","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-Hydroxysalicylaldehyde benzoylhydrazone","","- C14 H12 N2 O3 -","- C14 H12 N2 O3 -","- C112 H96 N16 O24 -","8","1","BT6624","Ali, Hapipah M.; Puvaneswary, Subramaniam; Basirun, Wan Jefri; Ng, Seik Weng","3-Hydroxysalicylaldehyde benzoylhydrazone","Acta Crystallographica Section E","2005","61","4","o1013","o1014","10.1107/S1600536805007555","","","0.71073","MoKα","","0.0825","0.04","","","0.1021","0.1243","","","","","","0.992","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205420","7.5025","0.0005","22.508","0.0015","11.196","0.0007","90","","101.639","0.001","90","","1851.8","0.2","273","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-[2-hydroxy-4-methoxy-5-(3-methylbut-2-enyl)phenyl]-3-(4-hydroxyphenyl)prop- 2-en-1-one","","- C21 H22 O4 -","- C21 H22 O4 -","- C84 H88 O16 -","4","1","BT6625","K. Ravikumar; B. Sridhar; P. Aparna; J. Madhusudana Rao","A polymorph of bavachalcone","Acta Crystallographica Section E","2005","61","4","o1020","o1022","10.1107/S1600536805007713","","","0.71073","MoKα","","0.0682","0.0527","","","0.1457","0.1584","","","","","","1.044","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205421","11.2143","0.0008","9.373","0.0007","11.4149","0.0009","90","","109.12","0.001","90","","1133.65","0.15","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Hydroxysalicylaldehyde 2-furoylhydrazone","","- C12 H10 N2 O4 -","- C12 H10 N2 O4 -","- C48 H40 N8 O16 -","4","1","BT6627","Ali, Hapipah M.; Puvaneswary, Subramaniam; Basirun, Wan Jefri; Ng, Seik Weng","3-Hydroxysalicylaldehyde 2-furoylhydrazone","Acta Crystallographica Section E","2005","61","4","o1079","o1080","10.1107/S1600536805008391","","","0.71073","MoKα","","0.063","0.041","","","0.11","0.127","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205422","6.7936","0.0009","16.988","0.002","21.515","0.003","90","","90","","90","","2483","0.6","295","2","295","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","(5,6-Dihydroxy-2-methyl-1-benzofuran-3-yl) phenyl ketone","","- C16 H12 O4 -","- C16 H12 O4 -","- C128 H96 O32 -","8","1","BT6628","Pei, Li-Xi; Bu, Xian-Zhang; Gu, Lian-Quan; Ng, Seik Weng","(5,6-Dihydroxy-2-methyl-1-benzofuran-3-yl) phenyl ketone","Acta Crystallographica Section E","2005","61","4","o1081","o1082","10.1107/S1600536805008408","","","0.71073","MoKα","","0.049","0.037","","","0.103","0.114","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205423","8.265","0.001","10.51","0.001","10.841","0.001","113.855","0.002","98.767","0.002","98.39","0.002","828.45","0.15","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","N-(2-Fluorobenzylidene)-2,6-diisopropylbenzenamine","","- C19 H22 F N -","- C19 H22 F N -","- C38 H44 F2 N2 -","2","1","BT6629","Gao, Hai-Yang; Lü, Xing-Qiang; Bao, Feng; Wu, Qing; Ng, Seik Weng","<i>N</i>-(2-Fluorobenzylidene)-2,6-diisopropylaniline","Acta Crystallographica Section E","2005","61","4","o1068","o1069","10.1107/S1600536805008263","","","0.71073","MoKα","","0.078","0.055","","","0.172","0.195","","","","","","1.062","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205424","9.815","0.001","23.404","0.003","18.777","0.002","90","","92.002","0.002","90","","4310.6","0.8","295","2","295","2","","","","","","","","4","C 1 c 1","C -2yc","9","","2-(2,6-Diisopropylphenylamino)cyclohex-1-enyl phenyl ketone","","- C25 H31 N O -","- C25 H31 N O -","- C200 H248 N8 O8 -","8","2","BT6630","Gui, Guo-Qiu; Bao, Feng; Lü, Xing-Qiang; Wu, Qing; Ng, Seik Weng","2-(2,6-Diisopropylphenylamino)cyclohex-1-enyl phenyl ketone","Acta Crystallographica Section E","2005","61","4","o1070","o1071","10.1107/S1600536805008135","","","0.71073","MoKα","","0.051","0.043","","","0.122","0.13","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205425","12.852","0.003","12.924","0.003","7.236","0.002","90","","91.49","0.02","90","","1201.5","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-Phenylpyridinium betaine of squaric acid","4-phenylpyridinium-3-squarate","","- C15 H9 N O3 -","- C15 H9 N O3 -","- C60 H36 N4 O12 -","4","1","BT6631","Kolev, Tonsko; Wortmann, Rüdiger; Spiteller, Michael; Sheldrick, William Steven; Mayer-Figge, Heike","4-Phenylpyridinium betaine of squaric acid","Acta Crystallographica Section E","2005","61","4","o1090","o1092","10.1107/S1600536805008457","","","0.71073","MoKα","","0.0686","0.0427","","","0.1013","0.1117","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205426","7.994","0.001","11.99","0.002","24.787","0.004","90","","90","","90","","2375.8","0.6","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","3-Hydroxysalicylaldehyde 2-thienoylhydrazone","","- C12 H10 N2 O3 S -","- C12 H10 N2 O3 S -","- C96 H80 N16 O24 S8 -","8","2","BT6632","Ali, Hapipah M.; Puvaneswary, Subramaniam; Basirun, Wan Jefri; Ng, Seik Weng","3-Hydroxysalicylaldehyde 2-thienoylhydrazone","Acta Crystallographica Section E","2005","61","4","o1083","o1084","10.1107/S160053680500841X","","","0.71073","MoKα","","0.082","0.045","","","0.104","0.121","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205427","16.9182","0.0007","29.388","0.001","10.6777","0.0004","90","","107.174","0.001","90","","5072.2","0.3","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tridecaaquadinitratohexasodium(I) bis[(trans-cyclohexane-1,2-diyldinitrilotetraacetato)nickellate(II)]","","- C14 H31 N3 Na3 Ni O17.5 -","- C14 H31 N3 Na3 Ni O17.5 -","- C112 H248 N24 Na24 Ni8 O140 -","8","1","BT6635","Long, Yu-Xiang; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","Tridecaaquadinitratohexasodium(I) bis[(<i>trans</i>-cyclohexane-1,2-diyldinitrilotetraacetato)nickelate(II)]","Acta Crystallographica Section E","2005","61","4","m790","m792","10.1107/S1600536805009359","","","0.71073","MoKα","","0.0712","0.0644","","","0.1773","0.1818","","","","","","1.095","","","","has coordinates,has Fobs","197043","2020-10-21","18:00:00",""
"2205428","24.1025","0.0004","11.0675","0.0005","19.0716","0.0002","90","","90","","90","","5087.4","0.3","295","1","","","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C30 H32 N2 O4 -","- C30 H32 N2 O4 -","- C240 H256 N16 O32 -","8","1","BV6011","Shan-Zhong Jian; Jian-Ming Gu; Yan-Guang Wang","3-[(2<i>R</i>*,3<i>S</i>*)-3-(2-Methoxyanilino)-2-methyl-3-phenylpropionyl]spiro[2<i>H</i>-1,3-benzoxazine-2,1'-cyclohexan]-4(3<i>H</i>)-one","Acta Crystallographica Section E","2005","61","4","o990","o991","10.1107/S1600536805007361","","","0.7107","MoKα","","","0.031","","","","0.063","","","","","","1.028","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205429","9.833","0.003","25.403","0.004","5.1578","0.0019","90","","90","","90","","1288.4","0.6","298","2","298","2","","","","","","","","4","P b a 2","P 2 -2ab","32","","di-n-butyldicinnamatotin(IV)","","- C26 H32 O4 Sn -","- C26 H32 O4 Sn -","- C52 H64 O8 Sn2 -","2","0.5","BV6014","Min Hong; Handong Yin; Daqi Wang","Di-<i>n</i>-butyldicinnamatotin(IV)","Acta Crystallographica Section E","2005","61","4","m746","m747","10.1107/S160053680500735X","","","0.71073","MoKα","","0.0703","0.0442","","","0.117","0.1375","","","","","","0.999","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205430","19.6113","0.0019","6.8168","0.0007","14.2923","0.0014","90","","113.551","0.002","90","","1751.5","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","[Cu(H~2~biim)~2~(H~2~O)](NO~3~)~2~","Aquabis(2,2'-biimidazole)copper(II) dinitrate","","- C12 H14 Cu N10 O7 -","- C12 H14 Cu N10 O7 -","- C48 H56 Cu4 N40 O28 -","4","0.5","BV6015","Sang, Ruili; Xu, Li","Aquabis(2,2'-biimidazole)copper(II) dinitrate","Acta Crystallographica Section E","2005","61","4","m793","m795","10.1107/S1600536805008378","","","0.71073","MoKα","","0.0465","0.0391","","","0.1212","0.1361","","","","","","1.006","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205431","9.5153","0.0003","9.5153","0.0003","6.8933","0.0002","90","","90","","90","","624.13","0.03","185","","185","","","","","","","","","3","P 42/m b c","-P 4c 2ab","135","","","","- C5 H10 O2 -","- C5 H10 O2 -","- C20 H40 O8 -","4","0.25","CF6408","Howard A. Shallard-Brown; David J. Watkin; Andrew R. Cowley","Ethyl propionate at 185K","Acta Crystallographica Section E","2005","61","4","o1118","o1120","10.1107/S1600536805005271","","","0.71073","MoKα","","0.0618","0.0618","","0.0996","0.0996","0.0996","","","","","","0.9034","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205432","15.4548","0.0004","9.0111","0.0002","16.4767","0.0005","90","","102.787","0.001","90","","2237.72","0.1","190","","190","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C45 H56 N4 O7 Si2 -","- C45 H56 N4 O7 Si2 -","- C90 H112 N8 O14 Si4 -","2","1","CF6411","Humphreys, Steven; Watkin, David J.; Sanjayan, Gangadharar J.; Tranter, George E.; Edwards, Alison A.; Fleet, George W. J.","Isopropyl 2,5-anhydro-4-(2,5-anhydro-4-azido-3-<i>O</i>-<i>tert</i>-butyldiphenylsilyl-4-deoxy-<small>L</small>-ribonylamino)-3-<i>O</i>-<i>tert</i>-butyldiphenylsilyl-4-deoxy-<small>L</small>-ribonate","Acta Crystallographica Section E","2005","61","4","o918","o919","10.1107/S1600536805006689","","","0.71073","MoKα","","0.0848","0.0848","","0.1191","0.1191","0.1191","","","","","","0.9886","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205433","6.8912","0.0003","7.3504","0.0003","13.6824","0.0006","90","","90.822","0.002","90","","692.98","0.05","190","","190","","","","","","","","","4","P 1 21 1","P 2yb","4","","2-Acetamido-N-benzyl-1,4-imino-1,2,4-trideoxy-L-ribitol","","- C14 H20 N2 O3 -","- C14 H20 N2 O3 -","- C28 H40 N4 O6 -","2","1","CF6412","Christopher C. Harding; David J. Watkin; J. S. Shane Rountree; Terry D. Butters; Mark R. Wormald; Raymond A. Dwek; George W. J. Fleet","2-Acetamido-<i>N</i>-benzyl-1,4-imino-1,2,4-trideoxy-<small>L</small>-ribitol","Acta Crystallographica Section E","2005","61","4","o930","o932","10.1107/S1600536805006926","","","0.71073","MoKα","","0.0394","0.0336","","0.0858","0.0776","0.0858","","","","","","0.8861","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205434","7.59","0.002","12.098","0.003","22.228","0.004","90","","90","","90","","2041.1","0.8","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","21-Acetoxy-17α-4-pregnene-3,20-dione","","- C23 H32 O4 -","- C23 H32 O4 -","- C92 H128 O16 -","4","1","CF6413","Raja Dey; S. Chanda; A. Pal; S. Roychowdhury","21-Acetoxy-17α-4-pregnene-3,20-dione","Acta Crystallographica Section E","2005","61","4","o980","o982","10.1107/S1600536805007415","","","1.5418","CuKα","","0.0554","0.0541","","","0.1545","0.1549","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205435","10.8823","0.0002","5.469","0.0001","15.3816","0.0002","90","","103.882","0.0011","90","","888.7","0.03","190","","190","","","","","","","","","4","P 1 21 1","P 2yb","4","","1-Amino-N,N-dibenzyl-1,6-dideoxy-β-L-fructofuranose","","- C20 H25 N O4 -","- C20 H25 N O4 -","- C40 H50 N2 O8 -","2","1","CF6414","Christopher C. Harding; David J. Watkin; David J. Hotchkiss; Joseph M.D. Cook; George W. J. Fleet","1-Amino-<i>N</i>,<i>N</i>-dibenzyl-1,6-dideoxy-β-<small>L</small>-fructofuranose","Acta Crystallographica Section E","2005","61","4","o995","o997","10.1107/S1600536805007324","","","0.71073","MoKα","","0.0424","0.0345","","0.0784","0.0744","0.0784","","","","","","0.9916","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205436","11.3352","0.0001","20.4411","0.0001","13.9594","0.0001","90","","108.303","0.001","90","","3070.81","0.04","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(Bis(diphenylphosphino)ethane)dichloro(oxo)methoxorhenium(V)","","- C28 H29 Cl4 O2 P2 Re -","- C27 H27 Cl2 O2 P2 Re -","- C108 H108 Cl8 O8 P8 Re4 -","4","1","CF6416","André L. Beauchamp; Sigouin, Olivier","[1,2-Bis(diphenylphosphino)ethane]dichloro(methoxo)oxorhenium(V) dichloromethane solvate","Acta Crystallographica Section E","2005","61","4","m736","m737","10.1107/S1600536805008718","","","1.54178","CuKα","","0.052","0.0466","","","0.1198","0.122","","","","","","1.107","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205437","8.7819","0.0008","10.2641","0.0007","10.4074","0.0012","112.034","0.008","98.297","0.008","94.009","0.007","852.58","0.15","293","2","","","","","","","","","","6","P -1","-P 1","2","","","","- C20 H12 Cl N O4 S -","- C20 H12 Cl N O4 S -","- C40 H24 Cl2 N2 O8 S2 -","2","1","CI6509","Özgen, Özen; Ceylan‒Ünlüsoy, Meltem; Bozdag̃‒Dündar, Oya; Ertan, Rahmiye; Kendi, Engin","3-(4-Chlorobenzyl)-5-(4-oxo-4<i>H</i>-chromen-3-ylmethylene)-1,3-thiazolidine-2,4-dione","Acta Crystallographica Section E","2005","61","4","o870","o872","10.1107/S1600536805006252","","","1.5418","CuKα","","","0.0482","","","","0.1254","","","","","","1.2","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205438","6.2877","0.0006","21.724","0.002","10.9742","0.0011","90","","90.39","0.002","90","","1499","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2'-(3,4-Dimethoxybenzylidene)-2-hydroxybenzohydrazide","","- C16 H16 N2 O4 -","- C16 H16 N2 O4 -","- C64 H64 N8 O16 -","4","1","CI6520","Jian-Guo Yang; Fu-You Pan","2'-(3,4-Dimethoxybenzylidene)-2-hydroxybenzohydrazide","Acta Crystallographica Section E","2005","61","4","o831","o832","10.1107/S1600536805002497","","","0.71073","MoKα","","0.0832","0.0422","","","0.081","0.0927","","","","","","0.866","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205439","21.071","0.006","10.944","0.003","25.569","0.008","90","","114.109","0.005","90","","5382","3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Triphenyl[(2-oxidobenzylideneamino)acetato]antimony(V) dichloromethane solvate","","- C28 H24 Cl2 N O3 Sb -","- C28 H24 Cl2 N O3 Sb -","- C224 H192 Cl16 N8 O24 Sb8 -","8","2","CI6523","Guo-Cang Wang; Yong-Na Lu; Lin Yu; Hai-Bin Song; Jin-Shan Li","Triphenyl[(2-oxidobenzylideneamino)acetato]antimony(V) dichloromethane solvate","Acta Crystallographica Section E","2005","61","4","m649","m651","10.1107/S1600536805006446","","","0.71073","MoKα","","0.0744","0.0416","","","0.0844","0.097","","","","","","1.079","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205440","30.958","0.007","7.9544","0.0019","14.263","0.006","90","","95.53","0.03","90","","3496","1.9","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Myricetin","5-hydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-3,7-dimethoxychromen-4-one","","- C19 H18 O8 -","- C19 H18 O8 -","- C152 H144 O64 -","8","1","CI6530","S. Etti; G. Shanmugam; M. N. Ponnuswamy; K. Balakrishna; Saradha Vasanth","5,3'-Dihydroxy-3,7,4',5'-tetramethoxyflavone","Acta Crystallographica Section E","2005","61","4","o846","o848","10.1107/S1600536805006161","","","0.71073","MoKα","","0.1381","0.0515","","","0.1296","0.1599","","","","","","0.985","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205441","7.667","0.002","22.862","0.006","14.654","0.004","90","","104.478","0.004","90","","2487","1.1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,2-Bis(2-chlorophenyl)-1,2-bis(3,4-dimethylphenyl)ethane-1,2-diol","","- C30 H28 Cl2 O2 -","- C30 H28 Cl2 O2 -","- C120 H112 Cl8 O8 -","4","0.5","CI6531","N. Sampath; S. Aravindhan; M. N. Ponnuswamy; M. Nethaji","1,2-Bis(2-chlorophenyl)-1,2-bis(3,4-dimethylphenyl)ethane-1,2-diol","Acta Crystallographica Section E","2005","61","4","o886","o888","10.1107/S1600536805006331","","","0.71073","MoKα","","0.105","0.0758","","","0.1626","0.1747","","","","","","1.169","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205442","10.5883","0.0018","11.5887","0.0018","10.014","0.0017","90","","92.904","0.003","90","","1227.2","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(2-Methoxy-5-methylphenyl) phenyl ketone","","- C15 H14 O2 -","- C15 H14 O2 -","- C60 H56 O8 -","4","1","CI6533","Malathy Sony, S. M.; Charles, P.; Ponnuswamy, M. N.; Nethaji, M.","2-Methoxy-5-methylphenyl phenyl ketone","Acta Crystallographica Section E","2005","61","4","o801","o803","10.1107/S1600536805005775","","","0.71073","MoKα","","0.1351","0.0726","","","0.1572","0.187","","","","","","1.027","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205443","9.1652","0.0013","14.716","0.002","23.596","0.003","90","","93.918","0.004","90","","3175.1","0.7","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(2-amino-7,7-dimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline- 3-carbonitrile) monohydrate","","- C18 H20 N3 O1.5 -","- C18 H20 N3 O1.5 -","- C144 H160 N24 O12 -","8","2","CI6534","Shujiang Tu; Jinpeng Zhang; Xiaotong Zhu; Jianing Xu; Qian Wang","2-Amino-7,7-dimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile hemihydrate","Acta Crystallographica Section E","2005","61","4","o983","o985","10.1107/S1600536805007403","","","0.7107","MoKα","","0.0866","0.0684","","","0.1352","0.1433","","","","","","1.167","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205444","7.273","0.001","11.298","0.002","30.344","0.005","90","","90","","90","","2493.4","0.7","286","2","286","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","17β-hydroxy-28-norolean-12-ene-3,16-dione","","- C29 H44 O3 -","- C29 H44 O3 -","- C116 H176 O12 -","4","1","CI6536","Bai, Suping; Yang, Li","17β-Hydroxy-28-norolean-12-ene-3,16-dione","Acta Crystallographica Section E","2005","61","4","o967","o968","10.1107/S1600536805007051","","","0.71073","MoKα","","0.0804","0.0419","","","0.0796","0.0889","","","","","","0.863","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205445","10.4974","0.001","10.4974","0.001","4.0967","0.0007","90","","90","","90","","451.44","0.1","150","2","150","2","","","","","","","","3","I 4","I 4","79","metaldehyde","2,4,6,8-tetramethyl-1,3,5,7-tetroxocane","","- C8 H16 O4 -","- C8 H16 O4 -","- C16 H32 O8 -","2","0.25","CI6537","Barnett, Sarah A.; Hulme, Ashley T.; Tocher, Derek A.","A low-temperature redetermination of metaldehyde","Acta Crystallographica Section E","2005","61","4","o857","o859","10.1107/S1600536805006306","","","0.71073","MoKα","","0.0289","0.0288","","","0.0732","0.0732","","","","","","1.079","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205446","15.359","0.003","13.215","0.003","12.969","0.003","90","","99.051","0.003","90","","2599.5","1","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6'-(4-Phenylpiperazin-1-yl)-1,3,3-trimethyl-2,3-dihydrospiro[1H- indole-2,3'-3H-naphth[2,1-b][1,4]oxazine]","","- C32 H32 N4 O -","- C32 H32 N4 O -","- C128 H128 N16 O4 -","4","1","CI6539","Hui Guo; Yong-Bin Gao; Yan-Xia Li; Jie Han; Ji-Ben Meng","1,3,3-Trimethyl-6'-(4-phenylpiperazin-1-yl)-2,3-dihydrospiro[1<i>H</i>-indole-2,3'-3<i>H</i>-naphth[2,1-<i>b</i>][1,4]oxazine]","Acta Crystallographica Section E","2005","61","4","o988","o989","10.1107/S1600536805007063","","","0.71073","MoKα","","0.0757","0.0453","","","0.1199","0.1392","","","","","","1.056","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205447","8.2731","0.0018","25.493","0.006","8.1129","0.0018","90","","101.443","0.003","90","","1677","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Guieranone","(E)-1-(1,3,6,8-Tetramethoxynaphthalen-2-yl)but-2-en-1-one","","- C18 H20 O5 -","- C18 H20 O5 -","- C72 H80 O20 -","4","1","CI6540","M. Iqbal Choudhary; Alain Meli Lannang; Shamsher Ali; Shazia Anjum; Fernande Ngounou Ngninzeko; David Lontsi; Hoong-Kun Fun","(<i>E</i>)-1-(1,3,6,8-Tetramethoxynaphthalen-2-yl)but-2-en-1-one","Acta Crystallographica Section E","2005","61","4","o1015","o1017","10.1107/S1600536805007646","","","0.71073","MoKα","","0.0461","0.042","","","0.1202","0.1257","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205448","12.0488","0.0008","12.1842","0.0008","12.139","0.0008","90","","104.2","0.01","90","","1727.6","0.2","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1,4-Diazoniabicyclo[2,2,2]octane hexaaquacobalt(II) bis(sulfate)","","- C6 H26 Co N2 O14 S2 -","- C6 H26 Co N2 O14 S2 -","- C24 H104 Co4 N8 O56 S8 -","4","1","CI6541","Ya-Juan Zhao; Xin-Hua Li; Shun Wang","1,4-Diazoniabicyclo[2.2.2]octane hexaaquacobalt(II) bis(sulfate)","Acta Crystallographica Section E","2005","61","4","m671","m672","10.1107/S1600536805007166","","","0.71073","MoKα","","0.0309","0.0293","","","0.0779","0.0792","","","","","","1.064","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205449","7.1123","0.0007","12.1068","0.0012","13.3174","0.0013","80.602","0.002","84.43","0.002","77.227","0.002","1101.12","0.19","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","1,4-Diazoniabicyclo[2,2,2]octane diaquabis(pyrazole-3,5-dicarboxylato)zinc(II) dihydrate","","- C16 H26 N6 O12 Zn -","- C16 H26 N6 O12 Zn -","- C32 H52 N12 O24 Zn2 -","2","1","CI6543","Xin-Hua Li; Xin-Xiang Lei; Yi-Guang Tian; Shun Wang","1,4-Diazoniabicyclo[2.2.2]octane diaquabis(pyrazole-3,5-dicarboxylato)zincate(II) dihydrate","Acta Crystallographica Section E","2005","61","4","m702","m704","10.1107/S1600536805008019","","","0.71073","MoKα","","0.0357","0.0335","","","0.0817","0.0835","","","","","","1.087","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205450","7.194","0.002","19.119","0.002","12.694","0.002","90","","95.846","0.002","90","","1736.9","0.6","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[4-Bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato- κ^3^O,N,N']methoxocobalt(III) perchlorate","","- C14 H13 Br Cl Co N2 O6 -","- C14 H13 Br Cl Co N2 O6 -","- C56 H52 Br4 Cl4 Co4 N8 O24 -","4","1","CI6545","Ma, Jun-Ying; Wu, Tong-Xing; She, Xue-Gong; Pan, Xin-Fu","[4-Bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato-κ^3^<i>O,N,N</i>']methoxocobalt(III) perchlorate","Acta Crystallographica Section E","2005","61","4","m695","m696","10.1107/S1600536805007737","","","0.71073","MoKα","","0.074","0.0473","","","0.1203","0.134","","","","","","1.035","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2205451","7.5304","0.0009","12.5739","0.0016","14.5935","0.0018","65.678","0.009","84.257","0.01","89.335","0.01","1252.2","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-({4-[3-Methyl-3-(2,4,6-trimethylphenyl)cyclobutyl]-3H-thiazol-2- ylidene}hydrazonomethyl)benzene-1,4-diol ethanol solvate","","- C26 H33 N3 O3 S -","- C26 H33 N3 O3 S -","- C52 H66 N6 O6 S2 -","2","1","CI6546","Çiğdem Yüksektepe; Mustafa Serkan Soylu; Hanife Saraçoğlu; Ibrahim Yılmaz; Alaaddin Çukurovali; Nezihe Çalıs̨kan","2-({4-[3-Methyl-3-(2,4,6-trimethylphenyl)cyclobutyl]-3<i>H</i>-thiazol-2-ylidene}hydrazonomethyl)benzene-1,4-diol ethanol solvate","Acta Crystallographica Section E","2005","61","4","o1158","o1160","10.1107/S1600536805008603","","","0.71073","MoKα","","0.079","0.0353","","","0.0682","0.0748","","","","","","0.8","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205452","13.169","0.002","4.0582","0.0006","17.651","0.003","90","","92.121","0.002","90","","942.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 5-bromosalicylate","","- C9 H9 Br O3 -","- C9 H9 Br O3 -","- C36 H36 Br4 O12 -","4","1","CI6549","Long-Fei Jin; Feng-Ping Xiao","Ethyl 5-bromosalicylate","Acta Crystallographica Section E","2005","61","4","o1105","o1106","10.1107/S1600536805008615","","","0.71073","MoKα","","0.0605","0.041","","","0.1053","0.1165","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205453","6.9648","0.0012","13.162","0.002","18.579","0.003","90","","91.015","0.004","90","","1702.9","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 5-nitrosalicylate","","- C8 H7 N O5 -","- C8 H7 N O5 -","- C64 H56 N8 O40 -","8","2","CI6550","Long-Fei Jin; Feng-Ping Xiao","Methyl 5-nitrosalicylate","Acta Crystallographica Section E","2005","61","4","o1107","o1108","10.1107/S1600536805008627","","","0.71073","MoKα","","0.1038","0.0541","","","0.1304","0.1517","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205454","4.7424","0.0007","11.3044","0.0017","18.374","0.003","90","","96.618","0.003","90","","978.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 5-nitrosalicylate","","- C9 H9 N O5 -","- C9 H9 N O5 -","- C36 H36 N4 O20 -","4","1","CI6551","Long-Fei Jin; Feng-Ping Xiao","Ethyl 5-nitrosalicylate","Acta Crystallographica Section E","2005","61","4","o1198","o1199","10.1107/S1600536805009293","","","0.71073","MoKα","","0.0922","0.0622","","","0.1899","0.2187","","","","","","1.056","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205455","6.741","0.004","9.119","0.005","20.465","0.011","90","","90","","90","","1258","1.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","7-Methyl-1-(β-D-erythro-pentofuranosyl)-1H-benzimidazol-2(3H)-one","","- C13 H16 N2 O5 -","- C13 H16 N2 O5 -","- C52 H64 N8 O20 -","4","1","CI6552","Qi, Ji; Hui, Guo; Hai-Bin, Song; Fei, Huang; Ji-Ben, Meng","7-Methyl-1-(β-<small>D</small>-<i>erythro</i>-pentofuranosyl)-1<i>H</i>-benzimidazol-2(3<i>H</i>)-one","Acta Crystallographica Section E","2005","61","4","o1147","o1149","10.1107/S1600536805009177","","","0.71073","MoKα","","0.0379","0.0306","","","0.0782","0.0804","","","","","","1.093","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205456","6.126","0.002","8.405","0.002","30.985","0.005","90","","92.275","0.003","90","","1594.1","0.7","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-[2-(dimethylammonio)ethyliminiomethyl]naphthalen-2-olate perchlorate","","- C15 H19 Cl N2 O5 -","- C15 H19 Cl N2 O5 -","- C60 H76 Cl4 N8 O20 -","4","1","CI6554","Yuan, Chun-Lan","A perchlorate salt of 1-[(2-dimethylaminoethylimino)methyl]naphthalen-2-ol","Acta Crystallographica Section E","2005","61","4","o1182","o1183","10.1107/S1600536805009499","","","0.71073","MoKα","","0.1147","0.0801","","","0.1719","0.1897","","","","","","1.1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205457","8.6247","0.0008","8.8862","0.0009","12.7604","0.0012","78.81","0.002","89.371","0.002","81.935","0.002","949.75","0.16","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","trans-Bis[4-(4-methoxylphenyl)-3,5-di-2-pyridyl-4H-1,2,4-triazole- κN^1^]dithiocyanatocobalt(II)","","- C40 H30 Co N12 O2 S2 -","- C40 H30 Co N12 O2 S2 -","- C40 H30 Co N12 O2 S2 -","1","0.5","CI6555","Zhang, Shu-Ping; Shao, Si-Chang; Liu, Zhao-Di; Zhu, Hai-Liang","<i>trans</i>-Bis[4-(4-methoxyphenyl)-3,5-di-2-pyridyl-4<i>H</i>-1,2,4-triazole-κ<i>N</i>^1^]dithiocyanatocobalt(II)","Acta Crystallographica Section E","2005","61","4","m799","m800","10.1107/S1600536805009402","","","0.71073","MoKα","","0.0658","0.0569","","","0.1548","0.1864","","","","","","1.212","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205458","11.656","0.003","9.96","0.003","18.796","0.005","90","","97.776","0.005","90","","2162","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-tert-Butyl-2-(4-ethylbenzoyl)-1-(2-mercapto-3,5-dimethylbenzoyl)hydrazine","","- C22 H28 N2 O2 S -","- C22 H28 N2 O2 S -","- C88 H112 N8 O8 S4 -","4","1","CV6453","Shang, Jian; Wang, Qing-Min; Huang, Run-Qiu; Chen, Li; Song, Hai-Bin; Mao, Chun-Hui","1-<i>tert</i>-Butyl-2-(4-ethylbenzoyl)-1-(2-mercapto-3,5-dimethylbenzoyl)hydrazine","Acta Crystallographica Section E","2005","61","4","o1043","o1045","10.1107/S1600536805008123","","","0.71073","MoKα","","0.1437","0.0595","","","0.1418","0.1759","","","","","","0.99","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205459","10.3133","0.0008","22.7193","0.0018","8.5237","0.0007","90","","104.58","0.001","90","","1932.9","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","5-(2-Chlorobenzamido)-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]- 1H-pyrazole-3-carbonitrile","","- C18 H8 Cl3 F3 N4 O -","- C18 H8 Cl3 F3 N4 O -","- C72 H32 Cl12 F12 N16 O4 -","4","1","CV6454","Xiaohong,Zhang; Ping, Zhong; Zhiping, Yang; Maolin, Hu; Hongping, Xiao","5-(2-Chlorobenzamido)-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","4","o806","o807","10.1107/S1600536805005763","","","0.71073","MoKα","","0.0628","0.0539","","","0.1201","0.1248","","","","","","1.112","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205460","21.077","0.006","9.971","0.003","37.485","0.012","90","","98.121","0.009","90","","7799","4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1-[2-(Biphenyl-4-yl)-2-oxoethyl]-4-(N,N-dimethylamino)pyridinium bromide hemihydrate","","- C21 H22 Br N2 O1.5 -","- C21 H22 Br N2 O1.5 -","- C336 H352 Br16 N32 O24 -","16","2","CV6458","Sundar, T. V.; Parthasarathi, V.; Sarkunam, K.; Nallu, M.; Walfort,B.; Lang, H.","1-[2-(Biphenyl-4-yl)-2-oxoethyl]-4-(<i>N,N</i>-dimethylamino)pyridinium bromide hemihydrate","Acta Crystallographica Section E","2005","61","4","o889","o891","10.1107/S1600536805006471","","","0.71073","MoKα","","0.1297","0.0555","","","0.1145","0.1399","","","","","","1.01","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205461","9.7846","0.0017","16.865","0.003","6.8914","0.0012","90","","103.934","0.003","90","","1103.7","0.3","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N-Methylcorydaldine","6,7-Dimethoxy-2-methyl-3,4-dihydroisoquinolin-1(2H)-one","","- C12 H15 N O3 -","- C12 H15 N O3 -","- C48 H60 N4 O12 -","4","1","CV6461","Said, Ikram M.; Hamid, Norizan. A. A.; Latif, Jalifah; Din, Laily B.; Yamin, Bohari M.","6,7-Dimethoxy-2-methyl-3,4-dihydroisoquinolin-1(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","4","o797","o798","10.1107/S1600536805005787","","","0.71073","MoKα","","0.081","0.058","","","0.133","0.145","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205462","11.734","0.0019","10.3824","0.0017","36.162","0.006","90","","95.382","0.003","90","","4386.1","1.2","294","2","294","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Bis(pyrimidine-2-thiolato)bis(triphenylphosphine)ruthenium(II) chloroform solvate","","- C45 H37 Cl3 N4 P2 Ru S2 -","- C45 H37 Cl3 N4 P2 Ru S2 -","- C180 H148 Cl12 N16 P8 Ru4 S8 -","4","1","CV6463","Zhengkai Li; Jin Zhao; Lei Liang; Xiangge Zhou","Bis(pyrimidine-2-thiolato)bis(triphenylphosphine)ruthenium(II) chloroform solvate","Acta Crystallographica Section E","2005","61","4","m714","m716","10.1107/S1600536805008214","","","0.71073","MoKα","","0.0697","0.0404","","","0.0762","0.0831","","","","","","1.027","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205463","6.677","0.002","10.794","0.003","22.608","0.007","90","","90","","90","","1629.4","0.8","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Isocrotocaudin","ent-(8S,10R)-15,16-epoxy-19-norcleroda-4,11,13(16),14-tetraene- 18,6(R):20,12-diolactone","","- C19 H18 O5 -","- C19 H18 O5 -","- C76 H72 O20 -","4","1","CV6464","Said, Ikram M.; Noor, Ainal F. A.; Syah, Yana M.; Latif, Jalifah; Ngah, Nurziana; Yamin, Bohari M.","<i>ent</i>-(8<i>S</i>,10<i>R</i>)-15,16-Epoxy-19-norcleroda-4,11,13(16),14-tetraene-18,6(<i>R</i>):20,12-diolactone (isocrotocaudin)","Acta Crystallographica Section E","2005","61","4","o1035","o1037","10.1107/S1600536805007725","","","0.71073","MoKα","","0.068","0.056","","","0.11","0.113","","","","","","1.18","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205464","6.0163","0.0004","29.332","0.003","9.1726","0.0008","90","0.007","90","0.007","90","0.007","1618.7","0.2","122","1","122","1","","","","","","","","4","P n a 21","P 2c -2n","33","2-(4-bromophenyl)-1-methyl-1H-phenanthro[9,10-d]imidazole","2-(4-bromophenyl)-1-methyl-1H-phenanthro[9,10-d]imidazole","","- C22 H15 Br N2 -","- C22 H15 Br N2 -","- C88 H60 Br4 N8 -","4","1","CV6465","Christian B. Nielsen; Michael Pittelkow; Henning O. Sørensen","2-(4-Bromophenyl)-1-methyl-1<i>H</i>-phenanthro[9,10-<i>d</i>]imidazole","Acta Crystallographica Section E","2005","61","4","o955","o956","10.1107/S1600536805007002","","","0.71073","MoKα","","0.0287","0.0238","","","0.054","0.0571","","","","","","1.148","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205465","8.1402","0.0016","9.3393","0.0019","11.206","0.002","107.047","0.003","103.066","0.004","106.257","0.003","736.5","0.2","289","2","289","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 6-amino-5-cyano-2-methyl-4-phenyl-4H-pyran-3-carboxylate","","- C16 H16 N2 O3 -","- C16 H16 N2 O3 -","- C32 H32 N4 O6 -","2","1","CV6466","Li, Yuling; Wang, Xiangshan; Zeng, Zhaosen; Shi, Daqing; Wei, Xianyong; Zong, Zhimin","Ethyl 6-amino-5-cyano-2-methyl-4-phenyl-4<i>H</i>-pyran-3-carboxylate","Acta Crystallographica Section E","2005","61","4","o1115","o1117","10.1107/S1600536805008858","","","0.71073","MoKα","","0.0616","0.0436","","","0.102","0.1104","","","","","","0.968","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205466","8.625","0.0017","9.639","0.0019","26.273","0.005","90","","91.28","0.03","90","","2183.7","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 3-dimethylamino-2-(2-{2-dimethylamino-1-[3-(3-pyridyl)-1,2,4-oxadiazol- 5-yl]vinyloxy}phenyl)acrylate","","- C23 H25 N5 O4 -","- C23 H25 N5 O4 -","- C92 H100 N20 O16 -","4","1","CV6467","Wang, Hai-Bo; Chen, Jia-Hui; Pu, Yue-Qing; Wang, Jin-Tang","Methyl 3-dimethylamino-2-(2-{2-dimethylamino-1-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]vinyloxy}phenyl)acrylate","Acta Crystallographica Section E","2005","61","4","o1010","o1012","10.1107/S160053680500766X","","","0.71073","MoKα","","0.1152","0.0527","","","0.139","0.1823","","","","","","0.926","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205467","4.5421","0.0004","15.3996","0.0015","15.3471","0.0013","90","","96.605","0.007","90","","1066.35","0.17","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(3-Chloropropyl)-2,3-dihydro-1H-isoindole-1,3-dione","","- C11 H10 Cl N O2 -","- C11 H10 Cl N O2 -","- C44 H40 Cl4 N4 O8 -","4","1","CV6468","Nagaraj, Basavegowda; Yathirajan, Hemmige S.; Bolte, Michael","2-(3-Chloropropyl)-2,3-dihydro-1<i>H</i>-isoindole-1,3-dione","Acta Crystallographica Section E","2005","61","4","o928","o929","10.1107/S1600536805006550","","","0.71073","MoKα","","0.0323","0.0289","","","0.0716","0.0736","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205468","7.5953","0.0015","14.582","0.003","10.616","0.002","90","","90.61","0.016","90","","1175.7","0.4","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4'-Methylbiphenyl-2-carboxylic acid","","- C14 H12 O2 -","- C14 H12 O2 -","- C56 H48 O8 -","4","1","CV6469","Narasegowda, Rajenahally S.; Yathirajan, Hemmige S.; Bolte, Michael","4'-Methylbiphenyl-2-carboxylic acid","Acta Crystallographica Section E","2005","61","4","o939","o940","10.1107/S1600536805006744","","","0.71073","MoKα","","0.0571","0.0318","","","0.0699","0.0771","","","","","","0.878","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205469","7.768","0.003","8.497","0.003","9.342","0.004","115.572","0.006","99.093","0.006","106.548","0.006","504.2","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","3-(4-Bromo-1H-pyrrole-2-carboxamido)propanoic acid","","- C8 H9 Br N2 O3 -","- C8 H9 Br N2 O3 -","- C16 H18 Br2 N4 O6 -","2","1","CV6470","Xiang-Chao Zen; Shi-Hai Xu; Po-Run Liu; Jian Gu","3-(4-Bromo-1<i>H</i>-pyrrole-2-carboxamido)propanoic acid","Acta Crystallographica Section E","2005","61","4","o1076","o1078","10.1107/S1600536805008299","","","0.71069","MoKα","","0.0428","0.0384","","","0.1002","0.1036","","","","","","1.049","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205470","5.094","0.0009","5.2911","0.001","30.759","0.006","90","","91.067","0.003","90","","828.9","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,6-Bis(pyridine-4-carboxamido)hexane","","- C18 H22 N4 O2 -","- C18 H22 N4 O2 -","- C36 H44 N8 O4 -","2","0.5","CV6474","Cai-Feng Ding; Mei Zhu; Xue-Mei Li; Shu-Sheng Zhang; Hong Xu; Ping-Kai Ouyang","1,6-Bis(pyridine-4-carboxamido)hexane","Acta Crystallographica Section E","2005","61","4","o1103","o1104","10.1107/S1600536805008688","","","0.71073","MoKα","","0.0496","0.0413","","","0.1066","0.1131","","","","","","1.074","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205471","10.114","0.015","10.537","0.015","20.92","0.03","90","","95.56","0.03","90","","2219","6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5,5'-[(p-phenylenedimethylene)dithio]bis(1-phenyl-1H-1,2,3,4-tetrazole)","","- C22 H18 N8 S2 -","- C22 H18 N8 S2 -","- C88 H72 N32 S8 -","4","1","CV6479","Wei Wang; Bing Zhao; Peng-Wu Zheng; Xue-Min Duan","5,5'-[(<i>p</i>-Phenylenedimethylene)dithio]bis(1-phenyl-1<i>H</i>-1,2,3,4-tetrazole)","Acta Crystallographica Section E","2005","61","4","o1163","o1164","10.1107/S1600536805009001","","","0.71073","MoKα","","0.0698","0.0398","","","0.1068","0.1288","","","","","","1.063","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205472","8.8654","0.0015","21.938","0.004","6.7526","0.0012","90","","94.967","0.002","90","","1308.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(4,6-Dimethylpyrimidin-2-ylsulfanyl)-3,3-dimethylbutan-2-one","","- C12 H18 N2 O S -","- C12 H18 N2 O S -","- C48 H72 N8 O4 S4 -","4","1","CV6481","Liang-Zhong Xu; Xi-Liu Ma; Hai-Bin Song; Qi Zhu; Ya-Xun Yang","1-(4,6-Dimethylpyrimidin-2-ylsulfanyl)-3,3-dimethylbutan-2-one","Acta Crystallographica Section E","2005","61","4","o1180","o1181","10.1107/S1600536805009372","","","0.71073","MoKα","","0.0762","0.0437","","","0.1047","0.1215","","","","","","1.03","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205473","11.852","0.002","12.458","0.001","6.3861","0.0006","90","","113.84","0.01","90","","862.5","0.2","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","sodium calcium magnesium iron phosphate","","- Ca0.31 Fe2 Mg Na0.38 O12 P3 -","- Ca0.312 Fe2 Mg Na0.376 O12 P3 -","- Ca1.248 Fe8 Mg4 Na1.504 O48 P12 -","4","0.5","DN6200","Zid, Mohamed Faouzi; Driss, Ahmed; Jouini, Tahar","(Na~0.38~,Ca~0.31~)MgFe~2~P~3~O~12~","Acta Crystallographica, Section E","2005","61","4","i46","i48","10.1107/S1600536805006756","","","0.71073","MoKα","","0.041","0.0309","","","0.0829","0.0881","","","","","","1.11","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205474","12.9562","0.0002","10.6502","0.0002","13.3251","0.0002","90","","114.032","0.001","90","","1679.3","0.05","292","2","292","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","piperazinediium hexaaquazinc(II) bis(sulfate)","Piperazinediium hexaaquazinc(II) bis(sulfate)","","- C4 H24 N2 O14 S2 Zn -","- C4 H24 N2 O14 S2 Zn -","- C16 H96 N8 O56 S8 Zn4 -","4","1","DN6201","Rekik, Walid; Naïli, Houcine; Mhiri, Tahar; Bataille, Thierry","Piperazinediium hexaaquazinc(II) bis(sulfate): a structural analogue of Tutton's salts","Acta Crystallographica Section E","2005","61","4","m629","m631","10.1107/S1600536805005982","","","0.71073","MoKα","","0.0699","0.0441","","","0.1105","0.1261","","","","","","1.035","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205475","5.369","0.002","10.456","0.004","11.357","0.005","107.554","0.005","96.246","0.005","94.581","0.006","600","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4,4'-Bipyridinium dipicrate","","- C22 H14 N8 O14 -","- C22 H14 N8 O14 -","- C22 H14 N8 O14 -","1","0.5","DN6203","Lu-Fang Ma; Bang-Tun Zhao; Li-Ya Wang","4,4'-Bipyridinium dipicrate","Acta Crystallographica Section E","2005","61","4","o964","o966","10.1107/S1600536805006999","","","0.71073","MoKα","","0.052","0.0346","","","0.0931","0.0985","","","","","","1.058","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205476","10.263","0.002","10.737","0.002","12.623","0.003","86.48","0.03","86.2","0.03","66.81","0.03","1274.8","0.5","295","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H19 N4 O7 V -","- C27 H19 N4 O7 V -","- C54 H38 N8 O14 V2 -","2","1","DN6204","Gao, Shan; Huo, Li-Hua; Zhang, Xian-Fa; Ng, Seik Weng","(<i>N</i>-Hydroxy-<i>N</i>-phenylbenzamidato-κ^2^<i>O</i>,<i>O</i>')oxo[salicylaldehyde (4-nitrobenzoyl)hydrazonato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']vanadium(V)","Acta Crystallographica Section E","2005","61","4","m738","m739","10.1107/S1600536805008846","","","0.71073","MoKα","","0.0559","0.0462","","","0.1359","0.143","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205477","9.975","0.0005","14.6856","0.0007","10.1388","0.0005","90","","116.812","0.002","90","","1325.55","0.12","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(Z)-3-(4-Methoxybenzylidene)-2-methylisoindolin-1-one","","- C17 H15 N O2 -","- C17 H15 N O2 -","- C68 H60 N4 O8 -","4","1","DN6206","Warzecha, Klaus-Dieter; Neudörfl, Jörg M.; Griesbeck, Axel G.","(<i>Z</i>)-3-(4-Methoxybenzylidene)-2-methylisoindolin-1-one","Acta Crystallographica Section E","2005","61","4","o1074","o1075","10.1107/S1600536805008238","","","0.71073","MoKα","","0.0694","0.0446","","","0.1069","0.1162","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205478","6.5001","0.0008","11.5624","0.0014","12.7093","0.0015","90","","92.179","0.002","90","","954.5","0.2","110","","110","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(±)-1,8,8-Trimethyl-3-oxabicyclo[3.2.1]octane-2,4-dione","","- C10 H14 O3 -","- C10 H14 O3 -","- C40 H56 O12 -","4","1","DN6207","Kgomo, Ditebogo B.; Levendis, Demetrius C.; Gukasov, Arsen; Cousson, Alain; Schöning, Ludwig F. R.; Venter, Andrew M.","Low-temperature (110K) single-crystal neutron diffraction study of (±)-camphoric anhydride","Acta Crystallographica Section E","2005","61","4","o1141","o1143","10.1107/S1600536805008950","","neutron","0.833","neutron","","0.0844","0.059","","0.0627","0.0566","0.0566","","","","","","1.1006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205479","8.9729","0.0004","22.6232","0.0009","9.9288","0.0005","90","","106.427","0.004","90","","1933.23","0.16","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4'-(2-Butyl-4-chloro-5-formylimidazol-1-ylmethyl)biphenyl-2-carbonitrile","","- C22 H20 Cl N3 O -","- C22 H20 Cl N3 O -","- C88 H80 Cl4 N12 O4 -","4","1","DN6209","Yathirajan, Hemmige S.; Nagaraj, Basavegowda; Narasegowda, Rajenahally S.; Nagaraja, Padmarajaiah; Bolte, Michael","4'-(2-Butyl-4-chloro-5-formylimidazol-1-ylmethyl)biphenyl-2-carbonitrile","Acta Crystallographica Section E","2005","61","4","o1193","o1195","10.1107/S1600536805009487","","","0.71073","MoKα","","0.0463","0.0419","","","0.1086","0.1116","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205480","11.9515","0.0009","8.1082","0.0004","15.1665","0.001","90","","95.359","0.006","90","","1463.29","0.16","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-(1-Benzofuran-2-yl)ethanone O-(2-chlorobenzoyl)oxime","","- C17 H12 Cl N O3 -","- C17 H12 Cl N O3 -","- C68 H48 Cl4 N4 O12 -","4","1","DN6210","Ocak Ískeleli, Nazan; Kazak, Canan; Kırılmış, Cumhur; Koca, Murat","1-(1-Benzofuran-2-yl)ethanone <i>O</i>-(2-chlorobenzoyl)oxime","Acta Crystallographica Section E","2005","61","4","o1205","o1206","10.1107/S160053680500975X","","","0.71073","MoKα","","0.0492","0.0324","","","0.0728","0.0776","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205481","11.2528","0.0002","14.3549","0.0003","20.7998","0.0005","90","","90","","90","","3359.85","0.12","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3S,4S,5S,10S,13R,14R,17R)-4α,14α-Dimethyl-3β-tosyl-5α-cholest-8-ene- 7,11-dione","","- C36 H52 O5 S -","- C36 H52 O5 S -","- C144 H208 O20 S4 -","4","1","DN6211","Auhmani, A.; Giorgi, M.; Mazoir, N.","(3<i>S</i>,4<i>S</i>,5<i>S</i>,10<i>S</i>,13<i>R</i>,14<i>R</i>,17<i>R</i>)-4α,14α-Dimethyl-3β-tosyl-5α-cholest-8-ene-7,11-dione","Acta Crystallographica Section E","2005","61","4","o1190","o1192","10.1107/S1600536805009761","","","0.71073","MoKα","","0.0683","0.0564","","","0.142","0.1561","","","","","","1.081","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205482","3.9834","0.001","25.373","0.007","7.465","0.002","90","","101.38","0.004","90","","739.7","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2-(methylsulfanyl)nicotinic acid","2-(methylsulfanyl)nicotinic acid","","- C7 H7 N O2 S -","- C7 H7 N O2 S -","- C28 H28 N4 O8 S4 -","4","1","FL6150","Srinivas Basavoju; C. Malla Reddy; Gautam R. Desiraju","2-(Methylsulfanyl)nicotinic acid","Acta Crystallographica Section E","2005","61","4","o822","o823","10.1107/S1600536805005568","","","0.71073","MoKα","","0.0868","0.0706","","","0.1678","0.1767","","","","","","1.099","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205483","9.7553","0.0009","9.7554","0.0009","11.7319","0.0011","68.582","0.001","68.58","0.001","69.34","0.01","936.05","0.16","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","5-{[(4-Chlorophenyl)methylene]amino}-1-[2,6-dichloro-4- (trifluoromethyl)phenyl]-1H-pyrazole-3-carbonitrile","","- C18 H8 Cl3 F3 N4 -","- C18 H8 Cl3 F3 N4 -","- C36 H16 Cl6 F6 N8 -","2","1","FL6153","Yang, Zhiping; Zhong, Ping; Shi, Qian; Tang, Riyuan; Li, Shuyan","5-{[(4-Chlorophenyl)methylene]amino}-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","4","o949","o950","10.1107/S1600536805007075","","","0.71073","MoKα","","0.0616","0.0503","","","0.1267","0.1346","","","","","","1.028","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205484","13.2451","0.0019","21.668","0.004","12.664","0.002","90","","91.69","0.02","90","","3632.9","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-{(E)-3-[(E)-4-chlorophenylimino]-4-hydroxyphenyldiazenyl}benzoic acid hemihydrate","","- C20 H15 Cl N3 O3.5 -","- C20 H15 Cl N3 O3.5 -","- C160 H120 Cl8 N24 O28 -","8","1","GH6012","Butcher, Ray J.; Basu Baul, Tushar S.; Singh, Keisham Surjit; Smith, Frank E.","A quasi-planar polyaromatic compound containing an azo and a Schiff base linkage","Acta Crystallographica Section E","2005","61","4","o1007","o1009","10.1107/S1600536805007373","","","1.54178","CuKα","","0.1404","0.0761","","","0.1585","0.2159","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205485","5.4066","0.0007","10.3363","0.0014","17.434","0.002","90","","90","","90","","974.3","0.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Diacetyltartaric acid anhydride","","- C8 H8 O7 -","- C8 H8 O7 -","- C32 H32 O28 -","4","1","GH6017","Zhao-Bin Qi; Ming-Jie Zhang; Dong-Yan Yuan; Shan-Shan Ma; Xiang-Qian Wang","(2<i>R</i>,3<i>R</i>)-Diacetyltartaric acid anhydride","Acta Crystallographica Section E","2005","61","4","o1085","o1086","10.1107/S1600536805008469","","","0.71073","MoKα","","0.0454","0.0351","","","0.095","0.0996","","","","","","1.071","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205486","7.2959","0.0007","9.4843","0.0009","16.0204","0.0016","90","","90","","90","","1108.56","0.19","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-2-amino-1-butanol (2R,3R)-tartrate","","- C8 H17 N O7 -","- C8 H17 N O7 -","- C32 H68 N4 O28 -","4","1","GH6018","Bai, Guo-Yi; Chen, Li-Gong; Li, Yang; Yan, Xi-Long; Xing, Peng; Dong, Chuan-Ming; Duan, Xue-Min; Zhang, Yue-Cheng; Ge, Feng-Yan","(<i>S</i>)-2-Ammoniobutan-1-ol (2<i>R</i>,3<i>R</i>)-tartrate","Acta Crystallographica Section E","2005","61","4","o1125","o1126","10.1107/S1600536805008767","","","0.71073","MoKα","","0.0328","0.0303","","","0.0814","0.0828","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205487","7.1361","0.0012","17.251","0.003","19.541","0.003","90","","90","","90","","2405.6","0.7","110","2","110","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Tricarbonyl[η^6^-(S,S)-1-[2-methoxy-3,6-bis(trimethylsilyl)phenyl]-N,N- dimethylethylamine]chromium(0)","","- C20 H33 Cr N O4 Si2 -","- C20 H33 Cr N O4 Si2 -","- C80 H132 Cr4 N4 O16 Si8 -","4","1","HB6159","Braun, Wolfgang; Calmuschi, Beatrice; Totev, Daniel; Salzer, Albrecht","Tricarbonyl{η^6^-(<i>S,S</i>)-1-[2-methoxy-3,6-bis(trimethylsilyl)phenyl]-<i>N,N</i>-dimethylethylamine}chromium(0)","Acta Crystallographica Section E","2005","61","4","m647","m648","10.1107/S1600536805006008","","","0.71073","MoKα","","0.0419","0.0328","","","0.0693","0.0843","","","","","","0.921","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205488","14.011","0.003","13.247","0.002","12.701","0.002","90","","106.834","0.015","90","","2256.3","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","diaquadi-μ-cyano-dicyanodimethanolbis[N,N'-o-phenylenebis(pyridine-2- carboxamidato)]diiron(III)manganese(II)","","- C42 H40 Fe2 Mn N12 O10 -","- C42 H40 Fe2 Mn N12 O10 -","- C84 H80 Fe4 Mn2 N24 O20 -","2","0.5","HB6160","Ni, Zhong-Hai; Kou, Hui-Zhong; Zhang, Li-Fang; Jiang, Yun-Bo; Cui, Ai-Li","A cyano-bridged trimeric complex [Mn(CH~3~OH)~2~(H~2~O)~2~][Fe(bpb)(CN)~2~]~2~·2H~2~O [bpb^2{-^} is 1,2-bis(pyridine-2-carboxamido)benzenate]","Acta Crystallographica Section E","2005","61","4","m796","m798","10.1107/S1600536805009530","","","0.71073","MoKα","","0.0392","0.034","","","0.1029","0.112","","","","","","1.083","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205489","8.7122","0.0019","10.4","0.002","12.007","0.003","93.292","0.003","107.373","0.002","112.457","0.002","941.2","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","tetraammonium octamolybdate bis(2-methylbenzimidazole),","","- C16 H32 Mo8 N8 O26 -","- C16 H32 Mo8 N8 O26 -","- C16 H32 Mo8 N8 O26 -","1","0.5","HB6161","Feng, Si-Si; Lu, Li-Ping; Zhang, Hong-Mei; Qin, Shi-Dong; Li, Xue-Mei; Zhu, Miao-Li","A co-crystal of 2-methylbenzimidazole and ammonium octamolybdate","Acta Crystallographica Section E","2005","61","4","m659","m661","10.1107/S1600536805006677","","","0.71073","MoKα","","0.0363","0.0315","","","0.0861","0.0888","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205490","5.4094","0.0005","7.4222","0.0008","9.4238","0.0014","110.151","0.008","105.133","0.011","92.302","0.007","339.33","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Tetraaquabis(hydrogen maleato)cadmium(II)","","- C8 H14 Cd O12 -","- C8 H14 Cd O12 -","- C8 H14 Cd O12 -","1","0.5","HB6162","Liu, Yong","Tetraaquabis(hydrogen maleato)cadmium(II)","Acta Crystallographica Section E","2005","61","4","m669","m670","10.1107/S1600536805007208","","","0.71073","MoKα","","0.0189","0.0189","","","0.0492","0.0492","","","","","","1.113","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205491","26.88","0.004","8.009","0.0011","18.294","0.003","90","","123.836","0.008","90","","3271.3","0.9","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","Bis(tetraethylammonium) bis(2-thioxo-1,3-dithiole-4,5-dithiolato)copper(II)","","- C22 H40 Cu N2 S10 -","- C22 H40 Cu N2 S10 -","- C88 H160 Cu4 N8 S40 -","4","1","HB6163","Wang, Xin-Qiang; Yu, Wen-Tao; Xu, Dong; Wang, Yan-Ling; Li, Ting-Bin; Zhang, Guang-Hui; Sun, Xiang-Bin; Ren, Quan","Bis(tetraethylammonium) bis(2-thioxo-1,3-dithiole-4,5-dithiolato)cuprate(II)","Acta Crystallographica Section E","2005","61","4","m717","m719","10.1107/S1600536805008159","","","0.71073","MoKα","","0.1071","0.0506","","","0.096","0.1184","","","","","","0.953","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205492","7.686","0.003","13.498","0.005","12.808","0.004","90","","93.138","0.007","90","","1326.8","0.8","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(imidazolium) tetrachlorocobaltate(II)","","- C6 H10 Cl4 Co N4 -","- C6 H10 Cl4 Co N4 -","- C24 H40 Cl16 Co4 N16 -","4","1","HB6164","Zhang, Hui; Fang, Liang; Yuan, Runzhang","Bis(imidazolium) tetrachlorocobaltate(II)","Acta Crystallographica Section E","2005","61","4","m677","m678","10.1107/S1600536805007452","","","0.71073","MoKα","","0.0551","0.0349","","","0.0733","0.0789","","","","","","0.894","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205493","10.128","0.002","15.038","0.003","24.586","0.005","90","","99.7","0.03","90","","3691","1.3","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Chlorobis[2-(2-pyridyl)phenyl-κ^2^N,C^1^](triphenylphosphine- κP)iridium(III)‒dichloromethane (2/3)","","- C41.5 H34 Cl4 Ir N2 P -","- C41.5 H34 Cl4 Ir N2 P -","- C166 H136 Cl16 Ir4 N8 P4 -","4","1","HB6165","Wang, Yuanmin; Teng, Feng; Tang, Aiwei; Wang, Yongsheng; Xu, Xurong","Chlorobis[2-(2-pyridyl)phenyl-κ^2^<i>N,C</i>^1^](triphenylphosphine-κ<i>P</i>)iridium(III) dichloromethane sesquisolvate","Acta Crystallographica Section E","2005","61","4","m778","m780","10.1107/S1600536805008913","","","0.71073","MoKα","","0.0752","0.0506","","","0.1118","0.1198","","","","","","0.958","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205494","7.941","0.002","12.199","0.002","9.804","0.002","90","","118.18","0.03","90","","837.2","0.4","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2,2'-Bipyrimidinium hexachlororhenate(IV) dihydrate","","- C8 H12 Cl6 N4 O2 Re -","- C8 H12 Cl6 N4 O2 Re -","- C16 H24 Cl12 N8 O4 Re2 -","2","0.5","HB6166","Andrzej Kochel","2,2'-Bipyrimidinium hexachlororhenate(IV) dihydrate","Acta Crystallographica Section E","2005","61","4","m759","m760","10.1107/S1600536805008937","","","0.71073","MoKα","","0.0469","0.0276","","","0.0536","0.0573","","","","","","1.074","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205495","11.045","0.0011","12.3699","0.0011","13.0539","0.0015","90","","113.148","0.01","90","","1639.9","0.3","153","2","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,5-dimethylpiperazinediium β-octamolybdate","","- C12 H32 Mo8 N4 O26 -","- C12 H32 Mo8 N4 O26 -","- C24 H64 Mo16 N8 O52 -","2","0.5","HB6167","Muller, Eric A.; Narducci Sarjeant, Amy; Norquist, Alexander J.","(C~6~H~16~N~2~)~2~[Mo~8~O~26~]: a new β-octamolybdate salt","Acta Crystallographica Section E","2005","61","4","m730","m732","10.1107/S1600536805008330","","","0.71073","MoKα","","0.0857","0.0429","","0.1104","0.0954","0.0954","","","","","","0.8516","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205496","7.2316","0.0003","10.5151","0.0004","13.4031","0.0005","90.5","0.002","103.127","0.003","100.594","0.0018","974.28","0.07","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","Tetraaquabis(1,4-di-4-pyridyl-2,3-diaza-1,3-butadiene)zinc(II) bis(perchlorate)","","- C24 H28 Cl2 N8 O12 Zn -","- C24 H28 Cl2 N8 O12 Zn -","- C24 H28 Cl2 N8 O12 Zn -","1","0.5","HB6169","Einat Tirosh; Rozi Maman; Israel Goldberg","Tetraaquabis(1,4-di-4-pyridyl-2,3-diaza-1,3-butadiene)zinc(II) bis(perchlorate) and its supramolecular assembly","Acta Crystallographica Section E","2005","61","4","m751","m754","10.1107/S1600536805008962","","","0.71073","MoKα","","0.0775","0.0578","","","0.1425","0.1517","","","","","","1.099","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205497","12.7022","0.0008","11.705","0.001","20.493","0.001","90","","105.049","0.003","90","","2942.4","0.3","297","2","297","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","chlorotriphenyl[3-(piperidinium-1-yl)propionato]tin(V) chloroform solvate","","- C27 H31 Cl4 N O2 Sn -","- C27 H30 Cl4 N O2 Sn -","- C108 H120 Cl16 N4 O8 Sn4 -","4","1","HB6171","Yaw-Kai Yan; Lian Ee Khoo","A 1:1 adduct of 3-(piperidin-1-yl)propionic acid with triphenyltin chloride","Acta Crystallographica Section E","2005","61","4","m781","m783","10.1107/S1600536805009517","","","0.71073","MoKα","","0.07","0.0446","","","0.1093","0.1256","","","","","","0.962","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205498","9.9326","0.0003","11.8986","0.0004","13.1517","0.0004","82.779","0.0011","84.46","0.0015","78.7095","0.0012","1508.01","0.08","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Chlorobis(1,10-phenanthroline-κ^2^N,N')copper(II) nitrate 4-nitrobenzoic acid monohydrate","","- C31 H23 Cl Cu N6 O8 -","- C31 H23 Cl Cu N6 O8 -","- C62 H46 Cl2 Cu2 N12 O16 -","2","1","HB6173","Tu-Gen Xu; Jia-Geng Liu; Duan-Jun Xu","Chlorobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) nitrate 4-nitrobenzoic acid monohydrate","Acta Crystallographica Section E","2005","61","4","m787","m789","10.1107/S1600536805009529","","","0.71073","MoKα","","0.071","0.045","","","0.101","0.11","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205499","8.735","0.002","16.569","0.004","8.764","0.002","90","","113.81","0.04","90","","1160.5","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4,4-Dinitro-5,6,7,8,9,10-hexahydro-4H-cyclonona[d]isoxazole","","- C10 H13 N3 O5 -","- C10 H13 N3 O5 -","- C40 H52 N12 O20 -","4","1","HG6133","Jan Lokaj; Viktor Kettmann; Viktor Milata; Milan Marko","4,4-Dinitro-5,6,7,8,9,10-hexahydro-4<i>H</i>-cyclonona[<i>d</i>]isoxazole","Acta Crystallographica Section E","2005","61","4","o808","o810","10.1107/S1600536805004186","","","0.71073","MoKα","","0.1451","0.0561","","","0.1346","0.1623","","","","","","0.913","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205500","8.109","0.001","6.6266","0.0008","8.381","0.001","90","","113.406","0.002","90","","413.3","0.09","100","2","100","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","3-cyano-N-methylpyridinium bromide","","- C7 H7 Br N2 -","- C7 H7 Br N2 -","- C14 H14 Br2 N4 -","2","0.5","HG6136","Mague, Joel T.; Ivie, Ryan M.; Hartsock, Robert W.; Koplitz, Lynn Vogel; Spulak, Mary","3-Cyano-<i>N</i>-methylpyridinium bromide","Acta Crystallographica Section E","2005","61","4","o851","o853","10.1107/S1600536805006264","","","0.71073","MoKα","","0.0347","0.0291","","","0.0616","0.0629","","","","","","0.927","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205501","14.7792","0.0003","16.739","0.0002","14.692","0.0003","90","","132.09","0.0005","90","","2697.24","0.09","293","1","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H31 Cl N2 O4 -","- C30 H31 Cl N2 O4 -","- C120 H124 Cl4 N8 O16 -","4","1","HG6138","Shan-Zhong Jian; Jian-Ming Gu; Yan-Guang Wang","3-[(2<i>R</i>*,3<i>S</i>*)-3-(4-Chlorophenyl)-3-(2-methoxyanilino)-2-methylpropionyl]spiro[2<i>H</i>-1,3-benzoxazine-2,1'-cyclohexan]-4(3<i>H</i>)-one","Acta Crystallographica Section E","2005","61","4","o814","o815","10.1107/S1600536805005854","","","0.7107","MoKα","","","0.038","","","","0.102","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205502","12.1981","0.001","10.1097","0.0008","19.9112","0.0016","90","","90","","90","","2455.4","0.3","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","4-Phenyl-1-(1H-1,2,4-triazol-3-ylcarbonyl)thiosemicarbazide","","- C10 H10 N6 O S -","- C10 H10 N6 O S -","- C80 H80 N48 O8 S8 -","8","1","HG6140","Ding-Ben Chen; Ling Huang; Fu-You Pan; Jian-Guo Yang","4-Phenyl-1-(1<i>H</i>-1,2,4-triazol-3-ylcarbonyl)thiosemicarbazide","Acta Crystallographica Section E","2005","61","4","o836","o837","10.1107/S1600536805003387","","","0.71073","MoKα","","0.0746","0.0419","","","0.0699","0.0768","","","","","","0.85","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205503","11.3496","0.0019","18.016","0.003","10.9165","0.0018","90","","90","","90","","2232.1","0.6","273","2","273","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","3-(2,4-Dichlorophenyl)-4-[(1E)-(2,4-dichlorophenyl)methyleneamino]- 4,5-dihydro-1H-1,2,4-triazole-5-thione dimethylformamide solvate","","- C18 H15 Cl4 N5 O S -","- C18 H15 Cl4 N5 O S -","- C72 H60 Cl16 N20 O4 S4 -","4","1","HG6143","Fang, Xiao-Niu; Zhong, Fan; Dai, Mei-Zhen; Hu, Rong-Hua","3-(2,4-Dichlorophenyl)-4-[(1<i>E</i>)-(2,4-dichlorophenyl)methyleneamino]-4,5-dihydro-1<i>H</i>-1,2,4-triazole-5-thione dimethylformamide solvate","Acta Crystallographica Section E","2005","61","4","o863","o865","10.1107/S1600536805006240","","","0.71073","MoKα","","0.0581","0.0311","","","0.0371","0.0388","","","","","","0.821","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205504","8.295","0.002","13.178","0.007","24.714","0.004","90","","95.412","0.001","90","","2689.5","1.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","benzyltrimethylammonium dihydrogen orthophosphate monohydrate.","","- C10 H20 N O5 P -","- C10 H20 N O5 P -","- C80 H160 N8 O40 P8 -","8","2","HG6146","A. Criado; María Jesús Diánez; María Dolores Estrada; Simeón Pérez-Garrido; I. M. L. Fernandes; M. Belsley; E. de Matos Gomes","Benzyltrimethylammonium dihydrogen orthophosphate monohydrate","Acta Crystallographica Section E","2005","61","4","o1127","o1129","10.1107/S1600536805008755","","","0.71069","MoKα","","0.0753","0.0512","","0.1698","","0.1429","","","1.019","","","1.014","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205505","11.366","0.0007","21.4096","0.0012","12.9034","0.0011","90","","90","","90","","3139.9","0.4","293","","293","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","N-(2,2-Dimethyl-4-oxo-1,3-thiazolidin-3-yl)-6- methylimidazo[2,1-b][1,3]thiazole-5-carboxamide monohydrate","","- C12 H16 N4 O3 S2 -","- C12 H16 N4 O3 S2 -","- C96 H128 N32 O24 S16 -","8","1","HG6147","Sema Öztürk Yıldırım; Mehmet Akkurt; Fusun Ur; Zafer Cesur; Nesrin Cesur; Orhan Büyükgüngör","<i>N</i>-(2,2-Dimethyl-4-oxo-1,3-thiazolidin-3-yl)-6-methylimidazo[2,1-<i>b</i>][1,3]thiazole-5-carboxamide monohydrate","Acta Crystallographica Section E","2005","61","4","o892","o894","10.1107/S1600536805006525","","","0.71073","MoKα","","0.086","0.0549","","","0.166","0.1783","","","","","","1.075","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205506","4.9264","0.0019","28","0.011","11.098","0.004","90","","97.957","0.007","90","","1516.1","1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Hydroxy-2'-(4-isopropylbenzylidene)benzohydrazide","","- C17 H18 N2 O2 -","- C17 H18 N2 O2 -","- C68 H72 N8 O8 -","4","1","HG6148","Jian-Guo Yang; Fu-You Pan","2-Hydroxy-2'-(4-isopropylbenzylidene)benzohydrazide","Acta Crystallographica Section E","2005","61","4","o1038","o1040","10.1107/S1600536805007385","","","0.71073","MoKα","","0.1275","0.0763","","","0.2041","0.2283","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205507","16.544","0.002","15.0056","0.0019","7.3884","0.001","90","","100.22","0.002","90","","1805.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(4-Bromophenyl)-5-(3,4-dimethoxyphenyl)-3,4-dimethylthiophene","","- C20 H19 Br O2 S -","- C20 H19 Br O2 S -","- C80 H76 Br4 O8 S4 -","4","1","HG6149","Lei, Yingjie; Shi, Jixian; Yu, Mei; Zheng, Xiufang","2-(4-Bromophenyl)-5-(3,4-dimethoxyphenyl)-3,4-dimethylthiophene","Acta Crystallographica Section E","2005","61","4","o873","o874","10.1107/S1600536805006288","","","0.71073","MoKα","","0.0913","0.0404","","","0.0903","0.1055","","","","","","0.993","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205508","11.1573","0.0006","14.8063","0.0012","16.8629","0.0013","66.738","0.003","86.74","0.004","83.251","0.004","2541.4","0.3","295","2","295","2","","","","","","","","3","P -1","-P 1","2","","N-(3-Methylphenyl)-N,N-bis(4-methylphenyl)amine","","- C21 H21 N -","- C21 H21 N -","- C126 H126 N6 -","6","3","HG6150","Manifar, Touraj; Rohani, Sohrab; Jennings, Michael, C.","<i>N</i>-(3-Methylphenyl)-<i>N,N</i>-bis(4-methylphenyl)amine","Acta Crystallographica Section E","2005","61","4","o1032","o1034","10.1107/S1600536805007488","","","0.71073","MoKα","","0.217","0.0711","","","0.1809","0.2448","","","","","","0.928","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205509","13.986","0.002","10.8228","0.0019","9.0976","0.0016","90","","108.474","0.004","90","","1306.1","0.4","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","benzamidinium tetrachlogallate(III)","benzamidinium tetrachlogallate(III)","","- C7 H9 Cl4 Ga N2 -","- C7 H9 Cl4 Ga N2 -","- C28 H36 Cl16 Ga4 N8 -","4","1","HG6154","Barker, James; Errington, William; Wallbridge, Malcolm G. H.","Benzamidinium tetrachlorogallate(III)","Acta Crystallographica Section E","2005","61","4","m748","m750","10.1107/S1600536805008597","","","0.71073","MoKα","","0.096","0.0434","","","0.0659","0.0786","","","","","","0.992","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205510","8.856","0.001","9.05","0.002","12.343","0.001","85.35","0.01","87.82","0.01","64.82","0.01","892.3","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-Acetyl-2-phenyl-4-acetoxy-decahydroquinoline","","- C19 H25 N O3 -","- C19 H25 N O3 -","- C38 H50 N2 O6 -","2","1","HG6155","R. Padmavathy; K. Saminathan; D. Natarajan; N. Bhavani; K. Sivakumar","1-Acetyl-2-phenylperhydroquinolin-4-yl acetate","Acta Crystallographica Section E","2005","61","4","o1109","o1111","10.1107/S1600536805008780","","","0.71073","MoKα","","0.0656","0.0485","","","0.1447","0.1544","","","","","","1.111","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205511","5.6507","0.0006","12.8745","0.0017","24.386","0.003","90","","90","","90","","1774.1","0.4","293","2","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl (2S,3S)-3-phenyloxirane-2-carboxylate","","- C19 H26 O3 -","- C19 H26 O3 -","- C76 H104 O12 -","4","1","HG6156","Shan-Zhong Jian; Yan-Guang Wang","(1<i>R</i>,2<i>S</i>,5<i>R</i>)-2-Isopropyl-5-methylcyclohexyl (2<i>S</i>,3<i>S</i>)-3-phenyloxirane-2-carboxylate","Acta Crystallographica Section E","2005","61","4","o1135","o1136","10.1107/S1600536805008883","","","0.71069","MoKα","","","0.0467","","","","0.1235","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205512","6.9483","0.0002","22.4844","0.0005","8.2364","0.0002","90","","92.765","0.001","90","","1285.26","0.06","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3,5-dinitro-4-methylbenzoic acid DMSO solvate","3,5-dinitro-4-methylbenzoic acid dimethyl sulfoxide","","- C10 H12 N2 O7 S -","- C10 H12 N2 O7 S -","- C40 H48 N8 O28 S4 -","4","1","HG6157","Trask, A. V.; Abthorpe, M.; Jones, W.","4-Methyl-3,5-dinitrobenzoic acid‒dimethyl sulfoxide (1/1)","Acta Crystallographica Section E","2005","61","4","o1100","o1102","10.1107/S1600536805008779","","","0.71073","MoKα","","0.0626","0.0407","","","0.0914","0.1024","","","","","","1.056","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205513","9.02","0.001","18.233","0.003","11.219","0.002","90","","107.908","0.002","90","","1755.7","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,4,6-tris(pyrimidin-2-ylsulfanyl)-1,3,5-triazine","","- C15 H9 N9 S3 -","- C15 H9 N9 S3 -","- C60 H36 N36 S12 -","4","1","HG6159","Zhang, Lei; Zhao, Xin-Hua; Wang, Xiao-Dong","2,4,6-Tris(pyrimidin-2-ylsulfanyl)-1,3,5-triazine","Acta Crystallographica Section E","2005","61","4","o1133","o1134","10.1107/S1600536805008901","","","0.71073","MoKα","","0.0613","0.035","","","","0.0895","","","","","","1.084","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205514","14.251","0.0012","14.251","0.0012","14.251","0.0012","116.402","0.007","116.402","0.007","116.402","0.007","1391","0.8","298","2","298","2","","","","","","","","5","R -3 :R","-P 3*","148","","Potassium ethane-1,1-bis(diazeniumdiolate) monohydrate","","- C2 H6 K2 N4 O5 -","- C2 H6 K2 N4 O5 -","- C12 H36 K12 N24 O30 -","6","1","HK6000","Arulsamy, Navamoney; Bohle, D. Scott","Dipotassium ethane-1,1-diylbis(diazeniumdiolate) monohydrate","Acta Crystallographica Section E","2005","61","4","m764","m766","10.1107/S1600536805008822","","","0.71073","MoKα","","0.0472","0.0329","","","0.0772","0.0838","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205515","9.8647","0.0008","13.3308","0.001","16.9443","0.0014","90","","101.63","0.001","90","","2182.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis[4-phenyl-5-(1H-1,2,4-triazol-3-yl)-4-phenyl-4H-1,2,4-triazol-3-yl] disulfide","","- C20 H14 N12 S2 -","- C20 H14 N12 S2 -","- C80 H56 N48 S8 -","4","1","IS6051","Fu-You Pan; Jian-Guo Yang; Ding-Ben Chen; Ling Huang","Bis[4-phenyl-5-(1<i>H</i>-1,2,4-triazol-3-yl)-4<i>H</i>-1,2,4-triazol-3-yl] disulfide","Acta Crystallographica Section E","2005","61","4","o866","o867","10.1107/S1600536805006276","","","0.71073","MoKα","","0.0655","0.0415","","","0.0789","0.0852","","","","","","0.868","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205516","8.424","0.005","10.184","0.005","20.943","0.005","90","","90","","90","","1796.7","1.4","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Poly[[triaquacadmium(II)-μ~3~-lactato] dilactatoboron(1-)]","","- C9 H19 B Cd O12 -","- C9 H19 B Cd O12 -","- C36 H76 B4 Cd4 O48 -","4","1","IS6052","Mehmet Akkurt; Sema Öztürk Yıldırım; Jayaraman Ramajothi; Orhan Büyükgüngör; Sivasubramanian Dhanuskodi","Poly[[triaquacadmium(II)-μ~3~-lactato] dilactatoboron(1‒)]","Acta Crystallographica Section E","2005","61","4","m632","m634","10.1107/S1600536805005970","","","0.71073","MoKα","","0.0311","0.0241","","","0.0505","0.0518","","","","","","0.933","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205517","8.863","0.0016","10.3923","0.0015","12.1022","0.0016","90","","100.466","0.002","90","","1096.2","0.3","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(1H-imidazole-κN^3^)bis(3-methylbenzoato-κO)copper(II)","","- C22 H22 Cu N4 O4 -","- C22 H22 Cu N4 O4 -","- C44 H44 Cu2 N8 O8 -","2","0.5","IS6053","Tu-Gen Xu; Jia-Geng Liu; Duan-Jun Xu","Bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)bis(3-methylbenzoato-κ<i>O</i>)copper(II)","Acta Crystallographica Section E","2005","61","4","m622","m624","10.1107/S1600536805005726","","","0.71073","MoKα","","0.049","0.039","","","0.098","0.103","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205518","4.911","0.0018","12.466","0.004","21.018","0.007","90","","91.299","0.006","90","","1286.4","0.8","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1-(2-Hydroxyphenyl)ethanone benzoylhydrazone","1-(2-Hydroxyphenyl)ethanone benzoylhydrazone","","- C15 H14 N2 O2 -","- C15 H14 N2 O2 -","- C60 H56 N8 O8 -","4","1","IS6055","Ngah, Nurziana; Mohamad, Nuriah; Ahmad, Musa; Yamin, Bohari M.","1-(2-Hydroxyphenyl)ethanone benzoylhydrazone","Acta Crystallographica Section E","2005","61","4","o969","o970","10.1107/S1600536805007191","","","0.71073","MoKα","","0.07","0.059","","","0.133","0.138","","","","","","1.24","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205519","6.9876","0.0003","8.1549","0.0004","8.6495","0.0003","63.53","0.002","85.004","0.003","85.179","0.002","438.96","0.03","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","4-(2-Chloroethyl)morpholinium chloride","","- C6 H13 Cl2 N O -","- C6 H13 Cl2 N O -","- C12 H26 Cl4 N2 O2 -","2","1","IS6056","Rajenahally S. Narasegowda; Hemmige S. Yathirajan; Padmarajaiah Nagaraja; Daniel E. Lynch","4-(2-Chloroethyl)morpholinium chloride","Acta Crystallographica Section E","2005","61","4","o849","o850","10.1107/S1600536805006136","","","0.71073","MoKα","","0.0351","0.0278","","","0.0716","0.078","","","","","","0.943","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205520","13.4973","0.0005","8.0905","0.0002","8.8358","0.0003","90","","102.627","0.002","90","","941.53","0.05","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(Carbamoylmethyl)cyclohexanecarboxylic acid","","- C9 H15 N O3 -","- C9 H15 N O3 -","- C36 H60 N4 O12 -","4","1","IS6057","Basavegowda Nagaraj; Hemmige S. Yathirajan; Padmarajaiah Nagaraja; Daniel E. Lynch","1-(Carbamoylmethyl)cyclohexanecarboxylic acid","Acta Crystallographica Section E","2005","61","4","o884","o885","10.1107/S1600536805006148","","","0.71073","MoKα","","0.0447","0.038","","","0.0989","0.1031","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205521","8.442","0.002","7.117","0.001","13.162","0.003","90","","103.76","0.03","90","","768.1","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-acetylpyridinium chloride","","- C7 H8 Cl N O -","- C7 H8 Cl N O -","- C28 H32 Cl4 N4 O4 -","4","1","IS6058","Andrzej Kochel","4-Acetylpyridinium chloride","Acta Crystallographica Section E","2005","61","4","o926","o927","10.1107/S1600536805006872","","","0.71073","MoKα","","0.141","0.0728","","","0.1543","0.1788","","","","","","1.103","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205522","5.617","0.0011","12.247","0.002","16.993","0.003","90","","93.06","0.03","90","","1167.3","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","5-Chloromethyl-3-[4-(methylsulfonyl)phenyl]-1,2,4-oxadiazole","","- C10 H9 Cl N2 O3 S -","- C10 H9 Cl N2 O3 S -","- C40 H36 Cl4 N8 O12 S4 -","4","1","IS6059","Wang, Hai-Bo; Chen, Jia-Hui; Pu, Yue-Qing; Wang, Jin-Tang","5-Chloromethyl-3-[4-(methylsulfonyl)phenyl]-1,2,4-oxadiazole","Acta Crystallographica Section E","2005","61","4","o953","o954","10.1107/S1600536805007087","","","0.71073","MoKα","","0.0649","0.0435","","","0.1341","0.1486","","","","","","1.009","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205523","4.7477","0.0005","5.5644","0.0008","47.983","0.003","90.205","0.009","90.523","0.007","102.288","0.01","1238.5","0.2","296","1","","","","","","","","","","3","P -1","-P 1","2","","Tricosane-1,23-dithiol","","- C23 H48 S2 -","- C23 H48 S2 -","- C46 H96 S4 -","2","1","IS6060","Naotake Nakamura; Hirotaka Shimizu; Yoshihiro Ogawa","Tricosane-1,23-dithiol","Acta Crystallographica Section E","2005","61","4","o1046","o1048","10.1107/S1600536805008032","","","1.5418","CuKα","","","0.056","","","","0.126","","","","","","1.001","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205524","7.7151","0.001","8.5541","0.0011","9.6887","0.0013","88.516","0.002","76.964","0.002","83.401","0.002","618.81","0.14","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4-p-Tolyl-1,3,4,4a,5,6,7,8a-octahydro-2H-pyrano[2,3-d]pyrimidin-2-one","","- C14 H18 N2 O2 -","- C14 H18 N2 O2 -","- C28 H36 N4 O4 -","2","1","JH6001","Lei Yan; Yu-Lin Zhu; Yuan-Jiang Pan","4-<i>p</i>-Tolyl-1,3,4,4a,5,6,7,8a-octahydro-2<i>H</i>-pyrano[2,3-<i>d</i>]pyrimidin-2-one","Acta Crystallographica Section E","2005","61","4","o1049","o1051","10.1107/S1600536805008147","","","0.71073","MoKα","","0.0429","0.0373","","","0.1083","0.1115","","","","","","1.113","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205525","11.991","0.002","5.486","0.001","18.894","0.004","90","","94.64","0.03","90","","1238.8","0.4","293","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[diaquacadmium(II)]-μ-4-(carboxylatomethylsulfanyl)phenyoxyacetato]","","- C10 H12 Cd O7 S -","- C10 H12 Cd O7 S -","- C40 H48 Cd4 O28 S4 -","4","0.5","KP6025","Gao, Shan; Su, Hong; Huo, Li Hua; Ng, Seik Weng","<i>catena</i>-Poly[[diaquacadmium(II)]-μ-4-(carboxylatomethylsulfanyl)phenoxyacetato]","Acta Crystallographica Section E","2005","61","4","m725","m726","10.1107/S1600536805008500","","","0.71073","MoKα","","0.039","0.035","","","0.093","0.094","","","","","","1.11","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205526","7.8208","0.0011","11.0356","0.0014","11.5767","0.0015","91.531","0.01","102.391","0.011","91.567","0.011","975","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4,5-Bis(3-methoxythiophenoxy)phthalonitrile","","- C22 H16 N2 O2 S2 -","- C22 H16 N2 O2 S2 -","- C44 H32 N4 O4 S4 -","2","1","KP6030","Akbal, Tufan; Akdemir, Nesuhi; Özil, Musa; Ağar, Erbil; Erdönmez, Ahmet","4,5-Bis(3-methoxyphenylsulfanyl)phthalonitrile","Acta Crystallographica Section E","2005","61","4","o1121","o1122","10.1107/S1600536805008706","","","0.71073","MoKα","","0.1197","0.0514","","","0.1282","0.1513","","","","","","0.849","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205527","7.836","0.002","16.833","0.004","8.49","0.002","90","","96.72","0.02","90","","1112.2","0.5","293","2","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","2-bromobenzophenone","2-Bromobenzophenone","","- C13 H9 Br O -","- C13 H9 Br O -","- C52 H36 Br4 O4 -","4","1","KP6034","Baumer, Vyacheslav N.; Romashkin, Roman V.; Strzhemechny, Mikhail A.; Avdeenko, Anatoly A.; Pyshkin, Oleg S.; Zubatyuk, Roman I.; Buravtseva, Lyubov M.","2-Bromobenzophenone","Acta Crystallographica Section E","2005","61","4","o1170","o1172","10.1107/S1600536805009190","","","0.71073","MoKα","","","0.0383","","","","0.0641","","","","","","0.94","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205528","8.8423","0.0008","12.2784","0.0011","14.438","0.0013","90","","101.374","0.002","90","","1536.7","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2-Bis(5-chloro-2-methyl-3-thienyl)cyclopentene","","- C15 H14 Cl2 S2 -","- C15 H14 Cl2 S2 -","- C60 H56 Cl8 S8 -","4","1","KP6041","Guan, Jin-Tao; Yin, Jun; Yu, Guang-Ao; Liu, Sheng-Hua","1,2-Bis(5-chloro-2-methyl-3-thienyl)cyclopentene","Acta Crystallographica Section E","2005","61","4","o951","o952","10.1107/S1600536805006033","","","0.71073","MoKα","","0.0814","0.0561","","","0.1652","0.1822","","","","","","1.088","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205529","9.8562","0.0012","13.4978","0.0017","11.8371","0.0014","90","","90","","90","","1574.8","0.3","298","2","298","2","","","","","","","","3","A b a 2","A 2 -2ab","41","","6,6'-Dioxo-2,2-bi(7-oxatricyclo[3.2.1.1^3,8^]nonane)-4,4'-dicarboxylic acid","","- C18 H18 O8 -","- C18 H18 O8 -","- C72 H72 O32 -","4","","KP6045","Mao-Lin Hu; Ya-Qian Cheng; Shun Wang; Ji-Xin Yuan; Xiao-Qing Cai","6,6'-Dioxo-2,2-bi(7-oxatricyclo[3.2.1.1^3,8^]nonane)-4,4'-dicarboxylic acid","Acta Crystallographica Section E","2005","61","4","o1196","o1197","10.1107/S1600536805009669","","","0.71073","MoKα","","0.0414","0.0403","","","0.0881","0.0887","","","","","","1.185","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205530","16.7835","0.0004","8.458","0.0002","18.0373","0.0005","90","","111.653","0.001","90","","2379.8","0.1","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diethyl 2-aminothiazole-4,5-dicarboxylate hemihydrate","","- C9 H13 N2 O4.5 S -","- C9 H13 N2 O4.5 S -","- C72 H104 N16 O36 S8 -","8","2","KP6046","Daniel E. Lynch; Ian McClenaghan","Diethyl 2-aminothiazole-4,5-dicarboxylate hemihydrate","Acta Crystallographica Section E","2005","61","4","o824","o826","10.1107/S1600536805006197","","","0.71073","MoKα","","0.0633","0.0457","","","0.1122","0.1218","","","","","","1.087","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205531","12.485","0.004","13.666","0.004","25.801","0.008","90","","90","","90","","4402","2","273","2","273","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1,1'-Diphenyl-5,5'-[o-phenylenebis(methylenethio)]di-1H-tetrazole","","- C22 H18 N8 S2 -","- C22 H18 N8 S2 -","- C176 H144 N64 S16 -","8","1","KP6048","Luo, Xiao-Lan; Wang, Wei; Ma, Guo-Chun; Zhang, Wen-Qin","1,1'-Diphenyl-5,5'-[<i>o</i>-phenylenebis(methylenethio)]di-1<i>H</i>-tetrazole","Acta Crystallographica Section E","2005","61","4","o1161","o1162","10.1107/S1600536805009219","","","0.71073","MoKα","","0.0949","0.0513","","","0.111","0.1375","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205532","15.121","0.004","8.872","0.002","11.025","0.003","90","","90","","90","","1479","0.7","298","2","298","2","","","","","","","","3","C m c 21","C 2c -2","36","","9-Butyl-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione","","- C17 H22 O3 -","- C17 H22 O3 -","- C68 H88 O12 -","4","0.5","LH6333","Yu-Lin Zhu; Shen-Lin Huang; Yuan-Jiang Pan","9-Butyl-3,4,5,6,7,9-hexahydro-2<i>H</i>-xanthene-1,8-dione","Acta Crystallographica Section E","2005","61","4","o1139","o1140","10.1107/S1600536805006501","","","0.71073","MoKα","","0.0605","0.0389","","","0.0823","0.0889","","","","","","0.877","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205533","6.9281","0.0002","8.6629","0.0002","24.3962","0.0007","90","","90","","90","","1464.2","0.07","90","0.2","90","0.2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(Z)-2-(3-Thienyl)-3-(3,4,5-trimethoxyphenyl)acrylonitrile","","- C16 H15 N O3 S -","- C16 H15 N O3 S -","- C64 H60 N4 O12 S4 -","4","1","LH6335","Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.","(<i>Z</i>)-2-(3-Thienyl)-3-(3,4,5-trimethoxyphenyl)acrylonitrile","Acta Crystallographica Section E","2005","61","4","o933","o935","10.1107/S160053680500680X","","","0.71073","MoKα","","0.0554","0.0395","","","0.0807","0.0871","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205534","5.8067","0.001","12.7007","0.0014","8.7274","0.0007","90","","99.643","0.014","90","","634.54","0.14","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","5-Ferrocenyl-5-methyltetrahydrofuran-2-one","","- C15 H16 Fe O2 -","- C15 H16 Fe O2 -","- C30 H32 Fe2 O4 -","2","1","LH6364","Rybarczyk-Pirek, Agnieszka J.; Plażuk, Damian; Zakrzewski, Janusz","5-Ferrocenyl-5-methyltetrahydrofuran-2-one, the product of the Friedel‒Crafts reaction of ferrocene with γ-methylenebutyrolactone","Acta Crystallographica Section E","2005","61","4","m644","m646","10.1107/S1600536805006239","","","1.54178","CuKα","","0.0612","0.0488","","","0.1168","0.1274","","","","","","1.086","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205535","27.937","0.009","8.828","0.003","19.072","0.006","90","","93.974","0.006","90","","4692","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[di-μ~3~-benzoato-tetra-μ~2~-benzoato-dipyrroletricadmium(II)]","","- C50 H38 Cd3 N2 O12 -","- C50 H38 Cd3 N2 O12 -","- C200 H152 Cd12 N8 O48 -","4","0.5","LH6367","Xuan-Wen Liu","<i>catena</i>-Poly[di-μ~3~-benzoato-tetra-μ~2~-benzoato-dipyrroletricadmium(II)]","Acta Crystallographica Section E","2005","61","4","m662","m663","10.1107/S160053680500677X","","","0.71073","MoKα","","0.0903","0.0432","","","0.0878","0.1149","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205536","7.3809","0.0001","8.3383","0.0001","11.8498","0.0002","94.659","0.001","97.724","0.001","93.244","0.001","718.597","0.018","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[diaquazinc(II)-μ-(diethyl dichloromethylenebisphosphonato)- κ^3^O,O':O''-tetraaquazinc(II)-μ-(diethyl dichloromethylenebisphosphonato)- κ^3^O:O',O'']","","- C5 H16 Cl2 O9 P2 Zn -","- C5 H16 Cl2 O9 P2 Zn -","- C10 H32 Cl4 O18 P4 Zn2 -","2","1","LH6370","Kontturi, Mervi; Peräniemi, Sirpa; Vepsäläinen, Jouko J.; Ahlgrén, Markku","<i>catena</i>-Poly[diaquazinc(II)-μ-(diethyl dichloromethylenebisphosphonato)-κ^3^<i>O,O</i>':<i>O</i>''-tetraaquazinc(II)-μ-(diethyl dichloromethylenebisphosphonato)-κ^3^<i>O</i>:<i>O</i>',<i>O</i>'']","Acta Crystallographica Section E","2005","61","4","m635","m637","10.1107/S1600536805005957","","","0.71073","MoKα","","0.0242","0.0202","","","0.0518","0.0531","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205537","7.5437","0.0002","8.5071","0.0002","11.8973","0.0004","97.4564","0.0012","97.4929","0.0011","91.4131","0.0012","749.92","0.04","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[diaquacadmium(II)-μ-(diethyl dichloromethylenebisphosphonato)- κ^3^O,O':O''-tetraaquacadmium(II)-μ-(diethyl dichloromethylenebisphosphonato)- κ^3^O:O',O'']","","- C5 H16 Cd Cl2 O9 P2 -","- C5 H16 Cd Cl2 O9 P2 -","- C10 H32 Cd2 Cl4 O18 P4 -","2","1","LH6371","Kontturi, Mervi; Peräniemi, Sirpa; Vepsäläinen, Jouko J.; Ahlgrén, Markku","<i>catena</i>-Poly[diaquacadmium(II)-μ-(diethyl dichloromethylenebisphosphonato)-κ^3^<i>O,O</i>':<i>O</i>''-tetraaquacadmium(II)-μ-(diethyl dichloromethylenebisphosphonato)-κ^3^<i>O</i>:<i>O</i>',<i>O</i>'']","Acta Crystallographica Section E","2005","61","4","m638","m640","10.1107/S1600536805005969","","","0.71073","MoKα","","0.0329","0.0261","","","0.0685","0.0716","","","","","","0.968","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205538","6.0502","0.0006","16.524","0.002","19.031","0.002","90","","95.744","0.007","90","","1893","0.4","93.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","tert-Butyl 1,4-dioxo-3,6-diphenyl-1,2,4,5-tetrahydropyrrolo[3,4-c]pyrrole-2-carboxylate","","- C23 H20 N2 O4 -","- C23 H20 N2 O4 -","- C92 H80 N8 O16 -","4","1","LH6372","Imura, Yasuo; Senju, Takatoshi; Mizuguchi, Jin","<i>tert</i>-Butyl 1,4-dioxo-3,6-diphenyl-1,2,4,5-tetrahydropyrrolo[3,4-<i>c</i>]pyrrole-2-carboxylate","Acta Crystallographica Section E","2005","61","4","o816","o818","10.1107/S1600536805005829","","","1.5418","CuKα","","","0.0509","","","","0.1413","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205539","9.42","0.006","10.479","0.006","19.269","0.009","85.44","0.05","89.45","0.05","71.94","0.05","1802.4","1.8","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","Bis(triphenylsilyl) phenylphosphonate","","- C42 H35 O3 P Si2 -","- C42 H35 O3 P Si2 -","- C84 H70 O6 P2 Si4 -","2","1","LH6373","Ferguson, George; O'Leary, Brian J.; Spalding, Trevor R.","Bis(triphenylsilyl) phenylphosphonate","Acta Crystallographica Section E","2005","61","4","o838","o840","10.1107/S1600536805005945","","","0.7107","MoKα","","0.1508","0.0516","","","0.1189","0.1432","","","","","","0.949","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205540","7.3437","0.0004","17.944","0.001","21.34","0.001","90","","90","","90","","2812.1","0.3","295","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","5-Bromo-1H-indole-3-carbaldehyde 2-thienoylhydrazone","","- C14 H10 Br N3 O S -","- C14 H10 Br N3 O S -","- C112 H80 Br8 N24 O8 S8 -","8","1","LH6375","Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Lajis, Nordin Hj.; Basirun, Wan Jefri; Zain, Sharifuddin M.; Ng, Seik Weng","5-Bromo-1<i>H</i>-indole-3-carbaldehyde 2-thienoylhydrazone","Acta Crystallographica Section E","2005","61","4","o914","o915","10.1107/S1600536805006616","","","0.71073","MoKα","","0.082","0.053","","","0.131","0.151","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205541","8.9066","0.0005","11.7021","0.0006","11.7768","0.0006","90","","97.097","0.001","90","","1218.04","0.11","295","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Oxo-2,3-dihydro-1H-indol-3-one nicotinoylhydrazone","","- C14 H10 N4 O2 -","- C14 H10 N4 O2 -","- C56 H40 N16 O8 -","4","1","LH6376","Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Basirun, Wan Jefri; Ng, Seik Weng","2-Oxo-2,3-dihydro-1<i>H</i>-indol-3-one nicotinoylhydrazone","Acta Crystallographica Section E","2005","61","4","o916","o917","10.1107/S1600536805006628","","","0.71073","MoKα","","0.047","0.036","","","0.099","0.109","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205542","11.4198","0.0007","11.0121","0.0007","12.2262","0.0008","90","","93.319","0.001","90","","1534.94","0.17","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(4-Methoxybenzoyl)-N'-(4-methoxyphenyl)thiourea","","- C16 H16 N2 O3 S -","- C16 H16 N2 O3 S -","- C64 H64 N8 O12 S4 -","4","1","LH6377","Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Basirun, Wan Jefri; Ng, Seik Weng","<i>N</i>-(4-Methoxybenzoyl)-<i>N</i>'-(4-methoxyphenyl)thiourea","Acta Crystallographica Section E","2005","61","4","o1093","o1094","10.1107/S160053680500663X","","","0.71073","MoKα","","0.064","0.042","","","0.116","0.132","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205543","20.2456","0.0006","20.2456","0.0006","8.5209","0.0005","90","","90","","90","","3492.6","0.3","100","2","100","2","","","","","","","","6","P -4 21 c","P -4 2n","114","","2,3-Bis(5-bromothien-2-yl)-6,7-dichloroquinoxaline","","- C16 H6 Br2 Cl2 N2 S2 -","- C16 H6 Br2 Cl2 N2 S2 -","- C128 H48 Br16 Cl16 N16 S16 -","8","1","LH6378","Stacy, Vanessa; Crundwell, Guy; Updegraff III, James B.; Zeller, Matthias; Hunter, Allen D.","2,3-Bis(5-bromo-2-thienyl)-6,7-dichloroquinoxaline","Acta Crystallographica Section E","2005","61","4","o904","o905","10.1107/S1600536805006793","","","0.71073","MoKα","","0.0407","0.031","","","0.0644","0.0674","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205544","7.8491","0.0002","10.2612","0.0003","11.2111","0.0005","78.5212","0.0012","89.0564","0.0012","73.722","0.002","848.68","0.05","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","bis(μ-ferrocene-1,1'-diyl)bis[chloro(N,N,N',N'- tetramethylethylenediamine)aluminium","","- C32 H48 Al2 Cl2 Fe2 N4 -","- C32 H48 Al2 Cl2 Fe2 N4 -","- C32 H48 Al2 Cl2 Fe2 N4 -","1","0.5","LH6380","Schachner, Jörg A.; Lund, Clinton L.; Quail, J. Wilson; Müller, Jens","The first aluminium-bridged [1.1]ferrocenophane","Acta Crystallographica Section E","2005","61","4","m682","m684","10.1107/S1600536805007695","","","0.71073","MoKα","","0.0819","0.0469","","","0.1044","0.1195","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205545","10.284","0.002","13.055","0.003","19.015","0.004","91.75","0.02","105.47","0.02","106.31","0.02","2346","0.9","294","1","294","1","","","","","","","","6","P -1","-P 1","2","","Tris(triphenylsilyl)phosphate dichloromethane solvate","","- C54.26 H45.53 Cl0.53 O4 P Si3 -","- C54.263 H45.526 Cl0.526 O4 P Si3 -","- C108.526 H91.052 Cl1.052 O8 P2 Si6 -","2","1","LH6381","Ferguson, George; O'Leary, Brian J.; Spalding, Trevor R.","Tris(triphenylsilyl)phosphate dichloromethane solvate","Acta Crystallographica Section E","2005","61","4","o906","o907","10.1107/S1600536805006604","","","0.7107","MolybdenumKα","","0.1763","0.0591","","","0.109","0.1304","","","","","","0.856","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205546","7.5132","0.0005","7.8133","0.0003","16.1313","0.0011","77.537","0.004","89.546","0.003","65.6","0.003","838.53","0.09","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","2,6-Bis(4-nitrobenzylidene)cyclohexanone","","- C20 H16 N2 O5 -","- C20 H16 N2 O5 -","- C40 H32 N4 O10 -","2","1","LH6382","Quail, J. Wilson; Das, Umashankar; Dimmock, Jonathan R.","2,6-Bis(4-nitrobenzylidene)cyclohexanone","Acta Crystallographica Section E","2005","61","4","o1150","o1152","10.1107/S1600536805008871","","","0.71073","MoKα","","0.0923","0.056","","","0.1166","0.1318","","","","","","1.085","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205547","13.4405","0.0011","6.4774","0.0005","9.3684","0.0007","90","","90","","90","","815.61","0.11","150","2","150","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Adeninium(2+) dichloride","","- C5 H7 Cl2 N5 -","- C5 H7 Cl2 N5 -","- C20 H28 Cl8 N20 -","4","0.5","LH6383","Thomas C. Lewis; Derek A. Tocher","Redetermination of adeninium dichloride: the question of centrosymmetry","Acta Crystallographica Section E","2005","61","4","o1052","o1054","10.1107/S1600536805007993","","","0.71073","MoKα","","0.0243","0.0241","","","0.0626","0.0627","","","","","","0.985","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205548","9.364","0.004","11.445","0.004","13.597","0.006","90","","108.46","0.02","90","","1382.2","1","130","2","130","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Dichlorobis(pyridinium-2-thiolato)cadmium(II)","","- C10 H10 Cd Cl2 N2 S2 -","- C10 H10 Cd Cl2 N2 S2 -","- C40 H40 Cd4 Cl8 N8 S8 -","4","0.5","LH6384","Yi-Hang Wen; Yun-Long Feng","Dichlorobis(pyridinium-2-thiolato)cadmium(II)","Acta Crystallographica Section E","2005","61","4","m767","m768","10.1107/S1600536805009426","","","0.71073","MoKα","","","0.0189","","","0.0457","0.0464","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205549","7.127","0.0001","12.63","0.0004","13.2847","0.0004","107.338","0.0013","103.623","0.0017","101.423","0.0018","1061.98","0.05","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","11-(4-chlorophenyl)-10-methyl-8-phenyl-6,8-dihydro-5H- benzo[f]pyrazolo[3,4-b]quinoline","","- C27 H20 Cl N3 -","- C27 H20 Cl N3 -","- C54 H40 Cl2 N6 -","2","1","LH6385","Serrano, Hugo; Quiroga, Jairo; Cobo, Justo; Low, John N.; Glidewell, Christopher","11-(4-Chlorophenyl)-10-methyl-8-phenyl-6,8-dihydro-5<i>H</i>-benzo[<i>f</i>]pyrazolo[3,4-<i>b</i>]quinoline","Acta Crystallographica Section E","2005","61","4","o1058","o1060","10.1107/S160053680500797X","","","0.71073","MoKα","","0.0589","0.0412","","","0.1003","0.1101","","","","","","1.079","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205550","12.5653","0.0013","8.3613","0.001","9.9285","0.0015","90","","90.694","0.01","90","","1043","0.2","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-ethylenedisuccinimide","","- C10 H12 N2 O4 -","- C10 H12 N2 O4 -","- C40 H48 N8 O16 -","4","1","LH6386","Christopher L. Brown; Sarah J. Atkinson; Peter C. Healy","<i>N</i>,<i>N</i>'-Ethylenedisuccinimide","Acta Crystallographica Section E","2005","61","4","o1072","o1073","10.1107/S1600536805008226","","","0.7107","MoKα","","0.0657","0.0482","","","0.124","0.1367","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205551","10.3982","0.0007","5.7749","0.0004","11.248","0.0008","90","","96.132","0.001","90","","671.56","0.08","200","2","200","2","","","","","","","","3","P 1 c 1","P -2yc","7","","","","- C17 H16 O3 -","- C17 H16 O3 -","- C34 H32 O6 -","2","1","LH6387","George R. Clark; Kit Yee Tsang; Margaret A. Brimble","5-Methoxyspiro[1-benzofuran-2(3<i>H</i>),2'-chroman]","Acta Crystallographica Section E","2005","61","4","o1123","o1124","10.1107/S1600536805008743","","","0.71073","MoKα","","0.034","0.0298","","","0.0771","0.08","","","","","","1.015","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205552","6.5683","0.0002","6.7921","0.0002","22.4418","0.0006","90","","94.206","0.002","90","","998.49","0.05","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-Chloro-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde","","- C11 H9 Cl N2 O -","- C11 H9 Cl N2 O -","- C44 H36 Cl4 N8 O4 -","4","1","LH6388","Trilleras, Jorge; Quiroga, Jaime; Cobo, Justo; Low, John N.; Glidewell, Christopher","5-Chloro-3-methyl-1-phenyl-1<i>H</i>-pyrazole-4-carbaldehyde: sheets built from C—H···O and C—H···π(arene) hydrogen bonds","Acta Crystallographica Section E","2005","61","4","o1055","o1057","10.1107/S1600536805007981","","","0.71073","MoKα","","0.0418","0.0334","","","0.0801","0.0847","","","","","","1.023","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205553","18.924","0.0002","10.996","0.001","8.8821","0.0001","90","","92.58","0.001","90","","1846.39","0.17","298","2","298","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Bis[tris(3,5-dimethylpyrazolyl)methane]nickel(II) dibromide","","- C32 H44 Br2 N12 Ni -","- C32 H44 Br2 N12 Ni -","- C64 H88 Br4 N24 Ni2 -","2","0.25","LH6391","Annie Michaud; Frédéric-Georges Fontaine; Davit Zargarian","Bis[tris(3,5-dimethylpyrazolyl)methane]nickel(II) dibromide","Acta Crystallographica Section E","2005","61","4","m784","m786","10.1107/S1600536805009451","","","1.54178","CuKα","","0.0436","0.0402","","0.1105","","0.1082","","","1.07","","","1.114","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205554","20.203","0.005","17.021","0.006","9.643","0.003","90","","90","","90","","3316","1.8","295","","295","","","","","","","","","4","P b c a","-P 2ac 2ab","61","Succinimido 4-(N-maleimidomethyl)cyclohexanecarboxylate","2,5-dioxo-3-pyrrolidin-1-yl 4-[(2,5-dioxo-3-pyrrolin-1-yl)methyl]cyclohexanecarboxylate","","- C16 H18 N2 O6 -","- C16 H18 N2 O6 -","- C128 H144 N16 O48 -","8","1","LH6393","Christopher L. Brown; Sarah J. Atkinson; Peter C. Healy","Succinimido 4-(<i>N</i>-maleimidomethyl)cyclohexanecarboxylate","Acta Crystallographica Section E","2005","61","4","o1203","o1204","10.1107/S1600536805009074","","","0.7107","MoKα","","0.1201","0.0425","","","0.1063","0.132","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205555","9.498","0.001","13.028","0.001","16.598","0.002","90","","95.04","0.01","90","","2045.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dimethyl[4-methyl-2,6-bis(phenyliminomethyl)phenolato-κ^2^N,O]gallium(III)","","- C23 H23 Ga N2 O -","- C23 H23 Ga N2 O -","- C92 H92 Ga4 N8 O4 -","4","1","NG6095","Gu, Wei-Jin; Li, Yi-Zhi; Pan, Yi; Liu, San-Hui","Dimethyl[4-methyl-2,6-bis(phenyliminomethyl)phenolato-κ^2^<i>N</i>,<i>O</i>]gallium(III)","Acta Crystallographica Section E","2005","61","4","m614","m615","10.1107/S1600536805005702","","","0.71073","MoKα","","0.0564","0.0374","","","0.0824","0.0849","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205556","6.434","0.0013","22.876","0.005","16.273","0.003","90","","95.87","0.03","90","","2382.6","0.8","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Heptaaqua(isonicotinato-κ^2^O,O')lanthanum(III) 1,5-naphthalenedisulfonate","","- C16 H24 La N O15 S2 -","- C16 H24 La N O15 S2 -","- C64 H96 La4 N4 O60 S8 -","4","1","NG6104","Gao, Shan; Zhu, Zhi-Biao; Huo, Li-Hua; Zhao, Hui","Heptaaqua(isonicotinato-κ^2^<i>O,O</i>')lanthanum(III) 1,5-naphthalenedisulfonate","Acta Crystallographica Section E","2005","61","4","m656","m658","10.1107/S1600536805006513","","","0.71073","MoKα","","0.0463","0.0381","","","0.119","0.1254","","","","","","1.064","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205557","9.5218","0.0006","13.5515","0.0008","13.6083","0.0008","89.216","0.001","78.692","0.001","82.348","0.001","1706.38","0.18","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Bis(4-carboxybenzenesulfonato)bis(1,10-phenanthroline)manganese(II)","","- C38 H26 Mn N4 O10 S2 -","- C38 H26 Mn N4 O10 S2 -","- C76 H52 Mn2 N8 O20 S4 -","2","1","NG6119","Zhang, Li-Ping; Zhu, Long-Guan; Xiao, Hong-Ping","Bis(4-carboxybenzenesulfonato)bis(1,10-phenanthroline)manganese(II)","Acta Crystallographica Section E","2005","61","4","m705","m707","10.1107/S1600536805008020","","","0.71073","MoKα","","0.077","0.0718","","","0.1418","0.1444","","","","","","1.252","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205558","13.0071","0.0005","13.9756","0.0006","9.7024","0.0004","90","","96.042","0.002","90","","1753.92","0.12","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[[bis(1H-benzimidazole-κN^3^)manganese(II)]-μ-aqua-μ-succinato-κ^2^O:O']","","- C18 H18 Mn N4 O5 -","- C18 H18 Mn N4 O5 -","- C72 H72 Mn4 N16 O20 -","4","0.5","NG6122","Hong Li; Jia-Geng Liu; Duan-Jun Xu","Poly[[bis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)manganese(II)]-μ-aqua-μ-succinato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","4","m761","m763","10.1107/S1600536805009098","","","0.71073","MoKα","","0.029","0.027","","","0.074","0.075","","","","","","1.107","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205559","10.1597","0.0018","17.105","0.002","12.593","0.002","90","","100.178","0.004","90","","2154","0.6","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","cis-dichlorobis(phenanthroline-κ^2^N,N')manganese(II)","","- C24 H16 Cl2 Mn N4 -","- C24 H16 Cl2 Mn N4 -","- C96 H64 Cl8 Mn4 N16 -","4","1","OB6468","Tian-Tian Pan; Duan-Jun Xu","A polymorph of <i>cis</i>-dichlorobis(phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II)","Acta Crystallographica Section E","2005","61","4","m740","m742","10.1107/S1600536805002916","","","0.71073","MoKα","","0.099","0.075","","","0.199","0.221","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205560","7.339","0.001","7.521","0.001","12.23","0.004","98.66","0.02","99.26","0.02","111.13","0.01","605.3","0.2","291","1","","","","","","","","","","4","P -1","-P 1","2","","","","- C15 H13 N O2 -","- C15 H13 N O2 -","- C30 H26 N2 O4 -","2","1","OB6478","De Borger, Roeland; Vande Velde, Christophe M.L.; Blockhuys, Frank","(<i>E</i>)-1-(4-Methylphenyl)-2-(4-nitrophenyl)ethene","Acta Crystallographica Section E","2005","61","4","o819","o821","10.1107/S1600536805005830","","","0.71069","MoKα","","","0.0515","","","","0.1838","","","","","","1.011","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205561","6.2769","0.0016","8.6095","0.001","14.775","0.003","91.154","0.012","90.796","0.018","103.908","0.014","774.7","0.3","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","(3RS,1SR)-3-Bromo-3-(1-phenylpropyl)chroman-2,4-dione","","- C18 H15 Br O3 -","- C18 H15 Br O3 -","- C36 H30 Br2 O6 -","2","1","OB6484","Schollmeyer, Dieter; Bernd Kammerer; Christian Peifer; Stefan Laufer","(3<i>RS</i>,1<i>S</i><i>R</i>)-3-Bromo-3-(1-phenylpropyl)chroman-2,4-dione","Acta Crystallographica Section E","2005","61","4","o868","o869","10.1107/S1600536805006124","","","1.54178","CuKα","","0.0458","0.0411","","","0.1115","0.1153","","","","","","1.117","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205562","6.756","0.002","8.783","0.003","11.271","0.004","90","","90","","90","","668.8","0.4","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1R*,2S*,4S*,5S*)-Cyclohexane-1,2,4,5-tetraol","","- C6 H12 O4 -","- C6 H12 O4 -","- C24 H48 O16 -","4","1","OB6485","Goverdhan Mehta; Saikat Sen; Siddharth Dey","(1<i>R</i>*,2<i>S</i>*,4<i>S</i>*,5<i>S</i>*)-Cyclohexane-1,2,4,5-tetrol","Acta Crystallographica Section E","2005","61","4","o920","o922","10.1107/S1600536805006653","","","0.71073","MoKα","","0.0295","0.0289","","","0.0804","0.0808","","","","","","1.182","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205563","16.688","0.004","12.946","0.003","19.178","0.004","90","","111.97","0.02","90","","3842.4","1.6","93.2","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Bis[3,5-di-tert-butyl-2-hydroxybenzoato-κO]bis(dimethyl sulfoxide-κO)zinc(II)","","- C34 H54 O8 S2 Zn -","- C34 H54 O8 S2 Zn -","- C136 H216 O32 S8 Zn4 -","4","1","OB6486","Makino, Takashi; Mizuguchi, Jin","Bis[3,5-di-<i>tert</i>-butyl-2-hydroxybenzoato-κ<i>O</i>]bis(dimethyl sulfoxide-κ<i>O</i>)zinc(II)","Acta Crystallographica Section E","2005","61","4","m679","m681","10.1107/S1600536805007397","","","1.5418","CuKα","","","0.0584","","","","0.1703","","","","","","0.472","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2205564","8.043","0.001","11.877","0.001","20.233","0.003","90","","99.4","0.01","90","","1906.8","0.4","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl 3-amino-1-(2-chlorophenyl)-9-methoxy-5,6-dihydro-1H- naphtha[2,1-b]pyran-2-carboxylate","","- C22 H20 Cl N O4 -","- C22 H20 Cl N O4 -","- C88 H80 Cl4 N4 O16 -","4","1","OB6487","Xiang-Shan Wang; Zhao-Sen Zeng; Yu-Ling Li; Da-Qing Shi; Xian-Yong Wei; Zhi-Min Zong","Methyl 3-amino-1-(2-chlorophenyl)-9-methoxy-5,6-dihydro-1<i>H</i>-naphtho[2,1-<i>b</i>]pyran-2-carboxylate","Acta Crystallographica Section E","2005","61","4","o923","o925","10.1107/S1600536805006641","","","0.71073","MoKα","","0.0712","0.0397","","","0.0907","0.098","","","","","","0.869","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205565","3.782","0.001","14.84","0.004","12.942","0.003","90","","91.93","0.02","90","","726","0.3","93.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,9-Dichloro-5,12-dihydroquino[2,3-b]acridine-7,14-dione","","- C20 H10 Cl2 N2 O2 -","- C20 H10 Cl2 N2 O2 -","- C40 H20 Cl4 N4 O4 -","2","0.5","OB6489","Senju, Takatoshi; Hoki, Tomonori; Mizuguchi, Jin","2,9-Dichloro-5,12-dihydroquino[2,3-<i>b</i>]acridine-7,14-dione","Acta Crystallographica Section E","2005","61","4","o1061","o1063","10.1107/S1600536805007634","","","1.5418","CuKα","","","0.1","","","","0.35","","","","","","1.143","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205566","24.271","0.006","11.2","0.003","23.316","0.006","90","","109.679","0.003","90","","5968","3","291","2","291","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tetrakis(1,4-dimethylpyridinium) dodecamolybdophosphate nitrate","","- C28 H40 Mo12 N5 O43 P -","- C28 H40 Mo12 N5 O43 P -","- C112 H160 Mo48 N20 O172 P4 -","4","0.5","OB6490","Xue-Jie Tan; Si-Xiu Sun; Jian-Ping Ma; Shu-Lian Liu; Dian-Xiang Xing","Tetrakis(1,4-dimethylpyridinium) dodecamolybdophosphate nitrate","Acta Crystallographica Section E","2005","61","4","m711","m713","10.1107/S1600536805008044","","","0.71073","MoKα","","0.1217","0.081","","","0.1665","0.1831","","","","","","1.105","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205567","4.729","0.002","8.282","0.002","14.693","0.004","89.35","0.02","91.15","0.03","104.83","0.03","556.2","0.3","93.2","","","","","","","","","","","4","P -1","-P 1","2","","Dibenzimidazo[2,1-a:2',1'-a']anthra[2,1,9-def:6,5,10-d'e'f']diisoquinoline- 10,21-dione","","- C36 H16 N4 O2 -","- C36 H16 N4 O2 -","- C36 H16 N4 O2 -","1","0.5","OB6491","Mizuguchi, Jin","Dibenzimidazo[2,1-<i>a</i>:2',1'-<i>a</i>']anthra[2,1,9-<i>def</i>:6,5,10-<i>d</i>'<i>e</i>'<i>f</i>']diisoquinoline-10,21-dione: <i>trans</i> form (I)","Acta Crystallographica Section E","2005","61","4","o1064","o1065","10.1107/S1600536805008056","","","1.5418","CuKα","","","0.1018","","","","0.2218","","","","","","0.933","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205568","4.7501","0.0006","28.079","0.003","8.728","0.001","90","","99.21","0.01","90","","1149.1","0.2","93.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dibenzimidazo[2,1-a:2',1'-a']anthra[2,1,9-def:6,5,10-d'e'f']diisoquinoline- 10,21-dione","","- C36 H16 N4 O2 -","- C36 H16 N4 O2 -","- C72 H32 N8 O4 -","2","0.5","OB6492","Mizuguchi, Jin","Dibenzimidazo[2,1-<i>a</i>:1',2'-<i>b</i>']anthra[2,1,9-<i>def</i>:6,5,10-<i>d</i>'<i>e</i>'<i>f</i>']diisoquinoline-6,11-dione: <i>cis</i> form (II)","Acta Crystallographica Section E","2005","61","4","o1066","o1067","10.1107/S1600536805008068","","","1.5418","CuKα","","","0.0825","","","","0.1955","","","","","","1.144","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205569","3.871","0.0004","21.44","0.002","18.7091","0.0019","90","","95.555","0.002","90","","1545.5","0.3","183","2","183","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E,E,E)-1,6-Bis(4-nitrophenyl)hexa-1,3,5-triene","","- C18 H14 N2 O4 -","- C18 H14 N2 O4 -","- C72 H56 N8 O16 -","4","1","OB6494","Yoriko Sonoda; Yuji Kawanishi; Midori Goto","(<i>E</i>,<i>E</i>,<i>E</i>)-1,6-Bis(4-nitrophenyl)hexa-1,3,5-triene","Acta Crystallographica Section E","2005","61","4","o1200","o1202","10.1107/S1600536805009736","","","0.71073","MoKα","","0.0585","0.04","","","0.1047","0.1258","","","","","","1.063","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205570","9.797","0.002","10.29","0.003","13.856","0.003","90","","90","","90","","1396.8","0.6","290","2","290","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","6-tert-Butyl-4-isopropylideneamino-3-methylsulfanyl-1,2,4-triazin-5(4H)-one","","- C11 H18 N4 O S -","- C11 H18 N4 O S -","- C44 H72 N16 O4 S4 -","4","1","OB6495","Chopra, Deepak; Mohan, T. P.; Rao, K.S.; Guru Row, T. N.","6-<i>tert</i>-Butyl-4-isopropylideneamino-3-methylsulfanyl-1,2,4-triazin-5(4<i>H</i>)-one","Acta Crystallographica Section E","2005","61","4","o1112","o1114","10.1107/S1600536805008585","","","0.71073","MoKα","","0.0547","0.047","","","0.1027","0.1058","","","","","","1.151","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205571","10.044","0.002","7.2816","0.0015","25.006","0.005","90","","90","","90","","1828.8","0.6","297","2","297","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","Cu2Br4(mu-O-Py-NO2)2","Bis(μ-4-nitropyridine N-oxide-κ^2^O:O)bis[bromocopper(II)]","","- C10 H8 Br4 Cu2 N4 O6 -","- C10 H8 Br4 Cu2 N4 O6 -","- C40 H32 Br16 Cu8 N16 O24 -","4","0.5","OM6228","Twamley, Brendan","Bis(μ-4-nitropyridine <i>N</i>-oxide-κ^2^<i>O</i>:<i>O</i>)bis[dibromocopper(II)]","Acta Crystallographica Section E","2005","61","4","m619","m621","10.1107/S1600536805005441","","","0.71073","MoKα","","0.0542","0.0443","","","0.1074","0.1142","","","","","","1.073","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205572","5.995","0.004","10.54","0.004","12.586","0.006","90","","90","","90","","795.3","0.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Poly[zinc(II)-μ~2~-azido-κ^2^N^1^:N^1^-μ~3~-nicotinato-κ^3^N:O:O']","","- C6 H4 N4 O2 Zn -","- C6 H4 N4 O2 Zn -","- C24 H16 N16 O8 Zn4 -","4","1","OM6229","Chen, Hong-Ji","Poly[zinc(II)-μ~2~-azido-κ^2^<i>N</i>^1^:<i>N</i>^1^-μ~3~-nicotinato-κ^3^<i>N</i>:<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","4","m616","m618","10.1107/S1600536805005866","","","0.71073","MoKα","","0.0283","0.0242","","","0.0583","0.0599","","","","","","1.018","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205573","12.415","0.0007","12.415","0.0007","28.03","0.003","90","","90","","120","","3741.5","0.5","153","2","153","2","","","","","","","","6","R -3 :H","-R 3","148","","Hexakis(μ~4~-2-amino-2-methylpropane-1,3-diolato)hexachloroheptairon(II,III) acetonitrile disolvate monohydrate","","- C28 H62 Cl6 Fe7 N8 O13 -","- C28 H59.94 Cl6 Fe7 N8 O13 -","- C84 H179.82 Cl18 Fe21 N24 O39 -","3","0.166667","OM6230","Gaël Labat; Colette Boscovic; Hans U. Güdel","Hexakis(μ~4~-2-amino-2-methylpropane-1,3-diolato)hexachloroheptairon(II,III) acetonitrile disolvate monohydrate","Acta Crystallographica Section E","2005","61","4","m611","m613","10.1107/S160053680500557X","","","0.71073","MoKα","","0.114","0.0652","","","0.156","0.1688","","","","","","0.883","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205574","7.285","0.001","24.298","0.002","11.945","0.001","90","","93.523","0.002","90","","2110.4","0.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","μ-Piperidine-κ^2^N:N'-bis[(3-nitrobenzoato-κO)silver(I)] monohydrate","","- C18 H20 Ag2 N4 O9 -","- C18 H20 Ag2 N4 O9 -","- C72 H80 Ag8 N16 O36 -","4","1","OM6231","Li, Yu-Guang; Wang, Meng; Zhu, Hai-Liang","μ-Piperidine-κ^2^<i>N</i>:<i>N</i>'-bis[(3-nitrobenzoato-κ<i>O</i>)silver(I)] monohydrate","Acta Crystallographica Section E","2005","61","4","m667","m668","10.1107/S1600536805007026","","","0.71073","MoKα","","0.0603","0.0509","","","0.1089","0.1149","","","","","","1.045","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205575","10.492","0.0006","23.6166","0.0013","10.6391","0.0006","90","","91.436","0.001","90","","2635.4","0.3","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Di-μ~2~-Iodo-bis[(1,10-phenanthroline-κ^2^N,N')copper(I)] acetonitrile solvate","","- C26 H19 Cu2 I2 N5 -","- C26 H19 Cu2 I2 N5 -","- C104 H76 Cu8 I8 N20 -","4","1","RN6037","Zhou, Xiao-Ping; Li, Dan; Ng, Seik Weng","Di-μ~2~-Iodo-bis[(1,10-phenanthroline-κ^2^N,N')copper(I)] acetonitrile solvate","Acta Crystallographica, Section E","2005","61","4","m654","1m655","10.1107/S1600536805006458","","","0.71073","MoKα","","0.0581","0.041","","","0.0991","0.107","","","","","","1.026","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205576","4.8587","0.0011","13.228","0.003","14.612","0.003","90","","93.862","0.004","90","","937","0.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Guaninium chloride dihydrate","","- C5 H10 Cl N5 O3 -","- C5 H10 Cl N5 O3 -","- C20 H40 Cl4 N20 O12 -","4","1","RN6044","Thomas C. Lewis; Derek A. Tocher","Redetermination of guaninium chloride dihydrate","Acta Crystallographica Section E","2005","61","4","o1023","o1025","10.1107/S160053680500752X","","","0.71073","MoKα","","0.0401","0.0315","","","0.0778","0.0817","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205577","10.63","0.019","18","0.03","12.54","0.02","90","","108.75","0.03","90","","2272","7","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","N-{3-Cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl}-4- nitrobenzamide ethanol solvate","","- C20 H14 Cl2 F3 N5 O4 -","- C20 H14 Cl2 F3 N5 O4 -","- C80 H56 Cl8 F12 N20 O16 -","4","1","RZ6048","Zhong, Ping; Yang, Zhiping; Shi, Qian","<i>N</i>-{3-Cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1<i>H</i>-pyrazol-5-yl}-4-nitrobenzamide ethanol solvate","Acta Crystallographica Section E","2005","61","4","o841","o842","10.1107/S1600536805006112","","","0.71073","MoKα","","0.078","0.055","","","0.15","0.167","","","","","","1.074","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205578","6.7145","0.0012","10.931","0.002","13.616","0.003","77.464","0.003","83.116","0.003","81.47","0.003","960.8","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-[(4-methoxyphenyl)methylene]imino- 1H-pyrazole-3-enitrile","","- C19 H11 Cl2 F3 N4 O -","- C19 H11 Cl2 F3 N4 O -","- C38 H22 Cl4 F6 N8 O2 -","2","1","RZ6054","Zhang, Xiaohong; Yang, Zhiping; Zhong, Ping; Hu, Maolin","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(4-methoxyphenyl)methyleneimino]-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","4","o908","o909","10.1107/S1600536805006707","","","0.71073","MoKα","","0.125","0.09","","","0.194","0.211","","","","","","1.146","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205579","8.9637","0.0009","24.689","0.003","9.099","0.0009","90","","117.788","0.006","90","","1781.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-3-(9-Ethyl-9H-carbazol-3-yl)-1-(2-hydroxyphenyl)prop-2-en-1-one","","- C23 H19 N O2 -","- C23 H19 N O2 -","- C92 H76 N4 O8 -","4","1","RZ6055","Cao, Du-Xia; Li, Guo-Zhong; Xue, Gang; Yu, Wen-Tao; Liu, Zhi-Qiang","(<i>E</i>)-3-(9-Ethyl-9<i>H</i>-carbazol-3-yl)-1-(2-hydroxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2005","61","4","o977","o979","10.1107/S1600536805006987","","","0.71073","MoKα","","0.1091","0.0492","","","0.1114","0.1446","","","","","","0.951","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205580","5.8149","0.0005","10.9359","0.001","12.9304","0.0012","73.684","0.002","86.383","0.001","79.589","0.002","776.09","0.12","84","1","84","1","","","","","","","","3","P -1","-P 1","2","","6,8'-Dimethoxy-2,2'-spirobichroman","","- C19 H20 O4 -","- C19 H20 O4 -","- C38 H40 O8 -","2","1","RZ6056","George R. Clark; Christopher L. Flowers; Margaret A. Brimble","6,8'-Dimethoxy-2,2'-spirobichroman","Acta Crystallographica Section E","2005","61","4","o910","o911","10.1107/S1600536805006938","","","0.71073","MoKα","","0.1301","0.068","","","0.146","0.1734","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205581","5.362","0.0001","8.5764","0.0002","15.0992","0.0004","75.564","0.001","80.4","0.001","79.137","0.001","655.13","0.03","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","Diaquabis(dimethyl sulfoxide)bis(2,4-dinitrobenzoato)cobalt(II)","","- C18 H22 Co N4 O16 S2 -","- C18 H22 Co N4 O16 S2 -","- C18 H22 Co N4 O16 S2 -","1","0.5","RZ6058","Miminoshvili, Elguja B.; Miminoshvili, Ketevan E.; Sobolev, Alexandre N.","Diaquabis(dimethyl sulfoxide)bis(2,4-dinitrobenzoato)cobalt(II)","Acta Crystallographica Section E","2005","61","4","m775","m777","10.1107/S1600536805009050","","","0.71073","MoKα","","0.0307","0.0259","","","0.0721","0.0747","","","","","","1.065","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205582","4.693","0.001","19.14","0.003","12.682","0.002","90","","97.973","0.002","90","","1128.1","0.3","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(o-Tolyliminomethyl)phenol","","- C14 H13 N O -","- C14 H13 N O -","- C56 H52 N4 O4 -","4","1","RZ6059","Cheng, Kui; You, Zhong-Lu; Li, Yu-Guang; Zhu, Hai-Liang","2-(<i>o</i>-Tolyliminomethyl)phenol","Acta Crystallographica Section E","2005","61","4","o1137","o1138","10.1107/S1600536805008986","","","0.71073","MoKα","","0.1013","0.0565","","","0.1222","0.1419","","","","","","1.053","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205583","10.931","0.002","9.149","0.002","12.522","0.001","90","","110.94","0.02","90","","1169.6","0.4","298","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis[2-(o-tolyliminomethyl)phenolato]copper(II)","","- C28 H24 Cu N2 O2 -","- C28 H24 Cu N2 O2 -","- C56 H48 Cu2 N4 O4 -","2","0.5","RZ6060","Zhu, Hai-Liang; Cheng, Kui; You, Zhong-Lu; Li, Yu-Guang","Bis[2-(<i>o</i>-tolyliminomethyl)phenolato]copper(II)","Acta Crystallographica Section E","2005","61","4","m755","m756","10.1107/S1600536805009025","","","0.71073","MoKα","","0.1146","0.0597","","","0.1566","0.1969","","","","","","1.077","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205584","19.994","0.003","5.402","0.0008","9.0305","0.0015","90","","99.939","0.013","90","","960.7","0.3","130","2","130","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylaminium chloride","","- C7 H5 Cl F5 N O -","- C7 H5 Cl F5 N O -","- C28 H20 Cl4 F20 N4 O4 -","4","1","RZ6061","Maria Gdaniec","<i>O</i>-(2,3,4,5,6-Pentafluorobenzyl)hydroxylaminium chloride","Acta Crystallographica Section E","2005","61","4","o1187","o1189","10.1107/S1600536805009347","","","0.71073","MoKα","","0.0757","0.039","","","0.0807","0.0895","","","","","","0.897","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205585","12.439","0.004","16.9472","0.0018","7.4504","0.0008","90","","106.437","0.018","90","","1506.4","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-methylanilinium picrate","","- C13 H12 N4 O7 -","- C13 H12 N4 O7 -","- C52 H48 N16 O28 -","4","1","SG6000","Chellamuthu Muthamizhchelvan; Kolandaivelu Saminathan; Jan Fraanje; Rene Peschar; Kandasamy Sivakumar","3-Methylanilinium picrate","Acta Crystallographica Section E","2005","61","4","o1153","o1155","10.1107/S1600536805009189","","","1.54178","CuKα","","0.0647","0.0552","","","0.1596","0.1702","","","","","","1.067","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205586","13.636","0.006","7.218","0.003","12.467","0.006","90","","105.398","0.006","90","","1183","0.9","163","2","163","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(±)-5-Ethyl-1-methyl-5-phenylpyrimidine-2,4,6-trione","(±)-5-Ethyl-1-methyl-5-phenylpyrimidine-2,4,6-trione","","- C13 H14 N2 O3 -","- C13 H14 N2 O3 -","- C52 H56 N8 O12 -","4","1","SJ6050","Lewis, William; McKeown, Robert H.; Robinson, Ward T.","(±)-5-Ethyl-1-methyl-5-phenylpyrimidine-2,4,6-trione at 163K","Acta Crystallographica Section E","2005","61","4","o799","o800","10.1107/S1600536805005593","","","0.71073","MoKα","","0.0669","0.0421","","","0.1092","0.1273","","","","","","1.084","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205587","8.3575","0.0014","15.114","0.002","7.184","0.0012","90","","90","","90","","907.4","0.2","100","2","100","2","","","","","","","","3","P n m a","-P 2ac 2n","62","Dibromoazulene","1,3-Dibromoazulene","","- C10 H6 Br2 -","- C10 H6 Br2 -","- C40 H24 Br8 -","4","0.5","SJ6051","Chen, Xue-Yi; Dias, Jerry R.; Powell, Doug R.; Van Horn, J. David; Sandreczki, Thomas C.","1,3-Dibromoazulene","Acta Crystallographica Section E","2005","61","4","o941","o943","10.1107/S1600536805006811","","","0.71073","MoKα","","0.018","0.0162","","","0.0445","0.0457","","","","","","0.957","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205588","7.487","0.003","23.287","0.009","5.675","0.002","90","","95.579","0.007","90","","984.7","0.6","100","2","100","2","","","","","","","","3","C 1 c 1","C -2yc","9","Diiodoazulene","1,3-Diiodoazulene","","- C10 H6 I2 -","- C10 H6 I2 -","- C40 H24 I8 -","4","1","SJ6052","Chen, Xue-Yi; Dias, Jerry R.; Powell, Doug R.; Van Horn, J. David; Sandreczki, Thomas C.","1,3-Diiodoazulene","Acta Crystallographica Section E","2005","61","4","o944","o946","10.1107/S1600536805006823","","","0.71073","MoKα","","0.0212","0.0211","","","0.055","0.055","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205589","10.597","0.005","11.996","0.011","13.046","0.006","85.58","0.06","73.76","0.04","76.2","0.07","1546.2","1.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Octaureasamarium(III) triiodide","","- C8 H32 I3 N16 O8 Sm -","- C8 H32 I3 N16 O8 Sm -","- C16 H64 I6 N32 O16 Sm2 -","2","1","SJ6053","Elena V. Savinkina; Yana F. Al Ansari; Ilya A. Zamilatskov; Dmitry V. Albov; Aslan Yu. Tsivadze","Octaureasamarium(III) triiodide","Acta Crystallographica Section E","2005","61","4","m664","m666","10.1107/S1600536805006781","","","0.71073","MoKα","","0.0823","0.0363","","","0.0507","0.0581","","","","","","0.93","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205590","13.27","0.005","11.612","0.005","10.53","0.006","90","","112.48","0.03","90","","1499.3","1.3","297","2","297","2","","","","","","","","7","P 1 21 1","P 2yb","4","","Diaqua[(1R,2R)-N,N'-bis(3,5-dibromosalicylidene)cyclohexane-1,2-diamine- κ^4^O,N,N',O']manganese(III) perchlorate dihydrate","","- C20 H24 Br4 Cl Mn N2 O10 -","- C20 H16 Br4 Cl Mn N2 O10 -","- C40 H32 Br8 Cl2 Mn2 N4 O20 -","2","1","SJ6054","Akitsu, Takashiro; Takeuchi, Yuiri; Einaga, Yasuaki","Diaqua[(1<i>R</i>,2<i>R</i>)-<i>N</i>,<i>N</i>'-bis(3,5-dibromosalicylidene)cyclohexane-1,2-diamine-κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>']manganese(III) perchlorate dihydrate","Acta Crystallographica Section E","2005","61","4","m772","m774","10.1107/S1600536805009062","","","0.71073","MoKα","","0.1037","0.0416","","","0.0983","0.1224","","","","","","1.008","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205591","7.547","0.003","9.122","0.002","11.437","0.003","107.905","0.002","108.506","0.004","92.139","0.003","702.5","0.4","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","2-(2,3-Dimethoxyphenyl)chroman-4-one","","- C17 H16 O4 -","- C17 H16 O4 -","- C34 H32 O8 -","2","1","SJ6057","Hui Wu; Zhou Xu; Jun Zhou; Yongmin Liang","2-(2,3-Dimethoxyphenyl)chroman-4-one","Acta Crystallographica Section E","2005","61","4","o1095","o1096","10.1107/S160053680500838X","","","0.71073","MoKα","","0.1093","0.0514","","","0.1065","0.126","","","","","","1.001","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205592","28.991","0.002","5.9448","0.0005","21.5013","0.0018","90","","111.848","0.002","90","","3439.5","0.5","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[bis[4,4'-oxydibenzoato(1-)]cadmium(II)]-μ-1,2-di-4- pyridylethylene]","","- C40 H28 Cd N2 O10 -","- C40 H28 Cd N2 O10 -","- C160 H112 Cd4 N8 O40 -","4","0.5","SJ6058","Yin, De-Wu; Xiao, Hong-Ping","<i>catena</i>-Poly[[bis[4,4'-oxydibenzoato(1‒)]cadmium(II)]-μ-1,2-di-4-pyridylethylene]","Acta Crystallographica Section E","2005","61","4","m708","m710","10.1107/S1600536805008007","","","0.71073","MoKα","","0.0637","0.056","","","0.1191","0.1231","","","","","","1.209","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205593","7.6386","0.0009","8.259","0.002","15.761","0.0012","84.415","0.012","89.48","0.008","74.529","0.019","953.6","0.3","292","2","292","2","","","","","","","","3","P 1","P 1","1","","17-Oxo-5β-hydroxyandrostan-3β-yl acetate","","- C21 H32 O4 -","- C21 H32 O4 -","- C42 H64 O8 -","2","2","SJ6059","Andrade, L. C. R.; Paixão, J. A.; de Almeida, M. J. M.; Tavares da Silva, E. J.; Fernandes Roleira, F. M.","17-Oxo-5β-hydroxyandrostan-3β-yl acetate","Acta Crystallographica Section E","2005","61","4","o1144","o1146","10.1107/S1600536805008895","","","1.5418","CuKα","","0.0358","0.0324","","","0.0882","0.092","","","","","","1.057","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205594","8.7176","0.0004","7.5589","0.0003","17.5879","0.0007","90","","100.666","0.002","90","","1138.94","0.08","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl β-N-(3-nitrophenylmethylene)dithiocarbazate","","- C9 H9 N3 O2 S2 -","- C9 H9 N3 O2 S2 -","- C36 H36 N12 O8 S8 -","4","1","SJ6063","Yan-Ling Zhang; Shang Shan; Duan-Jun Xu","Methyl β-<i>N</i>-(3-nitrophenylmethylene)dithiocarbazate","Acta Crystallographica Section E","2005","61","4","o1173","o1175","10.1107/S1600536805009281","","","0.71073","MoKα","","0.059","0.032","","","0.074","0.079","","","","","","0.876","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205595","6.044","0.0004","14.6516","0.0009","16.8653","0.0011","90","","100.266","0.005","90","","1469.58","0.17","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Benzoin thiosemicarbazone","","- C15 H15 N3 O S -","- C15 H15 N3 O S -","- C60 H60 N12 O4 S4 -","4","1","SU6174","Dinçer, Muharrem; Özdemir, Namık; Çukurovalı, Alaaddin; Yılmaz, İbrahim","Benzoin thiosemicarbazone","Acta Crystallographica Section E","2005","61","4","o880","o883","10.1107/S160053680500646X","","","0.71073","MoKα","","0.0482","0.0362","","","0.1027","0.1067","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205596","24.733","0.009","4.42","0.002","12.376","0.004","90","","90.72","0.006","90","","1352.8","0.9","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Chloro-2-(1-naphthyliminomethyl)phenol","","- C17 H12 Cl N O -","- C17 H12 Cl N O -","- C68 H48 Cl4 N4 O4 -","4","1","SU6175","Li, Zong-Xiao; Zhang, Xin-Li","4-Chloro-2-(1-naphthyliminomethyl)phenol","Acta Crystallographica Section E","2005","61","4","o875","o876","10.1107/S1600536805006392","","","0.71073","MoKα","","0.0954","0.0554","","","0.1089","0.1249","","","","","","0.995","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205597","21.893","0.009","7.756","0.003","13.187","0.007","90","","112.23","0.03","90","","2072.7","1.7","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","(1S*,4aR*,8aR*)-decahydronaphthalene-1-carboxylic acid","","- C11 H18 O2 -","- C11 H18 O2 -","- C88 H144 O16 -","8","1","SU6176","Davison, Mark; Lalancette, Roger A.; Thompson, Hugh W.","Formation of non-centrosymmetric dimers in (1<i>S</i>*,4a<i>R</i>*,8a<i>R</i>*)-decahydronaphthalene-1-carboxylic acid","Acta Crystallographica Section E","2005","61","4","o877","o879","10.1107/S1600536805006410","","","0.71073","MoKα","","0.087","0.055","","","0.14","0.162","","","","","","1.01","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205598","23.469","0.005","8.953","0.005","8.492","0.005","90","0.005","95.879","0.005","90","0.005","1774.9","1.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4,5-Bis(pivaloylsulfanyl)-1,3-dithiolane-2-thione","","- C13 H18 O2 S5 -","- C13 H18 O2 S5 -","- C52 H72 O8 S20 -","4","0.5","SU6177","Wang, Yan Ling; Yu, Wen Tao; Xu, Dong; Wang, Xin Qiang; Zhang, Guang Hui","4,5-Bis(pivaloylsulfanyl)-1,3-dithiolane-2-thione","Acta Crystallographica Section E","2005","61","4","o971","o973","10.1107/S160053680500721X","","","0.71069","MoKα","","0.0782","0.0607","","","0.1578","0.1695","","","","","","1.076","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205599","30.514","0.003","8.436","0.002","7.742","0.002","90","","90","","90","","1992.9","0.7","273","2","298","2","","","","","","","","5","C m c 21","C 2c -2","36","","{1,1'-[Propane-1,3-diylbis(nitrilomethylidyne)]di-2-naphtholato}iron(II)","","- C25 H20 Fe N2 O2 -","- C25 H20 Fe N2 O2 -","- C100 H80 Fe4 N8 O8 -","4","0.5","SU6178","Zhao, Bin; Sun, Yu-Xi","{1,1'-[Propane-1,3-diylbis(nitrilomethylidyne)]di-2-naphtholato}iron(II)","Acta Crystallographica Section E","2005","61","4","m652","m653","10.1107/S1600536805006409","","","0.71073","MoKα","","0.0494","0.04","","","0.0916","0.0963","","","","","","0.996","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205600","19.288","0.004","15.84","0.003","15.485","0.003","90","","124.297","0.003","90","","3908.4","1.3","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N,N'-Bis(3-nitrobenzylidene)-trans-1,2-cyclohexanediamine","","- C20 H20 N4 O4 -","- C20 H20 N4 O4 -","- C160 H160 N32 O32 -","8","1","SU6179","Liu, Zhao-Di; Tan, Min-Yu; Zhu, Hai-Liang","<i>N</i>,<i>N</i>'-Bis(3-nitrobenzylidene)-<i>trans</i>-1,2-cyclohexanediamine","Acta Crystallographica Section E","2005","61","4","o962","o963","10.1107/S1600536805007099","","","0.71073","MoKα","","0.206","0.093","","","0.1561","0.1988","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205601","10.912","0.007","7.797","0.005","20.777","0.013","90","","96.899","0.013","90","","1754.9","1.9","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis{2-[3-(cyclohexylammonio)propyliminomethyl]phenolato}dithiocyanatocobalt(II)","","- C34 H48 Co N6 O2 S2 -","- C34 H48 Co N6 O2 S2 -","- C68 H96 Co2 N12 O4 S4 -","2","0.5","SU6180","Yue, Guo-Ren; Shi, Yu-Zhen; Lin, Min; Feng, Lei","Bis{2-[3-(cyclohexylammonio)propyliminomethyl]phenolato}dithiocyanatocobalt(II)","Acta Crystallographica Section E","2005","61","4","m720","m721","10.1107/S1600536805008251","","","0.71073","MoKα","","0.1326","0.0609","","","0.1345","0.192","","","","","","0.844","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205602","10.216","0.001","15.053","0.002","10.61","0.001","90","","91.164","0.002","90","","1631.3","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[N,N-Dimethyl-N'-(2-pyridylmethylene)ethane-1,2-diamine]dithiocyanatocopper(II)","","- C12 H15 Cu N5 S2 -","- C12 H15 Cu N5 S2 -","- C48 H60 Cu4 N20 S8 -","4","1","SU6181","Yue, Guo-Ren; Xu, Xin-Jian; Shi, Yu-Zhen; Feng, Lei","[<i>N,N</i>-Dimethyl-<i>N</i>'-(2-pyridylmethylene)ethane-1,2-diamine]dithiocyanatocopper(II)","Acta Crystallographica Section E","2005","61","4","m693","m694","10.1107/S1600536805007567","","","0.71073","MoKα","","0.0625","0.039","","","0.0975","0.1098","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205603","11.75","0.002","7.41","0.002","33.842","0.007","90","","90","","90","","2946.5","1.1","298","2","295","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","catena-Poly[[[4-bromo-2-(2-dimethylaminoethyliminomethyl)phenolato]zinc(II)]- μ-thiocyanato]","","- C12 H14 Br N3 O S Zn -","- C12 H14 Br N3 O S Zn -","- C96 H112 Br8 N24 O8 S8 Zn8 -","8","2","SU6182","Yue, Guo-Ren; Lei, Xin-You; Xu, Xin-Jian; Xue, Guo-Qing","<i>catena</i>-Poly[[[4-bromo-2-(2-dimethylaminoethyliminomethyl)phenolato]zinc(II)]-μ-thiocyanato]","Acta Crystallographica Section E","2005","61","4","m722","m724","10.1107/S1600536805008305","","","0.71073","MoKα","","0.0539","0.0405","","","0.0869","0.0933","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205604","6.413","0.002","7.285","0.003","15.654","0.006","97.229","0.004","92.625","0.004","105.2","0.005","697.8","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2,4,6-triamino-1,3,5-triazin-1-ium 4-methylbenzenesulfonate monohydrate","","- C10 H16 N6 O4 S -","- C10 H16 N6 O4 S -","- C20 H32 N12 O8 S2 -","2","1","TK6211","Li, Xue-Mei; Lu, Li-Ping; Feng, Si-Si; Zhang, Hong-Mei; Qin, Shi-Dong; Zhu, Miao-Li","2,4,6-Triamino-1,3,5-triazin-1-ium 4-methylbenzenesulfonate monohydrate","Acta Crystallographica Section E","2005","61","4","o811","o813","10.1107/S1600536805005842","","","0.71073","MoKα","","0.052","0.046","","","0.132","0.136","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205605","11.909","0.004","6.166","0.002","16.937","0.006","90","","110.278","0.007","90","","1166.6","0.7","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,4:5,8-dimethano-1,1a,4,4a,5,5a,8,8a-octahydroanthracene-9,10-dione","","- C16 H16 O2 -","- C16 H16 O2 -","- C64 H64 O8 -","4","1","TK6215","Andrey A. Yakovenko; Fedor M. Dolgushin","Redetermination of the Diels‒Alder diadduct of 1,4-benzoquinone and cyclopentadiene: 1,4:5,8-dimethano-1,1a,4,4a,5,5a,8,8a-octahydroanthracene-9,10-dione","Acta Crystallographica Section E","2005","61","4","o1178","o1179","10.1107/S1600536805009311","","","0.71073","MoKα","","0.05","0.042","","","0.081","0.084","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205606","10.061","0.002","11.763","0.002","19.337","0.004","100.87","0.03","100.71","0.03","108.14","0.03","2061.1","0.9","293","2","","","","","","","","","","6","P -1","-P 1","2","","trans-Carbonylchlorobis(tri-m-tolylphosphino)rhodium(I) dichloromethane solvate","","- C44 H44 Cl3 O P2 Rh -","- C44 H44 Cl3 O P2 Rh -","- C88 H88 Cl6 O2 P4 Rh2 -","2","1","WK6036","Meijboom, Reinout; Muller, Alfred; Roodt, Andreas","<i>trans</i>-Carbonylchlorobis(tri-<i>m</i>-tolylphosphino)rhodium(I) dichloromethane solvate","Acta Crystallographica Section E","2005","61","4","m699","m701","10.1107/S1600536805005738","","","0.71073","MoKα","","","0.0617","","","","0.1509","","","","","","1.015","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2205607","11.496","0.002","13.755","0.003","15.052","0.003","110.74","0.01","93.45","0.01","100.09","0.01","2172.1","0.8","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Hemi[4-(carboxymethoxy)phenylsulfanylacetato-κ^2^O,O']hemi[4- (carboxymethylsulfanyl)phenyloxyacetato]bis(1,10-phenanthroline- κ^2^N,N')cadmium(II) 4-(carboxymethoxy)phenylsulfanylacetate dihydrate","","- C44 H38 Cd N4 O12 S2 -","- C44 H38 Cd N4 O12 S2 -","- C88 H76 Cd2 N8 O24 S4 -","2","1","WK6040","Huo, Li-Hua; Gao, Shan; Zhao, Hui; Ng, Seik Weng","Hemi[4-(carboxymethoxy)phenylsulfanylacetato-κ^2^<i>O,O</i>']hemi[4-(carboxymethylsulfanyl)phenyloxyacetato]bis(1,10-phenanthroline-κ^2^<i>N,N</i>')cadmium(II) 4-(carboxymethoxy)phenylsulfanylacetate dihydrate","Acta Crystallographica Section E","2005","61","4","m727","m729","10.1107/S1600536805006665","","","0.71073","MoKα","","0.091","0.062","","","0.181","0.203","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","211332","2020-10-21","18:00:00",""
"2205608","6.902","0.002","9.036","0.002","15.164","0.004","103.6","0.01","93.36","0.01","108.75","0.01","861.1","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","μ-[2,8-Dimethyl-5,11-bis(dimethylethyleneamine)-1,4,5,6,7,10,11,12- octahydroimidazo[4,5-h]imidazo[4,5-c][1,6]diazecine]bis[aquasulfatocopper(II)] hexahydrate","","- C20 H52 Cu2 N8 O16 S2 -","- C20 H52 Cu2 N8 O16 S2 -","- C20 H52 Cu2 N8 O16 S2 -","1","0.5","WK6042","Gasque, Laura; Mijangos, Edgar; Ortiz-Frade, Luis","[μ-5,11-Bis(dimethylethyleneamino)-2,8-dimethyl-1,4,5,6,7,10,11,12-octahydroimidazo[4,5-<i>h</i>]imidazo[4,5-<i>c</i>][1,6]diazecine]bis[aquasulfatocopper(II)] hexahydrate: a dinuclear copper sulfate complex based on a diazecine ligand","Acta Crystallographica Section E","2005","61","4","m673","m676","10.1107/S1600536805006896","","","0.71073","MoKα","","0.1276","0.0609","","","0.1179","0.1482","","","","","","0.978","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205609","15.641","0.002","14.2886","0.0018","17.112","0.002","90","","112.678","0.002","90","","3528.7","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Benzoyl-1-tert-butyl-2-(2-tert-butyl-1,2-dibenzoylhydrazinosulfanyl)- 1-(3,5-dimethylbenzoyl)hydrazine","","- C38 H42 N4 O4 S -","- C38 H42 N4 O4 S -","- C152 H168 N16 O16 S4 -","4","1","WK6044","Shang, Jian; Wang, Qing-Min; Song, Hai-Bin; Huang, Run-Qiu; Chen, Li; Mao, Chun-Hui","2-Benzoyl-1-<i>tert</i>-butyl-2-(1,2-dibenzoyl-2-<i>tert</i>-butylhydrazinosulfanyl)-1-(3,5-dimethylbenzoyl)hydrazine","Acta Crystallographica Section E","2005","61","4","o936","o938","10.1107/S1600536805006537","","","0.71073","MoKα","","0.113","0.045","","","0.104","0.137","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205610","9.4362","0.0005","13.9625","0.0007","10.1948","0.0005","90","","90.78","0.001","90","","1343.07","0.12","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Octapotassium di-μ-sulfato-κ^2^O:O'-bis[cis-dioxo-cis-disulfatotungstate(VI)]","","- K8 O28 S6 W2 -","- K8 O28 S6 W2 -","- K16 O56 S12 W4 -","2","0.5","WM6051","Susan J. Cline Schäffer; Rolf W. Berg","Potassium bis(μ-sulfato-1κ<i>O</i>:2κ<i>O</i>')bis[<i>cis</i>-dioxido-<i>cis</i>-bis(sulfato-κ<i>O</i>)tungstate(VI)]","Acta Crystallographica Section E","2005","61","4","i49","i51","10.1107/S1600536805007579","","","0.71073","MoKα","","0.0136","0.0132","","","0.0309","0.0311","","","","","","1.125","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205611","6.946","0.002","6.157","0.002","11.172","0.006","90","","90","","90","","477.8","0.3","293","2","293","2","","","","","","","","5","P m n 21","P 2ac -2","31","","ammonium hexaaquacobalt(II) orthophosphate","","- Co H16 N O10 P -","- Co H16 N O10 P -","- Co2 H32 N2 O20 P2 -","2","0.5","WM6054","El Bali, Brahim; Esseli, Rachid; Capitelli, Francesco; Lachkar, Mohammed","Reinvestigation of NH~4~[Co(H~2~O)~6~]PO~4~ based on single-crystal data","Acta Crystallographica Section E","2005","61","4","i52","i54","10.1107/S1600536805007245","","","0.71073","MoKα","","0.0385","0.0293","","","0.0634","0.0663","","","","","","1.08","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2205612","16.292","0.001","7.2154","0.0006","13.68","0.001","90","","90","","90","","1608.1","0.2","193","2","193","2","","","","","","","","4","P c a 21","P 2c -2ac","29","caesium thorium phyllosilicate","cesium thorium(IV) silicate","","- Cs2 O15 Si6 Th -","- Cs2 O15 Si6 Th -","- Cs8 O60 Si24 Th4 -","4","1","WM6055","Woodward, Jonathan D.; Almond, Philip M.; Albrecht-Schmitt, Thomas E.","Caesium thorium silicate, Cs~2~ThSi~6~O~15~","Acta Crystallographica, Section E","2005","61","4","i58","i60","10.1107/S1600536805008421","","","0.71073","MoKα","","0.0405","0.0353","","","0.0744","0.0759","","","","","","1.066","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2205613","7.067","0.001","7.368","0.001","7.852","0.001","81.23","0.01","70.68","0.01","88.54","0.01","381.18","0.09","301","2","301","2","","","","","","","","5","P -1","-P 1","2","","Diammonium cobalt(II) dihydrogendiphosphate(V) dihydrate","","- Co H16 N2 O16 P4 -","- Co H16 N2 O16 P4 -","- Co H16 N2 O16 P4 -","1","0.5","WM6057","Essehli, Rachid; Lachkar, Mohammed; Svoboda, Ingrid; Fuess, Hartmut; El Bali, Brahim","(NH~4~)~2~[Co(H~2~P~2~O~7~)~2~(H~2~O)~2~]","Acta Crystallographica Section E","2005","61","4","i61","i63","10.1107/S1600536805008639","","","0.71073","MoKα","","0.0366","0.0338","","","0.0834","0.0851","","","","","","1.015","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205614","7.0344","0.0009","7.3214","0.0009","7.792","0.001","81.53","0.01","70.91","0.01","88.21","0.01","375.03","0.09","301","2","301","2","","","","","","","","5","P -1","-P 1","2","","Diammonium nickel(II) dihydrogendiphosphate(V) dihydrate","","- H16 N2 Ni O16 P4 -","- H16 N2 Ni O16 P4 -","- H16 N2 Ni O16 P4 -","1","0.5","WM6058","Essehli, Rachid; Lachkar, Mohammed; Svoboda, Ingrid; Fuess, Hartmut; El Bali, Brahim","(NH~4~)~2~[Ni(H~2~P~2~O~7~)~2~(H~2~O)~2~]","Acta Crystallographica Section E","2005","61","4","i64","i66","10.1107/S1600536805008640","","","0.71073","MoKα","","0.0341","0.033","","","0.1059","0.1069","","","","","","1.078","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205615","9.4794","0.0011","7.9025","0.0009","16.2016","0.0019","90","","94.089","0.003","90","","1210.6","0.2","110","2","110","2","","","","","","","","4","P 1 21 1","P 2yb","4","Amygdalin tri-hydrate","(R)-1-cyano-1-(phenylmethyl)-β-D-glucopyranosyl-(1→6)-β-D- glucopyranoside","","- C20 H33 N O14 -","- C20 H33 N O14 -","- C40 H66 N2 O28 -","2","1","WN6326","Eriksson, Lars; Widmalm, Göran","Amygdalin trihydrate","Acta Crystallographica Section E","2005","61","4","o860","o862","10.1107/S1600536805006227","","","0.891","synchrotron","","0.0407","0.0372","","","0.0959","0.0973","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205616","15.554","0.006","10.012","0.004","8.856","0.004","90","","96.217","0.008","90","","1371","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-[(2-Hydroxybenzylidene)hydrazinocarbonyl]-1H-1,2,4-triazole ethanol solvate","","- C12 H15 N5 O3 -","- C12 H15 N5 O3 -","- C48 H60 N20 O12 -","4","1","WN6328","Chang-Hua Ge; Jian-Guo Yang; Fu-You Pan","3-[(2-Hydroxybenzylidene)hydrazinocarbonyl]-1<i>H</i>-1,2,4-triazole ethanol solvate","Acta Crystallographica Section E","2005","61","4","o833","o835","10.1107/S1600536805006069","","","0.71073","MoKα","","0.1293","0.0764","","","0.2018","0.2293","","","","","","0.959","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205617","5.4716","0.0004","12.48","0.001","16.695","0.001","90","","90","","90","","1140.03","0.14","292","2","295","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2,2'-Diaminodibenzyl","","- C14 H16 N2 -","- C14 H16 N2 -","- C56 H64 N8 -","4","1","WN6331","Narasegowda, R. S.; Malathy Sony, S. M.; Mondal, S.; Nagaraj, B.; Yathirajan, H. S.; Narasimhamurthy, T.; Charles, P.; Ponnuswamy, M. N.; Nethaji, M.; Rathore, R. S.","2,2'-Diaminodibenzyl: a rare case of crystallographically non-compliant molecular symmetry","Acta Crystallographica Section E","2005","61","4","o843","o845","10.1107/S1600536805006021","","","0.71073","MoKα","","0.0446","0.04","","","0.0998","0.1025","","","","","","1.108","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205618","7.7442","0.0011","8.6866","0.0012","8.7559","0.0012","90.213","0.003","110.427","0.003","103.074","0.003","535.46","0.13","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H18 Cd2 Cl4 N6 S2 -","- C12 H18 Cd2 Cl4 N6 S2 -","- C12 H18 Cd2 Cl4 N6 S2 -","1","0.5","WN6332","Radosavljević Evans, Ivana; Mészáros Szécsényi, Katalin; Leovac, Vukadin M.","Di-μ-chloro-bis{chloro[3,5-dimethyl-1-(thiocarbamoyl)pyrazole-κ^2^<i>N</i>^2^,<i>S</i>]cadmium(II)}","Acta Crystallographica Section E","2005","61","4","m641","m643","10.1107/S1600536805006173","","","0.71073","MoKα","","0.0313","0.0234","","0.0544","0.0526","0.0526","","","","","","0.9109","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205619","7.663","0.004","12.119","0.007","18.303","0.009","90","","93.217","0.014","90","","1697.1","1.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-[(2-Hydroxyphenyl)amino]-1-phenylbut-3-en-1-one ethanol solvate","","- C18 H21 N O3 -","- C18 H21 N O3 -","- C72 H84 N4 O12 -","4","1","WN6333","Yao-Cheng Shi","3-[(2-Hydroxyphenyl)amino]-1-phenylbut-3-en-1-one ethanol solvate","Acta Crystallographica Section E","2005","61","4","o1130","o1132","10.1107/S1600536805008925","","","0.71073","MoKα","","0.1115","0.0582","","","0.1584","0.1891","","","","","","1.029","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205620","14.031","0.003","5.5082","0.001","14.601","0.003","90","","107.412","0.003","90","","1076.7","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-Phenylalaninium malonate L-phenylalanine","","- C21 H26 N2 O8 -","- C21 H26 N2 O8 -","- C42 H52 N4 O16 -","2","1","WN6334","M. Alagar; R. V. Krishnakumar; P. Parimala Devi; S. Natarajan","<small>L</small>-Phenylalanine <small>L</small>-phenylalaninium malonate","Acta Crystallographica Section E","2005","61","4","o992","o994","10.1107/S1600536805007014","","","0.71073","MoKα","","0.056","0.0351","","","0.0903","0.1012","","","","","","1.056","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205621","8.5622","0.0004","14.0393","0.0007","14.7524","0.0007","90","","90","","90","","1773.35","0.15","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","Bis-(3-methyl-4-aminopyridine)-Zinc(II)isothiocyanate","Bis(4-amino-3-methylpyridine)diisothiocyanatozinc(II)","","- C14 H16 N6 S2 Zn -","- C14 H16 N6 S2 Zn -","- C56 H64 N24 S8 Zn4 -","4","0.5","WN6335","Suchada Chantrapromma; Hoong-Kun Fun; Xiao-Jun Feng; Jia-Xiang Yang; Jie-Ying Wu; Yu-Peng Tian","Bis(4-amino-3-methylpyridine)diisothiocyanatozinc(II)","Acta Crystallographica Section E","2005","61","4","m733","m735","10.1107/S160053680500810X","","","0.71073","MoKα","","0.0402","0.0312","","","0.0815","0.0894","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205622","8.7855","0.0007","9.8033","0.0007","14.874","0.001","88.368","0.001","79.065","0.001","64.09","0.001","1129.21","0.14","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","3-Bromo-2-(2-bromo-4,5-dimethoxybenzyl)-1-phenylsulfonyl-1H-indole","","- C23 H19 Br2 N O4 S -","- C23 H19 Br2 N O4 S -","- C46 H38 Br4 N2 O8 S2 -","2","1","WN6336","T. Ravishankar; K. Chinnakali; N. Arumugam; P. C. Srinivasan; Anwar Usman; Hoong-Kun Fun","3-Bromo-2-(2-bromo-4,5-dimethoxybenzyl)-1-phenylsulfonyl-1<i>H</i>-indole","Acta Crystallographica Section E","2005","61","4","o998","o1000","10.1107/S1600536805007348","","","0.71073","MoKα","","0.0904","0.0416","","","0.0816","0.0998","","","","","","1.003","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205623","8.232","0.004","6.065","0.003","16.71","0.009","90","","97.864","0.006","90","","826.4","0.7","292.15","","292.15","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,4-Bis(4-dimethylaminobenzyl)-2,3-diaza-1,3-butadiene","","- C18 H22 N4 -","- C18 H22 N4 -","- C36 H44 N8 -","2","0.5","WN6337","Qing-Hua Wang; Guo-Cong Guo; Ming-Sheng Wang","1,4-Bis(4-dimethylaminobenzyl)-2,3-diaza-1,3-butadiene","Acta Crystallographica Section E","2005","61","4","o1156","o1157","10.1107/S1600536805008664","","","0.71073","MoKα","","0.1004","0.065","","","0.1475","0.1669","","","","","","1.098","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205624","9.6003","0.0011","13.0545","0.0015","7.6874","0.0009","90","","90","","90","","963.44","0.19","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","2,4-Dichloro-6-morpholino-1,3,5-triazine","","- C7 H8 Cl2 N4 O -","- C7 H8 Cl2 N4 O -","- C28 H32 Cl8 N16 O4 -","4","0.5","WN6338","Dong, Chuan-Ming; Chen, Li-Gong; Duan, Xue-Min; Shu, Xue-Gui; Zeng, Tao; Yan, Xi-Long","2,4-Dichloro-6-morpholino-1,3,5-triazine","Acta Crystallographica Section E","2005","61","4","o1168","o1169","10.1107/S1600536805008949","","","0.71073","MoKα","","0.035","0.0292","","","0.0837","0.0866","","","","","","1.081","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205625","9.877","0.002","4.6915","0.001","32.603","0.006","90","","106.25","0.01","90","","1450.4","0.5","105","2","105","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","DL-methionine","DL-methionine","","- C5 H11 N O2 S -","- C5 H11 N O2 S -","- C40 H88 N8 O16 S8 -","8","1","WN6339","M. Alagar; R. V. Krishnakumar; A. Mostad; S. Natarajan","β-<small>DL</small>-Methionine at 105 K","Acta Crystallographica Section E","2005","61","4","o1165","o1167","10.1107/S1600536805009141","","","0.71073","MoKα","","0.0422","0.0408","","","0.0996","0.1003","","","","","","1.231","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205626","9.8818","0.0005","24.3572","0.0013","9.7867","0.0005","90","","99.42","0.001","90","","2323.8","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(3-Bromo-1-phenylsulfonyl-1H-indole-2-ylmethylsulfanyl)-6-methyl-1H- benzimidazole","","- C23 H18 Br N3 O2 S2 -","- C23 H18 Br N3 O2 S2 -","- C92 H72 Br4 N12 O8 S8 -","4","1","WN6342","T. Ravishankar; K. Chinnakali; N. Arumugam; P. C. Srinivasan; Anwar Usman; Hoong-Kun Fun","2-(3-Bromo-1-phenylsulfonyl-1<i>H</i>-indol-2-ylmethylsulfanyl)-6-methyl-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2005","61","4","o1184","o1186","10.1107/S1600536805009414","","","0.71073","MoKα","","0.092","0.0721","","","0.2029","0.2187","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205627","5.8037","0.0007","12.0508","0.0015","20.16","0.003","90","","90","","90","","1410","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2S)-1-(2-Hydroxy-1-naphthylmethyl)pyrrolidinio-2-carboxylate","","- C16 H17 N O3 -","- C16 H17 N O3 -","- C64 H68 N4 O12 -","4","1","WW6352","Dong, Chuan-Ming; Chen, Li-Gong; Duan, Xue-Min; Shu, Xue-Gui; Zeng, Tao; Li, Yang","<i>N</i>-(2-Hydroxy-1-naphthylmethyl)-(<i>S</i>)-proline","Acta Crystallographica Section E","2005","61","4","o960","o961","10.1107/S1600536805006859","","","0.71073","MoKα","","0.0661","0.0387","","","0.0985","0.1131","","","","","","1.042","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205628","19.508","0.002","10.731","0.001","25.92","0.004","90","","108.666","0.002","90","","5140.7","1.1","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","16α,17-Epoxy-11α-(p-tolylsulfonyloxy)pregn-4-ene-3,20-dione","17-acetyl-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17- tetradecahydro-1H-20-oxacyclopropa[16,17]cyclopenta[a]phenanthren-11-yl toluene-4-sulfonate","","- C28 H34 O6 S -","- C28 H34 O6 S -","- C224 H272 O48 S8 -","8","2","WW6358","Nie, Qiang; Wang, Jingkang; Wang, Shi; Zhang, Meijing","16α,17-Epoxy-11α-(<i>p</i>-tolylsulfonyloxy)pregn-4-ene-3,20-dione","Acta Crystallographica Section E","2005","61","4","o912","o913","10.1107/S1600536805006835","","","0.71073","MoKα","","0.0906","0.0463","","","0.0923","0.1044","","","","","","1.009","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205629","7.9225","0.0011","8.0119","0.001","11.7565","0.0014","83.979","0.002","86.251","0.002","64.422","0.002","669.22","0.15","293","2","293","2","","","","","","","","3","P -1","-P 1","2","1,2-dihydrotanshinquinone","8,9-Dihydro-1,6-dimethylphenanthro[1,2-b]furan-10,11-dione","","- C18 H14 O3 -","- C18 H14 O3 -","- C36 H28 O6 -","2","1","WW6359","Qin, Jiang-Ke; Liao, Cheng-Zhu; Wang, Yong-Tao; Bu, Xian-Zhang; Huang, Zhi-Shu; Gu, Lian-Quan","8,9-Dihydro-1,6-dimethylphenanthro[1,2-<i>b</i>]furan-10,11-dione","Acta Crystallographica Section E","2005","61","4","o804","o805","10.1107/S1600536805005581","","","0.71073","MoKα","","0.0479","0.0402","","","0.117","0.1265","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205630","9.702","0.003","6.093","0.002","14.64","0.005","90","","100.914","0.001","90","","849.8","0.5","123.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H23 Br O2 -","- C20 H23 Br O2 -","- C40 H46 Br2 O4 -","2","1","YA6235","Masataka Watanabe; Taisuke Matsumoto; Shuntaro Mataka; Thies Thiemann","17-Bromo-16-formyl-3-methoxyestra-1,3,5(10),16-tetraene","Acta Crystallographica Section E","2005","61","4","o974","o976","10.1107/S160053680500704X","","","0.7107","MoKα","","","0.023","","","","0.061","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205631","11.2952","0.0008","11.2952","0.0008","4.5325","0.0004","90","","90","","120","","500.79","0.07","100","","100","","","","","","","","","4","P 32","P 32","145","","2-Iodoaniline","","- C6 H6 I N -","- C6 H6 I N -","- C18 H18 I3 N3 -","3","1","YA6240","Andrew Parkin; Christopher K. Spanswick; Colin R. Pulham; Chick C. Wilson","2-Iodoaniline at 100 K","Acta Crystallographica Section E","2005","61","4","o1087","o1089","10.1107/S1600536805007038","","","0.71073","MoKα","","0.058","0.048","","0.124","0.119","0.124","","","","","","0.999","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205632","10.4015","0.0016","23.653","0.004","32.204","0.005","90","","90","","90","","7923","2","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2α,3β,12β,20S-Trihydroxydammar-24-ene 20-O-β-D-glucopyranoside","","- C38.5 H72 O11.5 -","- C38.5 H72 O11.5 -","- C308 H576 O92 -","8","2","AC6165","Valentina Razmovski-Naumovski; Rujee K. Duke; Peter Turner; Colin C. Duke","(20<i>S</i>)-2α,3β,12β-Trihydroxydammar-24-ene 20-<i>O</i>-β-<small>D</small>-glucopyranoside (Gynosaponin TN1) as the 2.5-methanol solvate","Acta Crystallographica Section E","2005","61","5","o1239","o1241","10.1107/S1600536805009773","","","0.71073","MoKα","","0.0634","0.0549","","","0.1525","0.1583","","","","","","1.38","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2205633","8.572","0.0002","21.1088","0.0005","19.352","0.0006","90","","93.556","0.001","90","","3494.9","0.16","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C66 H98 Cl6 N10 O4 -","- C66 H98 Cl6 N10 O4 -","- C132 H196 Cl12 N20 O8 -","2","0.5","AC6167","Light, Mark E.; Gale, Philip A.; Navakhun, Korakot","1,4-Phenylene-bis-(3,4-dichloro-5-phenylcarbamoyl-1<i>H</i>-pyrrole-2-carboxamide) bis(tetrabutylammonium chloride) acetonitrile disolvate","Acta Crystallographica Section E","2005","61","5","o1300","o1301","10.1107/S1600536805010688","","","0.71073","MoKα","","0.0978","0.0596","","","0.1312","0.1438","","","","","","1.105","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205634","9.524","0.002","10.363","0.003","17.056","0.004","78.293","0.011","88.733","0.014","80.136","0.014","1623.9","0.7","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H94 Cl4 N8 O4 -","- C64 H94 Cl4 N8 O4 -","- C64 H94 Cl4 N8 O4 -","1","0.5","AC6168","Light, Mark E.; Gale, Philip A.; Navakhun, Korakot; Maynard-Smith, Michael","4-Aminomethyl-phenylamino-bis-(3,4-dichloro-5-phenylcarbamoyl-1<i>H</i>-pyrrole-2-carboxamide) tetrabutylammonium salt","Acta Crystallographica Section E","2005","61","5","o1302","o1303","10.1107/S160053680501069X","","","0.71073","MoKα","","0.2189","0.1014","","","0.1577","0.1921","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205635","11.9992","0.0004","7.8052","0.0002","16.6679","0.0003","90","","96.158","0.002","90","","1552.04","0.07","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2':6',2''-Terpyridinium nitrate","","- C15 H13 N5 O6 -","- C15 H13 N5 O6 -","- C60 H52 N20 O24 -","4","1","AT6002","Berthon, Claude; Grigoriev, Mikhail S.","2,2':6',2''-Terpyridinium dinitrate","Acta Crystallographica Section E","2005","61","5","o1216","o1217","10.1107/S1600536805009931","","","0.71073","MoKα","","0.0459","0.0404","","","0.0968","0.1009","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205636","4.5833","0.0015","18.843","0.006","11.112","0.004","90","","100.738","0.007","90","","942.9","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 3,5-dinitrobenzoate","","- C8 H6 N2 O6 -","- C8 H6 N2 O6 -","- C32 H24 N8 O24 -","4","1","AT6003","Jin, Long-Fei; Xiao, Feng-Ping","Methyl 3,5-dinitrobenzoate","Acta Crystallographica Section E","2005","61","5","o1276","o1277","10.1107/S1600536805010317","","","0.71073","MoKα","","0.1147","0.0607","","","0.1387","0.1695","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205637","7.3142","0.0009","9.6929","0.0011","12.9986","0.0016","81.233","0.009","83.004","0.01","74.967","0.009","876.34","0.19","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-(3,4-Dicyanophenoxy)-4-methoxybenzophenone","","- C22 H14 N2 O3 -","- C22 H14 N2 O3 -","- C44 H28 N4 O6 -","2","1","AT6004","Erdem, Talip Kaya; Atalay, Şehriman; Akdemir, Nesuhi; Aǧar, Erbil; Kantar, Cihan","4-(2-Benzoyl-5-methoxyphenoxy)benzene-1,2-dicarbonitrile","Acta Crystallographica Section E","2005","61","5","o1429","o1431","10.1107/S1600536805011918","","","0.71073","MoKα","","0.0719","0.0383","","","0.0755","0.0852","","","","","","0.97","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205638","10.083","0.004","12.576","0.004","13.849","0.005","90","","90","","90","","1756.1","1.1","295","2","295","2","","","","","","","","4","P n a 21","P 2c -2n","33","","3,8-Diphenyl-6-methyl-5H-pyrazolo[3,4-e]-1,2,4-triazolo[4,3-b]- 1,3,4-thiadiazepine","","- C19 H14 N6 S -","- C19 H14 N6 S -","- C76 H56 N24 S4 -","4","1","AT6005","Li-Min Yang; Zhao-Jie Liu","6-Methyl-3,8-diphenyl-5<i>H</i>-pyrazolo[3,4-<i>e</i>][1,2,4]triazolo[4,3-<i>b</i>][1,3,4]thiadiazepine","Acta Crystallographica Section E","2005","61","5","o1466","o1468","10.1107/S160053680501192X","","","0.71073","MoKα","","0.0591","0.0343","","","0.0716","0.0821","","","","","","1.034","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205639","14.9807","0.0006","15.5273","0.0006","9.4228","0.0004","90","","99.962","0.001","90","","2158.79","0.15","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","N,N'-Di(9H-fluoren-9-ylidene)benzene-1,2-diamine","","- C32 H20 N2 -","- C32 H20 N2 -","- C128 H80 N8 -","4","0.5","BH6000","Glagovich, Neil M.; Reed, Elizabeth M.; Crundwell, Guy; Updegraff III, James B.; Zeller, Matthias; Hunter, Allen D.","<i>N</i>,<i>N</i>'-Bis(9<i>H</i>-fluoren-9-ylidene)benzene-1,2-diamine","Acta Crystallographica Section E","2005","61","5","o1251","o1253","10.1107/S1600536805010251","","","0.71073","MoKα","","0.0483","0.0466","","","0.1153","0.1166","","","","","","1.074","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205640","13.5324","0.0015","7.2128","0.0008","12.988","0.0015","90","","109.501","0.002","90","","1195","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetraaquabis(4,6-oxidopyrimidin-1-ium-κ^3^N)cobalt(II)","","- C8 H14 Co N4 O8 -","- C8 H14 Co N4 O8 -","- C32 H56 Co4 N16 O32 -","4","0.5","BR6186","Huang, You-Gui; Zhou, You-Fu; Yuan, Da-Qiang; Wu, Ben-Lei; Hong, Mao-Chun","Tetraaquabis(4,6-dioxidopyrimidin-1-ium-κ^3^<i>N</i>)cobalt(II)","Acta Crystallographica Section E","2005","61","5","m832","m834","10.1107/S1600536805009785","","","0.71073","MoKα","","0.0355","0.0323","","","0.0787","0.0817","","","","","","1.172","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205641","5.0843","0.0009","29.44","0.005","10.823","0.002","90","","92.419","0.016","90","","1618.6","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Propyl 4-(3,4-dicyanophenoxy)benzoate","","- C18 H14 N2 O3 -","- C18 H14 N2 O3 -","- C72 H56 N8 O12 -","4","1","BT6626","Petek, Hande; Akdemir, Nesuhi; Kantar, Cihan; Ağar, Erbil; Şenel, İsmet","Propyl 4-(3,4-dicyanophenoxy)benzoate","Acta Crystallographica Section E","2005","61","5","o1233","o1234","10.1107/S1600536805010020","","","0.71073","MoKα","","0.1717","0.0612","","","0.1349","0.1533","","","","","","0.807","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205642","20.543","0.003","4.0082","0.0008","12.813","0.002","90","","95.497","0.006","90","","1050.2","0.3","133","2","133","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","1,5-Dibromo-2,6-dimethylnaphthalene","","- C12 H10 Br2 -","- C12 H10 Br2 -","- C48 H40 Br8 -","4","0.5","BT6633","Jones, Peter G.; Kuś, Piotr","1,5-Dibromo-2,6-dimethylnaphthalene","Acta Crystallographica Section E","2005","61","5","o1235","o1236","10.1107/S1600536805008652","","","0.71073","MoKα","","0.0352","0.0237","","","0.0503","0.0537","","","","","","1.081","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205643","5.5138","0.0004","7.1866","0.0005","12.0459","0.0004","90","","90","","90","","477.32","0.05","150","1","150","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","para-aminopyridine","4-aminopyridine","","- C5 H6 N2 -","- C5 H6 N2 -","- C20 H24 N8 -","4","1","BT6634","Anderson, Frankie P.; Gallagher, John F.; Kenny, Peter T.M.; Lough, Alan J.","Redetermination of <i>para</i>-aminopyridine (fampridine, EL-970)at 150 K","Acta Crystallographica Section E","2005","61","5","o1350","o1353","10.1107/S1600536805010433","","","0.71073","MolybdenumKα","","0.0376","0.0314","","","0.082","0.0858","","","","","","1.101","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205644","10.6453","0.0018","10.7928","0.0019","11.458","0.002","90","","90","","90","","1316.4","0.4","110","2","110","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Tricarbonyl[η^6^-(R)-N,N-dimethyl-1-phenylethylamine]chromium(0)","","- C13 H15 Cr N O3 -","- C13 H15 Cr N O3 -","- C52 H60 Cr4 N4 O12 -","4","1","BT6636","Braun, Wolfgang; Calmuschi, Beatrice; Salzer, Albrecht","Tricarbonyl[η^6^-(<i>R</i>)-<i>N,N</i>-dimethyl-1-phenylethylamine]chromium(0)","Acta Crystallographica Section E","2005","61","5","m828","m829","10.1107/S160053680501007X","","","0.71073","MoKα","","0.0228","0.0222","","","0.0603","0.0608","","","","","","1.072","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205645","7.6461","0.0006","8.4018","0.0007","8.4258","0.0007","85.89","0.01","78.08","0.01","69.757","0.009","496.9","0.08","170","2","170","2","","","","","","","","7","P -1","-P 1","2","","Bis[N-(2-aminoethyl)morpholine]copper(II) bis(tetrafluoroborate)","","- C12 H28 B2 Cu F8 N4 O2 -","- C12 H28 B2 Cu F8 N4 O2 -","- C12 H28 B2 Cu F8 N4 O2 -","1","0.5","BT6637","Sander, Ole; Tuczek, Felix; Näther, Christian","Bis[<i>N</i>-(2-aminoethyl)morpholine]copper(II) bis(tetrafluoroborate)","Acta Crystallographica Section E","2005","61","5","m824","m825","10.1107/S1600536805010056","","","0.71073","MoKα","","0.0363","0.0336","","","0.0899","0.0918","","","","","","1.085","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205646","14.0994","0.0007","9.5999","0.0005","28.0432","0.0013","90","","102.249","0.004","90","","3709.3","0.3","291","0.5","291","0.5","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","O,O'-Diisopropyl (4-methyl-7-cumarinyloxy)phosphonothioate","","- C16 H21 O5 P S -","- C16 H21 O5 P S -","- C128 H168 O40 P8 S8 -","8","2","BT6638","Kruszynski, Rafal; Trzesowska, Agata; Majewski, Piotr; Skretowska, Sylwia; Marszalek, Hanna","<i>O,O</i>'-Diisopropyl (4-methyl-7-coumarinyloxy)phosphonothioate","Acta Crystallographica Section E","2005","61","5","o1248","o1250","10.1107/S1600536805010172","","","0.71073","MoKα","","0.0687","0.0552","","","0.1316","0.1405","","","","","","1.185","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205647","6.4058","0.0006","11.284","0.001","14.51","0.001","90","","93.686","0.002","90","","1046.66","0.15","293","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diμ-chloro-bis[bis(ethane-1,2-diamine-κ^2^N,N')manganese(II)] dichloride","","- C8 H32 Cl4 Mn2 N8 -","- C8 H32 Cl4 Mn2 N8 -","- C16 H64 Cl8 Mn4 N16 -","2","0.5","BT6639","Hao, Zheng-Ming; Zhang, Xian-Ming; Wu, Hai-Shun; Ng, Seik Weng","Di-μ-chloro-bis[bis(ethane-1,2-diamine-κ^2^<i>N,N</i>')manganese(II)] dichloride","Acta Crystallographica Section E","2005","61","5","m973","m974","10.1107/S1600536805010184","","","0.71073","MoKα","","0.035","0.032","","","0.082","0.086","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205648","9.4776","0.0009","10.7072","0.0012","10.0023","0.0011","90","","99.463","0.008","90","","1001.21","0.19","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,5-Pentylenebisphosphonic Acid","Pentane-1,5-bisphosphonic acid","","- C5 H14 O6 P2 -","- C5 H14 O6 P2 -","- C20 H56 O24 P8 -","4","1","BT6640","McLauchlan, Craig C.; Ziegler, Amanda J.; Herlinger, Albert W.","Pentane-1,5-bisphosphonic acid","Acta Crystallographica Section E","2005","61","5","o1359","o1361","10.1107/S1600536805011207","","","0.71073","MoKα","","0.0463","0.0356","","","0.0916","0.0956","","","","","","1.116","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205649","12.4125","0.0005","15.4864","0.0006","17.5542","0.0007","106.082","0.001","105.386","0.001","106.52","0.001","2883.5","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","Bis[μ-oxoaquadichloromolybdenum(VI)]‒cucurbit[6]uril 10.5-hydrate","","- C36 H61 Cl4 Mo2 N24 O28.5 -","- C36 H60 Cl4 Mo2 N24 O28.5 -","- C72 H120 Cl8 Mo4 N48 O57 -","2","1","BT6642","Lin, Rong-Guang; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","A hydrated co-crystal of bis(μ-oxo-κ^2^<i>O</i>:<i>O</i>)bis[aquaoxodichloromolybdenum(VI)] with cucurbit[6]uril","Acta Crystallographica Section E","2005","61","5","m885","m888","10.1107/S1600536805010858","","","0.71073","MoKα","","0.0493","0.0463","","","0.1369","0.1394","","","","","","1.03","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2205650","8.7638","0.0007","10.7287","0.001","12.2216","0.001","74.845","0.01","72.997","0.01","88.978","0.01","1058.54","0.18","170","2","170","2","","","","","","","","5","P -1","-P 1","2","","Bis(2-aminoethylammonium)(ethylenediammonium)(di-μ-sulfido- κ^2^S:S)bis[disulfidotin(IV)]","","- C6 H28 N6 S6 Sn2 -","- C6 H28 N6 S6 Sn2 -","- C12 H56 N12 S12 Sn4 -","2","1","BT6643","Puls, Angela; Näther, Christian; Bensch, Wolfgang","Bis(2-aminoethylammonium) (ethylenediammonium) (di-μ-sulfido-κ^2^<i>S</i>:<i>S</i>)bis[dithiostannate(IV)]","Acta Crystallographica Section E","2005","61","5","m868","m870","10.1107/S1600536805010871","","","0.71073","MoKα","","0.0379","0.0291","","","0.0732","0.0765","","","","","","0.965","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205651","16.289","0.002","16.22","0.002","16.452","0.002","90","","94.981","0.002","90","","4330.3","0.9","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[tris(μ~2~-oxalato-κ^4^O,O':O''O''')bis(μ~2~-4,4'-bipyridyl- κ^2^N,N')bis(4,4'-bipyridyl-κN)trimanganese(II)]","","- C46 H32 Mn3 N8 O12 -","- C46 H32 Mn3 N8 O12 -","- C184 H128 Mn12 N32 O48 -","4","1","BT6644","Zhu, Li-Hong; Zeng, Ming-Hua; Ng, Seik Weng","Poly[bis(μ~2~-4,4'-bipyridyl-κ^2^<i>N</i>:<i>N</i>')bis(4,4'-bipyridyl-κ<i>N</i>)tris(μ~2~-oxalato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>''<i>O</i>''')trimanganese(II)]<i></i>","Acta Crystallographica Section E","2005","61","5","m916","m918","10.1107/S1600536805011499","","","0.71073","MoKα","","0.039","0.031","","","0.087","0.094","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205652","10.029","0.001","10.476","0.001","13.2088","0.0013","90","","90","","90","","1387.8","0.2","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","S-Dianin's compound","(S)-4-(4-Hydroxyphenyl)-2,2,4-trimethylchroman","","- C18 H20 O2 -","- C18 H20 O2 -","- C72 H80 O8 -","4","1","BT6647","Gareth O. Lloyd; Martin W. Bredenkamp","(<i>S</i>)-4-(4-Hydroxyphenyl)-2,2,4-trimethylchroman","Acta Crystallographica Section E","2005","61","5","o1512","o1514","10.1107/S1600536805012651","","","0.71073","MoKα","","0.0414","0.0384","","","0.0975","0.0997","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205653","32.208","0.0019","6.8884","0.0004","16.6204","0.001","90","","109.156","0.001","90","","3483.3","0.4","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1,4-dihydro-6-methy-5-N-methy carbamoyl-4-phenyl-2(3H)-pyrimidinethione","","- C15 H21 N3 O2 S2 -","- C15 H21 N3 O2 S2 -","- C120 H168 N24 O16 S16 -","8","1","BT6648","B. Sridhar; K. Ravikumar","A carbamoyl-substituted dihydropyrimidine with dimethyl sulfoxide solvent","Acta Crystallographica Section E","2005","61","5","o1414","o1416","10.1107/S1600536805011773","","","0.71073","MoKα","","0.0595","0.0536","","","0.1568","0.1635","","","","","","1.046","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205654","6.6508","0.001","7.9576","0.0012","8.4012","0.0012","81.03","0.012","88.572","0.012","81.179","0.012","434","0.11","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","6-Bromo-8-Thio-1,4-Epoxybicyclo[4.3.0]non-2-ene","","- C8 H9 Br O S -","- C8 H9 Br O S -","- C16 H18 Br2 O2 S2 -","2","1","BT6650","Büyükgüngör, Orhan; Koşar, Başak; Demircan, Aydın; Turaç, Ersen","6-Bromo-8-thia-1,4-epoxybicyclo[4.3.0]non-2-ene","Acta Crystallographica Section E","2005","61","5","o1441","o1442","10.1107/S1600536805012122","","","0.71073","MoKα","","0.05","0.0394","","","0.0883","0.0929","","","","","","1.089","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205655","35.204","0.003","5.282","0.006","12.738","0.004","90","","97.503","0.015","90","","2348","3","295","","295","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3,6-(Z,Z)-Bis[(3,4,5-trimethyoxyphenyl)methylene]piperazine-2,5-dione","","- C24 H26 N2 O8 -","- C24 H26 N2 O8 -","- C96 H104 N8 O32 -","4","0.5","BT6651","Wendy A. Loughlin; Raymond L. Marshall; Kathryn E. Fairfull-Smith (nee Elson); Peter C. Healy","(<i>Z</i>,<i>Z</i>)-3,6-Bis[(3,4,5-trimethoxyphenyl)methylene]piperazine-2,5-dione","Acta Crystallographica Section E","2005","61","5","o1443","o1445","10.1107/S1600536805012316","","","0.7107","MoKα","","0.1294","0.0517","","","0.1445","0.1887","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205656","9.578","0.003","7.3024","0.0017","25.656","0.005","90","","94.83","0.013","90","","1788.1","0.8","566","2","566","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(8-hydroxyquinolinium) squarate","","- C22 H16 N2 O6 -","- C22 H16 N2 O6 -","- C88 H64 N8 O24 -","4","1","BT6652","Tonko Kolev; Snezana Sinadinovic-Fiser; Michael Spiteller; William S. Sheldrick; Heike Mayer-Figge","Bis(8-hydroxyquinolinium) squarate","Acta Crystallographica Section E","2005","61","5","o1469","o1471","10.1107/S1600536805012523","","","0.71073","MoKα","","0.1364","0.0602","","","0.1242","0.1523","","","","","","0.991","","","","has coordinates","198633","2020-10-21","18:00:00",""
"2205657","7.1729","0.0004","13.5386","0.0008","14.353","0.0008","90","","103.917","0.002","90","","1352.92","0.13","160","2","160","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Pifithrin-β","2-p-tolyl-5,6,7,8-tetrahydrobenzo[d]imidazo[2,1-b]thiazole","","- C16 H16 N2 S -","- C16 H16 N2 S -","- C64 H64 N8 S4 -","4","1","BT6656","Clegg, William; Jamieson, Clare","Pifithrin-β","Acta Crystallographica Section E","2005","61","5","o1486","o1488","10.1107/S160053680501264X","","","0.71073","MoKα","","0.0426","0.0376","","","0.0993","0.1032","","","","","","1.047","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205658","15.023","0.006","8.27","0.007","24.038","0.007","90","","96.03","0.03","90","","2970","3","150","2","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichlorobis(3,5-dimethylpyrazole)copper(II)","","- C10 H16 Cl2 Cu N4 -","- C10 H16 Cl2 Cu N4 -","- C80 H128 Cl16 Cu8 N32 -","8","1","BV6012","Zhao, Ning-Feng; Eichhorn, David M.","Dichlorobis(3,5-dimethylpyrazole)copper(II)","Acta Crystallographica Section E","2005","61","5","m822","m823","10.1107/S1600536805009621","","","0.71073","MoKα","","","0.0665","","","","0.2109","","","","","","1.074","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2205659","29.398","0.003","9.839","0.001","13.59","0.001","90","","108.189","0.006","90","","3734.4","0.6","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","","bis(L-histidinato)cobalt(III)‒chloride‒nitrate‒water (1/0.4/0.6/2.5)","","- C12 H21 Cl0.4 Co N6.6 O8.3 -","- C12 H17.5 Cl0.4 Co N6.6 O8.3 -","- C96 H140 Cl3.2 Co8 N52.8 O66.4 -","8","2","BV6016","Leverett J. Zompa","<i>trans</i>-Imidazole isomer of the bis(<small>L</small>-histidinato)cobalt(III) complex","Acta Crystallographica Section E","2005","61","5","m849","m851","10.1107/S1600536805010123","","","0.71073","MoKα","","0.0444","0.0383","","","0.0979","0.1026","","","","","","1.081","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205660","28.831","0.003","9.3063","0.0012","8.6456","0.0012","90","","100.642","0.01","90","","2279.8","0.5","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tripotassium ethanoate-2,2-diylbis(diazeniumdiolate) 2.5-hydrate","","- C2 H6 K3 N4 O8.5 -","- C2 H6 K3 N4 O8.5 -","- C16 H48 K24 N32 O68 -","8","1","BV6018","Arulsamy, Navamoney; Bohle, D. Scott","Tripotassium carboxylatomethylenebis(diazeniumdiolate) 2.5-hydrate","Acta Crystallographica Section E","2005","61","5","m930","m932","10.1107/S1600536805010834","","","0.71073","MoKα","","0.0438","0.0371","","","0.0939","0.0983","","","","","","1.038","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205661","19.386","0.006","5.584","0.0015","17.928","0.005","90","","90","","90","","1940.7","1","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","9-oxo-10-diphenylphosphinoylanthracene","","- C26 H19 O2 P -","- C26 H19 O2 P -","- C104 H76 O8 P4 -","4","1","CF6410","Qing-Xiang Liu; Hai-bin Song","9-Oxo-10-diphenylphosphinoylanthracene","Acta Crystallographica Section E","2005","61","5","o1489","o1490","10.1107/S1600536805006598","","","0.71073","MoKα","","0.0725","0.0402","","","0.074","0.0828","","","","","","0.948","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205662","6.1521","0.0005","7.5495","0.0007","9.3055","0.0008","90","","98.501","0.005","90","","427.45","0.06","190","","190","","","","","","","","","3","P 1 21 1","P 2yb","4","","2-C-Methyl-D-allono-1,4-lactone","","- C7 H12 O6 -","- C7 H12 O6 -","- C14 H24 O12 -","2","1","CF6418","Christopher C. Harding; David J. Watkin; Nicola K. Sawyer; Sarah F. Jenkinson; George W. J. Fleet","2-<i>C</i>-Methyl-<small>D</small>-allono-1,4-lactone","Acta Crystallographica Section E","2005","61","5","o1472","o1474","10.1107/S1600536805012328","","","0.71073","MoKα","","0.0418","0.037","","0.0919","0.0886","0.0919","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205663","10.3116","0.0003","5.9084","0.0002","17.2641","0.0006","90","","94.2891","0.0013","90","","1048.87","0.06","190","","190","","","","","","","","","4","P 1 21 1","P 2yb","4","","1-Amino-1-deoxy-N,N-dibenzyl-α-D-tagatopyranose","","- C21 H29 N O6 -","- C21 H29 N O6 -","- C42 H58 N2 O12 -","2","1","CF6419","Christopher C. Harding; Andrew R. Cowley; David J. Watkin; Francesco Punzo; David Hotchkiss; George W. J. Fleet","1-Amino-<i>N</i>,<i>N</i>-dibenzyl-1-deoxy-α-<small>D</small>-tagatopyranose methanol solvate","Acta Crystallographica Section E","2005","61","5","o1475","o1477","10.1107/S160053680501233X","","","0.71073","MoKα","","0.0588","0.041","","0.0947","0.0862","0.0947","","","","","","0.8979","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205664","5.802","0.0003","13.6911","0.0008","21.4006","0.0014","90","","92.721","0.004","90","","1698.06","0.17","298","2","293.15","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","4-Phthalimidobutoxy Phthalonitrile","4-[4-(1,3-Dioxo-2,3-dihydro-1H-isoindol-2-yl)butoxy]phthalonitrile","","- C20 H15 N3 O3 -","- C20 H15 N3 O3 -","- C80 H60 N12 O12 -","4","1","CI6547","Zhu, Xiao-Li; Lin, Mei-Jin; Wang, Jun-Dong; Chen, Nai-Sheng; Huang, Jin-Ling","4-[4-(1,3-Dioxo-2,3-dihydro-1<i>H</i>-isoindol-2-yl)butoxy]phthalonitrile","Acta Crystallographica Section E","2005","61","5","o1214","o1215","10.1107/S1600536805009797","","","0.71073","MoKα","","0.0493","0.0411","","","0.102","0.1076","","","","","","1.01","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205665","5.883","0.002","8.022","0.003","12.387","0.005","90","","90.185","0.015","90","","584.6","0.4","292","2","292","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","N,N'-diphenylethylenediamine","","- C14 H16 N2 -","- C14 H16 N2 -","- C28 H32 N4 -","2","0.5","CI6553","Lennartson, Anders; Kokoli, Theonitsa; Håkansson, Mikael","<i>N,N</i>'-Diphenylethylenediamine, an N—H···π- and C—H···π-bonded network","Acta Crystallographica Section E","2005","61","5","o1245","o1247","10.1107/S1600536805010135","","","0.71073","MoKα","","0.0727","0.0514","","","0.1452","0.1571","","","","","","0.995","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205666","9.9319","0.0007","10.3666","0.0008","10.5606","0.0008","109.71","0.01","94.138","0.001","98.458","0.001","1003.79","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","4(4'-Hydroxy-3'-methoxystyryl)-1-methylpyridinium 4-bromobenzenesulfonate","4(4'-Hydroxy-3'-methoxystyryl)-1-methylpyridinium 4-bromobenzenesulfonate","","- C21 H20 Br N O5 S -","- C21 H20 Br N O5 S -","- C42 H40 Br2 N2 O10 S2 -","2","1","CI6556","Boonwasana Jindawong; Suchada Chantrapromma; Hoong-Kun Fun; Xiao-Lan Yu; Chatchanok Karalai","4(4'-Hydroxy-3'-methoxystyryl)-1-methylpyridinium 4-bromobenzenesulfonate","Acta Crystallographica Section E","2005","61","5","o1340","o1342","10.1107/S1600536805011086","","","0.71073","MoKα","","0.0404","0.0346","","","0.0886","0.0919","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205667","9.8299","0.0011","10.1415","0.0011","19.486","0.002","83.183","0.002","89.886","0.002","76.646","0.002","1876","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","[(triglycol ditolylene)imidiazolium]-2,6-dimethylpyridine dihexaflourphosphate","","- C33 H37 F12 N5 O4 P2 -","- C33 H37 F12 N5 O4 P2 -","- C66 H74 F24 N10 O8 P4 -","2","1","CI6557","Qin, Da-Bin; Song, Hai-Bin; Xu, Feng-Bo; Li, Qing-Shang; Zhang, Zheng-Zhi","[(Triglycol ditolylene)imidazolium]-2,6-dimethylpyridine bis(hexafluorophosphate)","Acta Crystallographica Section E","2005","61","5","o1503","o1504","10.1107/S1600536805010627","","","0.71073","MoKα","","0.0799","0.0559","","","0.171","0.1875","","","","","","1.075","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205668","10.4682","0.0008","17.7551","0.0013","14.1264","0.001","90","","106.058","0.001","90","","2523.1","0.3","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(Z)-Ethyl 3-(4-chlorophenyl)-2-[(triphenylphosphoranylidene)amino]prop-2- enoate","","- C29 H25 Cl N O2 P -","- C29 H25 Cl N O2 P -","- C116 H100 Cl4 N4 O8 P4 -","4","1","CI6558","Xiao-Bo Huang; Jin-Chang Ding; Miao-Chang Liu; Xi-Chang Zhang; Mao-Lin Hu","(<i>Z</i>)-Ethyl 3-(4-chlorophenyl)-2-[(triphenylphosphoranylidene)amino]prop-2-enoate","Acta Crystallographica Section E","2005","61","5","o1261","o1262","10.1107/S1600536805010391","","","0.71073","MoKα","","0.1096","0.0778","","","0.1394","0.1525","","","","","","1.138","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205669","9.886","0.002","5.7887","0.0011","20.646","0.004","90","","96.129","0.004","90","","1174.8","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Isopropyl 3, 5-dinitrobenzoate","","- C10 H10 N2 O6 -","- C10 H10 N2 O6 -","- C40 H40 N8 O24 -","4","1","CI6559","Long-Fei Jin; Feng-Ping Xiao","Isopropyl 3,5-dinitrobenzoate","Acta Crystallographica Section E","2005","61","5","o1269","o1270","10.1107/S1600536805010482","","","0.71073","MoKα","","0.1354","0.0562","","","0.1238","0.155","","","","","","0.974","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205670","9.254","0.002","6.864","0.002","13.174","0.003","90","","102.78","0.03","90","","816.1","0.4","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","1-{[2-(2-Hydroxyethylamino)ethylimino]methyl}naphthalen-2-ol perchlorate","","- C15 H19 Cl N2 O6 -","- C15 H19 Cl N2 O6 -","- C30 H38 Cl2 N4 O12 -","2","1","CI6560","Zhu, Hai-Liang; You, Zhong-Lu","A perchlorate salt of 1-{[2-(2-hydroxyethylamino)ethylimino]methyl}naphthalen-2-ol","Acta Crystallographica Section E","2005","61","5","o1271","o1272","10.1107/S1600536805010585","","","0.71073","MoKα","","0.0694","0.0531","","","0.1339","0.1452","","","","","","1.039","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205671","11.444","0.002","7.954","0.0016","19.356","0.004","90","","102.83","0.03","90","","1717.9","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 2-{[3-(2-methyl)phenyl-1,2,4-oxadiazol-5-yl]methoxy}phenylacetate","","- C19 H18 N2 O4 -","- C19 H18 N2 O4 -","- C76 H72 N8 O16 -","4","1","CI6561","Wang, Hai-Bo; Pu, Yue-Qing; Chen, Jia-Hui; Wang, Jin-Tang","Methyl 2-{[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methoxy}phenylacetate","Acta Crystallographica Section E","2005","61","5","o1390","o1392","10.1107/S1600536805011505","","","0.71073","MoKα","","0.114","0.0549","","","0.1402","0.168","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205672","8.372","0.003","10.449","0.003","10.781","0.003","96.099","0.005","110.379","0.005","99.826","0.005","857","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis{[N-(4-hydroxysalicylidene)-N^'^,N^'^-diethylethyldiamine-κ^2^N,O] copper(II)oxalate} dihydrate","","- C30 H44 Cu2 N4 O14 -","- C30 H44 Cu2 N4 O14 -","- C30 H44 Cu2 N4 O14 -","1","0.5","CI6562","Guang-Jun Xu; Shi-Ping Yan; Dai-Zheng Liao; Zong-Hui Jiang; Peng Cheng","A new Schiff base copper (II) complex: bis[<i>N</i>-(4-hydroxysalicylidene)-<i>N</i>',<i>N</i>'-diethylethylenediamine-κ^2^<i>N</i>,<i>O</i>]bis[(oxalato-κ^2^<i>O</i>,<i>O</i>')copper(II)] dihydrate","Acta Crystallographica Section E","2005","61","5","m933","m935","10.1107/S1600536805011700","","","0.71073","MoKα","","0.0443","0.0313","","","0.076","0.0812","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205673","9.964","0.002","7.284","0.0016","11.462","0.003","90","","110.917","0.003","90","","777.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis[2-(dimethylamino)ethyl]dithiooxamide","","- C10 H22 N4 S2 -","- C10 H22 N4 S2 -","- C20 H44 N8 S4 -","2","0.5","CI6564","Cui, Jian-Zhong; Zhang, Dan; Zhang, Hong; Pan, Shuo-Wen; Cheng, Peng; Liao, Dai-Zheng; Wang, Geng-Lin","<i>N</i>,<i>N</i>'-Bis[2-(dimethylamino)ethyl]dithiooxamide","Acta Crystallographica Section E","2005","61","5","o1496","o1497","10.1107/S1600536805012225","","","0.71073","MoKα","","0.0793","0.0378","","","0.1011","0.1157","","","","","","0.991","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2205674","16.507","0.006","8.361","0.003","18.907","0.007","90","","100.076","0.006","90","","2569.2","1.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3-(3H-inden-1-ylmethyl)-2,2'-bis(methoxymethoxy)-1,1'-binaphthalenyl","","- C34 H30 O4 -","- C34 H30 O4 -","- C136 H120 O16 -","4","1","CI6565","Jian Xiao; Yong-Na Lu; Guo-Cang Wang; Qun-sheng Guo; Bin Liu; Hai-Bin Song; Jin-Shan Li","3-(3<i>H</i>-Inden-1-ylmethyl)-2,2'-bis(methoxymethoxy)-1,1'-binaphthalenyl","Acta Crystallographica Section E","2005","61","5","o1501","o1502","10.1107/S1600536805012079","","","0.71073","MoKα","","0.1085","0.0576","","","0.118","0.1379","","","","","","1.086","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205675","11.545","0.002","20.694","0.003","8.597","0.0015","90","","110.147","0.004","90","","1928.3","0.6","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(2-chlorophenyl)-3-methyl-1-phenyl-6-(2-pyridyl)pyrazolo[3,4-b]pyridine","","- C24 H17 Cl N4 -","- C24 H17 Cl N4 -","- C96 H68 Cl4 N16 -","4","1","CI6566","Tu, Shu-Jiang; Zhu, Song-Lei; Zou, Xiang","4-(2-Chlorophenyl)-3-methyl-1-phenyl-6-(2-pyridyl)pyrazolo[3,4-<i>b</i>]pyridine","Acta Crystallographica Section E","2005","61","5","o1398","o1399","10.1107/S1600536805011657","","","0.7107","MoKα","","0.0898","0.0666","","","0.1291","0.1396","","","","","","1.156","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205676","10.9746","0.0004","21.409","0.0011","17.0115","0.0006","90","","98.468","0.003","90","","3953.4","0.3","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H40 N6 Ni O12 -","- C40 H40 N6 Ni O12 -","- C160 H160 N24 Ni4 O48 -","4","1","CI6567","Uçar, İbrahim; Yeşilel, Okan Zafer; Bulut, Ahmet; Ölmez, Halis; Büyükgüngör, Orhan","Tris(1,10-phenanthroline)nickel(II) squarate octahydrate","Acta Crystallographica Section E","2005","61","5","m947","m949","10.1107/S1600536805012055","","","0.71073","MoKα","","0.0751","0.0357","","","0.0751","0.0831","","","","","","0.843","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205677","11.0324","0.0002","5.62","0.0002","16.4317","0.0003","90","","105.789","0.002","90","","980.36","0.04","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","DL-Leucinium nitrate","","","- C6 H14 N2 O5 -","- C6 H14 N2 O5 -","- C24 H56 N8 O20 -","4","1","CI6568","Berrah, Fadila; Benali-Cherif, Nourredine; Lamraoui, Hanane","<small>DL</small>-Leucinium nitrate","Acta Crystallographica Section E","2005","61","5","o1517","o1519","10.1107/S1600536805012110","","","0.71073","MoKα","","0.1166","0.0414","","","0.0785","0.0927","","","","","","0.836","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205678","7.3556","0.0004","10.1773","0.0005","10.3602","0.0005","79.123","0.002","74.383","0.002","70.125","0.002","698.39","0.06","180","2","180","2","","","","","","","","6","P -1","-P 1","2","trans-Co(en)2(NO2)2 periodate","trans-bis(ethylenediamine-κ^2^N,N')dinitrocobalt(III) periodate","","- C4 H16 Co I N6 O8 -","- C4 H16 Co I N6 O8 -","- C8 H32 Co2 I2 N12 O16 -","2","1","CI6570","Sharma, Raj Pal; Sharma, Rajni; Bala, Ritu; Bond, Andrew D.","Second-sphere coordination in anion binding: <i>trans</i>-bis(ethylenediamine-κ^2^<i>N</i>,<i>N</i>')dinitrocobalt(III) periodate","Acta Crystallographica Section E","2005","61","5","m997","m1000","10.1107/S1600536805012274","","","0.71073","MoKα","","0.0163","0.0153","","","0.0408","0.0411","","","","","","1.108","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205679","6.7861","0.0001","8.5143","0.0001","19.0442","0.0003","88.623","0.0009","81.6364","0.0008","84.8577","0.0006","1084.2","0.03","150","","150","","","","","","","","","6","P -1","-P 1","2","","Poly[N,N,N',N'-tetramethylpropane-1,3-diaminium [aquatetraoxotri-μ~3~-sulfato-diuranate(VI)]]","","- C7 H22 N2 O17 S3 U2 -","- C7 H22 N2 O17 S3 U2 -","- C14 H44 N4 O34 S6 U4 -","2","1","CV6472","Norquist, Alexander J.; Doran, Michael B.; O'Hare, Dermot","(C~7~H~20~N~2~)[(UO~2~)~2~(SO~4~)~3~(H~2~O)]: an organically templated uranium sulfate with a novel layer topology","Acta Crystallographica Section E","2005","61","5","m807","m810","10.1107/S1600536805009670","","","0.71073","MoKα","","0.0406","0.0371","","0.1002","0.0965","0.0965","","","","","","0.9085","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205680","7.3983","0.0002","7.6333","0.0002","12.5946","0.0005","95.1761","0.0012","94.6412","0.0013","96.578","0.002","700.7","0.04","150","","150","","","","","","","","","6","P -1","-P 1","2","","Bis(propane-1,2-diaminium) tetraaquadi-μ~2~-sulfato-disulfatotetraoxodiuranate(VI) dihydrate","","- C6 H36 N4 O26 S4 U2 -","- C6 H36 N4 O26 S4 U2 -","- C6 H36 N4 O26 S4 U2 -","1","0.5","CV6473","Doran, Michael B.; Norquist, Alexander J.; O'Hare, Dermot","(C~3~H~12~N~2~)~2~[UO~2~(H~2~O)~2~(SO~4~)~2~]~2~·2H~2~O: an organically templated uranium sulfate with a novel dimer type","Acta Crystallographica Section E","2005","61","5","m881","m884","10.1107/S1600536805009682","","","0.71073","MoKα","","0.0268","0.0225","","0.0595","0.0555","0.0555","","","","","","0.828","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205681","6.4308","0.0011","9.8948","0.0017","15.356","0.003","90","","99.179","0.004","90","","964.6","0.3","298","2","298","2","","","","","","","","6","P 1 21 1","P 2yb","4","","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(3,4- methylenedioxyphenyl)methyleneimino]-1H-pyrazole-3-carbonitrile","","- C19 H9 Cl2 F3 N4 O2 -","- C19 H9 Cl2 F3 N4 O2 -","- C38 H18 Cl4 F6 N8 O4 -","2","1","CV6475","Zhong, Ping; Zhang, Xiao-Hong; Yang, Zhi-Ping; Xiao, Hong-Ping; Hu, Mao-Lin","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(3,4-methylenedioxyphenyl)methyleneimino]-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","5","o1448","o1449","10.1107/S1600536805012262","","","0.71073","MoKα","","0.0868","0.0646","","","0.1305","0.1535","","","","","","1.068","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205682","6.8815","0.0011","16.468","0.003","9.7901","0.0016","90","","95.568","0.002","90","","1104.2","0.3","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 3-cyano-7-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate","","- C11 H10 N4 O2 -","- C11 H10 N4 O2 -","- C44 H40 N16 O8 -","4","1","CV6476","Li-Rong Wen; Shu-wen Wang; Ming Li; Wei-si Guo","Ethyl 3-cyano-7-methylpyrazolo[1,5-<i>a</i>]pyrimidine-6-carboxylate","Acta Crystallographica Section E","2005","61","5","o1459","o1460","10.1107/S1600536805012353","","","0.71073","MoKα","","0.0443","0.0359","","","0.0992","0.1052","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205683","9.8963","0.0016","9.3319","0.0012","13.4112","0.0018","90","","95.234","0.012","90","","1233.4","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H11 O3 P S4 -","- C7 H11 O3 P S4 -","- C28 H44 O12 P4 S16 -","4","1","CV6478","Chen, Hong-Yu; Yu, Wen-Tao; Xue, Gang; Fang, Qi","Dimethyl (5,6-dihydro-2<i>H</i>-1,3-dithiolo[4,5-<i>b</i>][1,4]dithiin-2-yl)phosphonate","Acta Crystallographica Section E","2005","61","5","o1400","o1402","10.1107/S1600536805011542","","","0.71073","MoKα","","0.1037","0.0826","","","0.2034","0.2222","","","","","","1.043","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205684","10.729","0.003","12.116","0.003","19.552","0.006","89.721","0.005","85.328","0.006","66.677","0.004","2325.1","1.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","{1,8-Bis[2-(1-benzyl-1H-imidazol-3-ylmethyl-κC^2^)phenoxy]-3,6-dioxaoctane- κ^2^O^3^,O^6^}mercury(II) bis(hexaflourophosphate) nitromethane solvate","","- C41 H45 F12 Hg N5 O6 P2 -","- C41 H45 F12 Hg N5 O6 P2 -","- C82 H90 F24 Hg2 N10 O12 P4 -","2","1","CV6480","Da-Bin Qin; Hai-Bin Song; Feng-Bo Xu; Qing-Shang Li; Zheng-Zhi Zhang","{1,8-Bis[2-(1-benzyl-1<i>H</i>-imidazol-3-ylmethyl-κ<i>C</i>^2^)phenoxy]-3,6-dioxaoctane-κ^2^<i>O</i>^3^,<i>O</i>^6^}mercury(II) bis(hexaflourophosphate) nitromethane solvate","Acta Crystallographica Section E","2005","61","5","m826","m827","10.1107/S1600536805009943","","","0.71073","MoKα","","0.0753","0.0492","","","0.101","0.1123","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205685","17.027","0.006","6.828","0.003","10.126","0.004","90","","111.844","0.004","90","","1092.7","0.8","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","Tetra-aqua-bis(isothiocyanate)-manganese(II) bis(2-methylpyrazine-1,4-dioxide)","","- C12 H20 Mn N6 O8 S2 -","- C12 H20 Mn N6 O8 S2 -","- C24 H40 Mn2 N12 O16 S4 -","2","0.25","CV6483","Wen, Xu; Shi, Jing Min; Xia, Zhang","Tetraaquabis(isothiocyanato)manganese(II) bis(2-methylpyrazine-1,4-dioxide)","Acta Crystallographica Section E","2005","61","5","m854","m855","10.1107/S1600536805010664","","","0.71073","MoKα","","0.0373","0.035","","","0.0954","0.0974","","","","","","1.094","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205686","7.4937","0.0019","11.764","0.003","9.778","0.002","90","","102.784","0.004","90","","840.6","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 3-nitrobenzoate","","- C8 H7 N O4 -","- C8 H7 N O4 -","- C32 H28 N4 O16 -","4","1","CV6484","Jin, Long-Fei; Xiao, Feng-Ping","Methyl 3-nitrobenzoate","Acta Crystallographica, Section E","2005","61","5","o1238","o1239","10.1107/S1600536805009955","","","0.71073","MoKα","","0.0622","0.046","","","0.1195","0.1322","","","","","","1.039","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205687","12.429","0.002","13.359","0.002","7.6176","0.0013","90","","103.414","0.002","90","","1230.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(2,4-Difluorophenyl)-1-[3-(2-fluorophenyl)oxiran-2-yl]methanone","","- C15 H9 F3 O2 -","- C15 H9 F3 O2 -","- C60 H36 F12 O8 -","4","1","CV6485","Liang-Zhong Xu; Shuang-Hua Yang; Zhi-Guo Jiang; Guan-Ping Yu; Guo-Dong Si","1-(2,4-Difluorophenyl)-1-[3-(2-fluorophenyl)oxiran-2-yl]methanone","Acta Crystallographica Section E","2005","61","5","o1226","o1227","10.1107/S1600536805009967","","","0.71073","MoKα","","0.079","0.0434","","","0.1156","0.1304","","","","","","1.053","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205688","10.0686","0.0018","10.3118","0.0019","10.392","0.0019","87.47","0.003","85.492","0.002","78.284","0.002","1052.8","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(3,5-bis(phenylamino)-1,2-dithiolan-4-yl)(2,5-dichlorophenyl)methanone","","- C22 H14 Cl2 N2 O S2 -","- C22 H14 Cl2 N2 O S2 -","- C44 H28 Cl4 N4 O2 S4 -","2","1","CV6489","Xu, Liang-Zhong; Yu, Guan-Ping; Huang, Yong-Wei; Zhou, Kai; Zhu, Qi","(3,5-Bis(phenylamino)-1,2-dithiolan-4-yl)(2,5-dichlorophenyl)methanone","Acta Crystallographica Section E","2005","61","5","o1321","o1322","10.1107/S1600536805010780","","","0.71073","MoKα","","0.0526","0.0342","","","0.0862","0.0915","","","","","","1.084","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205689","11.915","0.003","12.05","0.004","13.544","0.002","105.67","0.02","99.141","0.01","93.4","0.02","1837.8","0.8","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C42 H54 N4 -","- C42 H54 N4 -","- C84 H108 N8 -","2","1","CV6490","Bolte, Michael","4,4'-Bis(di-<i>n</i>-butylaminostyryl)-2,2'-bipyridine: a space group revision","Acta Crystallographica Section E","2005","61","5","o1364","o1366","10.1107/S1600536805011414","","","0.71069","MoKα","","0.2045","0.0795","","","0.2159","0.2702","","","","","","1.023","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205690","17.3586","0.0019","9.8854","0.0011","26.324","0.003","90","","90","","90","","4517.1","0.9","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","catena-Poly[[μ-1,2-di-4-pyridylethylene-κ^2^N,N'-[aqua(2-sulfonatobenzoato- κ^2^O,O')copper(II)]] N,N-dimethylformamide]","","- C22 H23 Cu N3 O7 S -","- C22 H23 Cu N3 O7 S -","- C176 H184 Cu8 N24 O56 S8 -","8","1","CV6491","Hong-Ping Xiao; Qian Shi; Ya-Qian Cheng","<i>catena</i>-Poly[[μ-1,2-di-4-pyridylethylene-κ^2^<i>N</i>,<i>N</i>'-[aqua(2-sulfonatobenzoato-κ^2^<i>O</i>,<i>O</i>')copper(II)]] <i>N</i>,<i>N</i>-dimethylformamide]<i></i>","Acta Crystallographica Section E","2005","61","5","m907","m909","10.1107/S1600536805011475","","","0.71073","MoKα","","0.1033","0.0936","","","0.1658","0.1698","","","","","","1.417","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205691","10.5529","0.0008","11.9861","0.0009","11.9789","0.0009","90","","108.662","0.001","90","","1435.52","0.19","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","S-(4-methoxyphenyl) 3-methylsulfonyl-2-oxoimidazolidine-1-carbothioate","","- C12 H14 N2 O5 S2 -","- C12 H14 N2 O5 S2 -","- C48 H56 N8 O20 S8 -","4","1","CV6495","Wen Feng; Xue-ping Wu; Wei-Ke Su","<i>S</i>-(4-Methoxyphenyl) 3-methylsulfonyl-2-oxoimidazolidine-1-carbothioate","Acta Crystallographica Section E","2005","61","5","o1507","o1508","10.1107/S1600536805012560","","","0.71073","MoKα","","0.0584","0.0524","","","0.1153","0.1188","","","","","","1.176","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205692","10.797","0.002","11.571","0.002","12.0982","0.0016","90","","123.576","0.011","90","","1259.3","0.4","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-acetyl-4-methyl-2-(o-toluidinyl)-1,3-thiazole","","- C13 H14 N2 O S -","- C13 H14 N2 O S -","- C52 H56 N8 O4 S4 -","4","1","CV6497","Yamin, Bohari M.; Kasim. N. Azilah; Akhiar, Ezuanita","5-Acetyl-4-methyl-2-(<i>o</i>-toluidinyl)-1,3-thiazole","Acta Crystallographica Section E","2005","61","5","o1478","o1479","10.1107/S160053680501250X","","","0.71073","MoKα","","0.049","0.044","","","0.118","0.122","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205693","10.898","0.002","21.521","0.005","6.623","0.002","90","","90","","90","","1553.3","0.7","298","2","298","2","","","","","","","","4","C m c e","-C 2ac 2","64","","tripotassium triiron(III) tetraarsenate","","- As4 Fe3 K3 O16 -","- As4 Fe3 K3 O16 -","- As16 Fe12 K12 O64 -","4","0.25","DN6202","Ouerfelli, Najoua; Zid, Mohamed Faouzi; Jouini, Tahar","Composé à charpente bidimensionnelle K~3~Fe~3~(AsO~4~)~4~","Acta Crystallographica, Section E","2005","61","5","i67","i69","10.1107/S1600536805008998","","","0.71073","MoKα","","0.0564","0.04","","","0.0945","0.1022","","","","","","1.076","","","","has coordinates","282068","2023-03-26","10:12:38",""
"2205694","12.09","0.003","13.403","0.003","8.157","0.003","90","","95.79","0.03","90","","1315","0.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H11 N O5 S -","- C14 H11 N O5 S -","- C56 H44 N4 O20 S4 -","4","1","DN6205","Stefanowicz, Piotr; Jaremko, Łukasz; Jaremko, Mariusz; Lis, Tadeusz","1-[(2-Naphthylsulfonyl)oxy]pyrrolidine-2,5-dione","Acta Crystallographica Section E","2005","61","5","o1326","o1328","10.1107/S1600536805010469","","","0.71073","MoKα","","0.0704","0.0455","","","0.1212","0.1333","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205695","8.7112","0.0015","9.8967","0.0017","11.1551","0.0019","73.323","0.002","88.603","0.002","66.981","0.002","843.7","0.3","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","2-(4-Fluorophenyl)-2-oxo-1-(1<i>H</i>-1,2,4-triazol-1-yl)ethyl piperidine-1-carbodithiolate","","- C16 H17 F N4 O S2 -","- C16 H17 F N4 O S2 -","- C32 H34 F2 N8 O2 S4 -","2","1","DN6208","Liang-Zhong Xu; Kai Li; Chong-Yi Zhu; Guo-Dong Si; Guan-Ping Yu","2-(4-Fluorophenyl)-2-oxo-1-(1<i>H</i>-1,2,4-triazol-1-yl)ethyl piperidine-1-carbodithiolate","Acta Crystallographica Section E","2005","61","5","o1306","o1307","10.1107/S1600536805010561","","","0.71073","MoKα","","0.0492","0.0337","","","0.0813","0.0859","","","","","","1.096","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205696","8.2045","0.0009","8.9704","0.001","9.6826","0.001","93.026","0.002","109.337","0.002","109.787","0.002","621.71","0.12","293","2","293","2","","","","","","","","3","P -1","-P 1","2","3-hydroxykojic acid","3,5-dihydroxy-2-hydroxymethyl-4H-pyran-4-one","","- C6 H6 O5 -","- C6 H6 O5 -","- C24 H24 O20 -","4","2","DN6212","Yao, Guang-Min; Wang, Yu-Bo; Wang, Li-Quan; Qin, Guo-Wei","3,5-Dihydroxy-2-hydroxymethyl-4<i>H</i>-pyran-4-one","Acta Crystallographica Section E","2005","61","5","o1403","o1405","10.1107/S1600536805011633","","","0.71073","MoKα","","0.0672","0.0609","","","0.1745","0.1818","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205697","8.159","0.007","8.712","0.007","10.531","0.009","82.385","0.013","77.494","0.013","80.064","0.014","716.3","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H20 Fe N10 O4 S2 -","- C26 H20 Fe N10 O4 S2 -","- C26 H20 Fe N10 O4 S2 -","1","0.5","DN6213","Xiao-Jun Zhao; Jian-Hua Guo; Miao Du","A three-dimensional hydrogen-bonded network of diaquabis(2,5-di-3-pyridyl-1,3,4-oxadiazole)dithiocyanatoiron(II)","Acta Crystallographica Section E","2005","61","5","m913","m915","10.1107/S1600536805011268","","","0.71073","MoKα","","0.0651","0.0407","","","0.0844","0.0932","","","","","","1.023","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205698","10.4874","0.001","12.1216","0.0014","16.3091","0.0016","90","","90","","90","","2073.3","0.4","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","1-(2-furyl)-3-phenyl-2-propen-1-one","","- C13 H10 O2 -","- C13 H10 O2 -","- C104 H80 O16 -","8","1","DN6214","Ocak Ískeleli, Nazan; Işık, Şamil; Özdemir, Zuhal; Bilgin, Altan","1-(2-Furyl)-3-phenyl-2-propen-1-one","Acta Crystallographica Section E","2005","61","5","o1278","o1279","10.1107/S1600536805010615","","","0.71073","MoKα","","0.108","0.0402","","","0.0658","0.0793","","","","","","0.843","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205699","12.6686","0.001","8.9057","0.0007","13.44","0.0011","90","","91.737","0.001","90","","1515.6","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(4,5,6,7-tetrachloro-1,3-dioxoisoindolin-2-yl)benzaldehyde","","- C15 H5 Cl4 N O3 -","- C15 H5 Cl4 N O3 -","- C60 H20 Cl16 N4 O12 -","4","1","DN6215","Liu, Xin-Gang; Feng, Ya-Qing; Wang, Wei; Liang, Zu-Pei; Yang, Guang","4-(4,5,6,7-Tetrachloro-1,3-dioxoisoindolin-2-yl)benzaldehyde","Acta Crystallographica Section E","2005","61","5","o1316","o1317","10.1107/S1600536805010822","","","0.71073","MoKα","","0.0382","0.0301","","","","0.0852","","","","","","1.098","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205700","10.2204","0.0011","12.4047","0.0013","13.7842","0.0015","106.505","0.002","94.417","0.002","110.455","0.002","1539.4","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","[Aquabis(1,10-phenanthroline-κ^2^N,N')(2-sulfobenzoato-κO)manganese(II)] trihydrate","","- C31 H28 Mn N4 O9 S -","- C31 H28 Mn N4 O9 S -","- C62 H56 Mn2 N8 O18 S2 -","2","1","DN6217","Hong-Ping Xiao","Aquabis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(2-sulfobenzoato-κ<i>O</i>)manganese(II) trihydrate","Acta Crystallographica Section E","2005","61","5","m942","m944","10.1107/S1600536805011906","","","0.71073","MoKα","","0.101","0.0732","","","0.1419","0.1539","","","","","","1.12","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205701","7.8089","0.0004","8.8904","0.0005","14.7466","0.0012","90","","96.143","0.007","90","","1017.89","0.11","122","1","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-(1-naphtyl)propionic acid","","- C13 H12 O2 -","- C13 H12 O2 -","- C52 H48 O8 -","4","1","ER6003","Riis, Erik; Larsen, Sine","2-(1-Naphthyl)propionic acid","Acta Crystallographica Section E","2005","61","5","o1396","o1397","10.1107/S1600536805004125","","","0.71073","MoKα","","0.0707","0.0549","","","0.1463","0.1606","","","","","","1.053","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205702","9.608","0.0019","22.856","0.004","10.2908","0.0017","90","","98.353","0.016","90","","2235.9","0.7","298","2","298","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C24 H29 N O5 -","- C24 H29 N O5 -","- C96 H116 N4 O20 -","4","1","ER6008","Våbenø, Jon; Ingebrigtsen, Truls; Lejon, Tore; Luthman, Kristina; Hansen, Lars Kr.","Benzyl-5-[<i>N</i>-(<i>tert</i>-butoxycarbonyl)amino]-4-oxo-6-phenylhexanoate","Acta Crystallographica Section E","2005","61","5","o1331","o1332","10.1107/S1600536805010895","","","0.71069","MoKα","","0.1193","0.0354","","","0.0816","0.0987","","","","","","0.912","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205703","9.0795","0.0018","10.134","0.002","12.624","0.003","104.84","0.03","91.11","0.03","92.08","0.03","1121.6","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","{2-[(2-Hydroxyphenyl)iminomethyl]phenolato}(N-oxido-N- phenylbenzamide)oxovanadium(V)","","- C26 H19 N2 O5 V -","- C26 H19 N2 O5 V -","- C52 H38 N4 O10 V2 -","2","1","ER6010","Shan Gao; Li-Hua Huo; Zhao-Peng Deng; Hui Zhao","{2-[(2-Hydroxyphenyl)iminomethyl]phenolato}(<i>N</i>-oxido-<i>N</i>-phenylbenzamide)oxovanadium(V)","Acta Crystallographica Section E","2005","61","5","m978","m980","10.1107/S1600536805012602","","","0.71073","MoKα","","0.0564","0.0456","","","0.1246","0.1313","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205704","10.8349","0.0007","10.8349","0.0007","14.6028","0.0013","90","","90","","120","","1484.62","0.19","298","2","298","2","","","","","","","","6","P 3 1 c","P 3 -2c","159","","Tris({2-[(1-methylimidazol-2-yl)methylimino]ethyl}amine)cobalt(II) diperchlorate","","- C21 H30 Cl2 Co N10 O8 -","- C21 H30 Cl2 Co N10 O8 -","- C42 H60 Cl4 Co2 N20 O16 -","2","0.333333","ER6012","Chen, Hong-Mei; Yang Shi-Ping; Chen, Qiong-Qiong; Zhang, Fan; Chen Jia-Min; Yu, Xi-Bin","Tris({2-[(1-methylimidazol-2-yl)methylimino]ethyl}amine)cobalt(II) diperchlorate","Acta Crystallographica Section E","2005","61","5","m1001","m1003","10.1107/S1600536805012596","","","0.71073","MoKα","","0.055","0.0507","","","0.1331","0.1366","","","","","","1.041","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205705","10.367","0.004","5.1611","0.0007","13.12","0.003","90","","93.2","0.02","90","","700.9","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","L-Asparaginium picrate","L-Asparaginium picrate","","- C10 H11 N5 O10 -","- C10 H11 N5 O10 -","- C20 H22 N10 O20 -","2","1","ER6019","K. Anitha; S. Athimoolam; R. K. Rajaram","<small>L</small>-Asparaginium picrate","Acta Crystallographica Section E","2005","61","5","o1463","o1465","10.1107/S1600536805012080","","","0.71073","MoKα","","0.0271","0.0251","","","0.0679","0.0695","","","","","","1.094","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205706","11.063","0.002","18.313","0.003","12.615","0.002","90","","92.578","0.002","90","","2553.2","0.7","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis[μ-salicylaldehyde (1-carboxylatoethylidene)hydrazonato(2-)]bis[ethanolbis(4-fluorobenzyl)tin(IV)]","","- C52 H52 F4 N4 O10 Sn2 -","- C52 H52 F4 N4 O10 Sn2 -","- C104 H104 F8 N8 O20 Sn4 -","2","0.5","FL6151","Min Hong; Handong Yin; Daqi Wang; Zhongjun Gao","Bis(4-fluorobenzyl)tin(IV) ester of pyruvic acid salicylhydrazone","Acta Crystallographica Section E","2005","61","5","m801","m803","10.1107/S1600536805009694","","","0.71073","MoKα","","0.0475","0.0288","","","0.0677","0.0799","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205707","9.245","0.0008","10.0697","0.0009","18.87","0.002","90","","102.654","0.008","90","","1714","0.3","298","2","298","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","12,12'-Diisobutyl-11,11'-ethylenebis(9,10-dihydro-9,10-ethenoanthracene)","","- C44 H46 -","- C44 H46 -","- C88 H92 -","2","0.5","FL6152","Herres, Joeseph P.; Forman, Mark A.; Wheeler, Kraig A.; Yap, Glenn P.A.","11-(2,2-Dimethylpropyl)-12-{2-[12-(2,2-dimethylpropyl)-9,10-dihydro-9,10-ethenoanthracen-11-yl]ethyl}-9,10-dihydro-9,10-ethenoanthracene","Acta Crystallographica Section E","2005","61","5","o1223","o1225","10.1107/S160053680500944X","","","0.71073","MoKα","","0.1336","0.0593","","","0.1087","0.1336","","","","","","1.001","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205708","5.838","0.002","9.883","0.004","10.576","0.004","107.225","0.014","100.203","0.014","98.894","0.014","559.5","0.4","105","2","105","2","","","","","","","","4","P 1","P 1","1","α-thymidine","1-(2-Deoxy-α-D-ribofuranosyl)-5-methyluracil","","- C10 H14 N2 O5 -","- C10 H14 N2 O5 -","- C20 H28 N4 O10 -","2","2","FL6154","Görbitz, Carl Henrik; Nelson, William H.; Sagstuen, Einar","α-Thymidine at 105 K","Acta Crystallographica Section E","2005","61","5","o1207","o1209","10.1107/S1600536805009700","","","0.71073","MoKα","","0.034","0.0322","","","0.085","0.0861","","","","","","1.071","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205709","6.0458","0.0003","9.3592","0.0005","14.0314","0.0006","90","","90.5","0.001","90","","793.92","0.07","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","poly[dioxouranium(VI)-μ~4~-n-pentane-1,5-dicarboxylato]","","- C5 H6 O6 U -","- C5 H6 O6 U -","- C20 H24 O24 U4 -","4","1","FL6155","Borkowski, Lauren A.; Cahill, Christopher L.","A novel uranium-containing coordination polymer: poly[dioxouranium(VI)-μ~4~-<i>n</i>-pentane-1,5-dicarboxylato]","Acta Crystallographica Section E","2005","61","5","m816","m817","10.1107/S1600536805009438","","","0.71073","MoKα","","0.0315","0.0267","","","601","0.0622","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205710","17.815","0.005","8.022","0.003","12.251","0.003","90","","110.09","0.02","90","","1644.3","0.9","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-(Hexyloxy)phenyl)pyridin-4(1H)-one monohydrate","","- C17 H23 N O3 -","- C17 H23 N O3 -","- C68 H92 N4 O12 -","4","1","FL6156","Robinson, Paul D.; Li, Chenguang; Wolf, Jeremy R.; Dyer, Daniel J.","1-[4-(Hexyloxy)phenyl]pyridin-4(1<i>H</i>)-one monohydrate","Acta Crystallographica Section E","2005","61","5","o1254","o1256","10.1107/S1600536805010524","","","0.71069","MoKα","","0.158","0.071","","","0.219","0.28","","","","","","1.04","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205711","8.7362","0.0011","6.8235","0.0008","16.957","0.002","90","","95.769","0.002","90","","1005.7","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(+)-(1S,2S,3S,4R,5R)-N-(1,3-Dihydroxyprop-2-yl)-2,3,4-trihydroxy- 5-(hydroxymethyl)-1-cyclohexanaminium picrate","","- C16 H24 N4 O13 -","- C16 H24 N4 O13 -","- C32 H48 N8 O26 -","2","1","FL6157","Zhu, Jiarong; Chang, Hongjie; Feng, Xiao-Long","(+)-(1<i>S</i>,2<i>S</i>,3<i>S</i>,4<i>R</i>,5<i>R</i>)-<i>N</i>-(1,3-Dihydroxyprop-2-yl)-2,3,4-trihydroxy-5-(hydroxymethyl)-1-cyclohexanaminium picrate","Acta Crystallographica Section E","2005","61","5","o1498","o1500","10.1107/S1600536805012419","","","0.71073","MoKα","","0.0428","0.0373","","","0.0955","0.1029","","","","","","1.049","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205712","6.2782","0.0003","8.5831","0.0004","12.3649","0.0006","90","","100.133","0.002","90","","655.91","0.05","298","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","p-aminobenzoic acid","","- C7 H7 N O2 -","- C7 H7 N O2 -","- C28 H28 N4 O8 -","4","1","GH6019","Sandra Gracin; Andreas Fischer","Redetermination of the β-polymorph of <i>p</i>-aminobenzoic acid","Acta Crystallographica Section E","2005","61","5","o1242","o1244","10.1107/S160053680500961X","","","0.71073","MoKα","","0.0834","0.0499","","","0.114","0.1314","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205713","19.0062","0.0018","11.2552","0.0011","20.457","0.002","90","","102.273","0.002","90","","4276.1","0.7","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tris(1,10-phenanthroline)nickel(II) hexamolybdate","","- C36 H24 Mo6 N6 Ni O19 -","- C36 H24 Mo6 N6 Ni O19 -","- C144 H96 Mo24 N24 Ni4 O76 -","4","0.5","HB6157","Wenju Wang; Lin Xu; Guanggang Gao; Yongge Wei","Tris(1,10-phenanthroline)nickel(II) hexamolybdate","Acta Crystallographica Section E","2005","61","5","m813","m815","10.1107/S1600536805009748","","","0.71073","MoKα","","0.0324","0.0284","","","0.0757","0.0785","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205714","15.2039","0.0013","7.0727","0.0006","19.4242","0.0019","90","","104.018","0.012","90","","2026.5","0.3","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Disodium 4-hydroxybutane-1,1-diylbis(diazeniumdiolate) sesquihydrate","","- C4 H11 N4 Na2 O6.5 -","- C4 H8 N4 Na2.005 O6.495 -","- C32 H64 N32 Na16.04 O51.96 -","8","1","HB6168","Arulsamy, Navamoney; Bohle, D. Scott","Disodium 4-hydroxybutane-1,1-diylbis(diazeniumdiolate) sesquihydrate","Acta Crystallographica Section E","2005","61","5","m961","m963","10.1107/S1600536805012250","","","0.71073","MoKα","","0.0302","0.0288","","","0.0732","0.0742","","","","","","1.081","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2205715","13.223","0.003","15.779","0.003","19.574","0.004","90","","101.065","0.004","90","","4008.1","1.4","120","","120","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-(Piperidin-1-yl)propionic acid‒triphenyltin chloride (1/2)","","- C44 H45 Cl2 N O2 Sn2 -","- C44 H45 Cl2 N O2 Sn2 -","- C176 H180 Cl8 N4 O8 Sn8 -","4","1","HB6170","Lian Ee Khoo; Alan Hazell","A 1:2 adduct of 3-(piperidin-1-yl)propionic acid and triphenyltin chloride","Acta Crystallographica Section E","2005","61","5","m865","m867","10.1107/S1600536805010792","","","0.71073","MoKα","","","0.022","","","","0.025","","","","","","0.806","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205716","8.682","0.001","9.421","0.001","32.108","0.003","90","","90","","90","","2626.2","0.5","291","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","Pentacarbonyl (diphenyl(N-propylamine)phosphine) diiron(μ-1,3-dithiolate propane)","","- C23 H24 Fe2 N O5 P S2 -","- C23 H24 Fe2 N O5 P S2 -","- C92 H96 Fe8 N4 O20 P4 S8 -","4","1","HB6172","Ekström, Jesper; Ott, Sascha; Sun, Licheng; Åkermark, Björn; Eriksson, Lars","Pentacarbonyl(diphenyl(<i>N</i>-propylamine)phosphine)diiron(μ-1,3-propanedithiolate)","Acta Crystallographica Section E","2005","61","5","m852","m853","10.1107/S1600536805010809","","","0.71073","MoKα","","0.123","0.0349","","","0.0488","0.0578","","","","","","0.885","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205717","24.12","0.011","10.732","0.005","21.78","0.011","90","","108.098","0.008","90","","5359","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C50 H92 Cl2 P4 Ru -","- C50 H92 Cl2 P4 Ru -","- C200 H368 Cl8 P16 Ru4 -","4","0.5","HB6174","Linfang Jia; Wenfu Fu; Mingming Yu; Junfeng Zhang; Yong Chen","(<i>Trans</i>-dichloro-κ<i>Cl</i>)bis[(dicyclohexylphosphino)methane-κ^2^<i>P,P</i>'] ruthenium(II)","Acta Crystallographica Section E","2005","61","5","m858","m859","10.1107/S1600536805010743","","","0.71073","MoKα","","0.0504","0.0324","","","0.0743","0.0827","","","","","","1.085","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205718","24.0937","0.0004","24.6345","0.0005","16.7428","0.0003","90","","117.375","0.0011","90","","8824.6","0.3","150","1","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C48 H76 F12 Nd4 O42 S4 -","- C40 H56 F12 Nd4 O40 S4 -","- C160 H224 F48 Nd16 O160 S16 -","4","0.5","HB6176","Singh-Wilmot, Marvadeen A.; Kahwa, Ishenkumba A.; Lough, Alan J.","Octaaquatetrakis(μ~2~-2,6-diformyl-4-methylphenolato)tetra-μ~3~-hydroxo-tetraneodymium(III) trifluoromethanesulfonate butanol disolvate tetrahydrate","Acta Crystallographica Section E","2005","61","5","m970","m972","10.1107/S1600536805011785","","","0.71073","MoKα","","0.0529","0.0486","","","0.1204","0.1219","","","","","","1.232","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205719","7.5665","0.0016","9.701","0.002","14.129","0.003","103.82","0.003","98.958","0.003","91.721","0.003","992.4","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H20 N4 Ni O5 S2 -","- C14 H20 N4 Ni O5 S2 -","- C28 H40 N8 Ni2 O10 S4 -","2","1","HB6177","Shi, Jing Min; Liu, Zhe; Lu, Jian Jun; Liu, Lian Dong","Diaquabis(isothiocyanato)bis(4-methylpyridine <i>N</i>-oxide)nickel(II) monohydrate","Acta Crystallographica Section E","2005","61","5","m871","m872","10.1107/S1600536805010937","","","0.71073","MoKα","","0.0398","0.0353","","","0.0911","0.0941","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205721","15.235","0.0015","19.329","0.0012","15.875","0.0014","90","","113.96","0.006","90","","4272","0.7","273","","273","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","pyrimethaminium sulfosalicylate monohydrate","2,4-diamino-5-(4-chlorophenyl)-6-ethylpyrimidin-1-ium 3-carboxy-4-hydroxybenzenesulfonate monohydrate","","- C19 H21 Cl N4 O7 S -","- C19 H21 Cl N4 O7 S -","- C152 H168 Cl8 N32 O56 S8 -","8","2","HB6180","Madhukar Hemamalini; Packianathan Thomas Muthiah; Balasubramanian Sridhar; Ramaswamy Karunanandam Rajaram","Pyrimethaminium sulfosalicylate monohydrate","Acta Crystallographica Section E","2005","61","5","o1480","o1482","10.1107/S1600536805012237","","","0.71069","MoKα","","0.0818","0.0356","","","0.0886","0.1059","","","","","","1.012","","","","has coordinates","211332","2020-10-21","18:00:00",""
"2205722","4.9026","0.0005","17.0331","0.0016","10.479","0.001","90","","97.88","0.002","90","","866.8","0.15","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[μ~4~-5-(3-carboxylato)-1H-tetrazolato-zinc(II)]","","- C8 H4 N4 O2 Zn -","- C8 H4 N4 O2 Zn -","- C32 H16 N16 O8 Zn4 -","4","1","HB6181","Li, Jing-Tang; Tao, Jun; Huang, Rong-Bin; Zhang, Lan-Sun","Poly[μ~4~-5-(3-carboxylatophenyl)-1<i>H</i>-tetrazolato-zinc(II)]","Acta Crystallographica Section E","2005","61","5","m984","m985","10.1107/S1600536805012687","","","0.71073","MoKα","","0.0656","0.0513","","","0.1121","0.1184","","","","","","1.119","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205723","8.4429","0.0002","24.1805","0.0006","17.0825","0.0004","90","","103.495","0.007","90","","3391.17","0.17","295","3","295","3","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H30 Mn N4 O8 -","- C38 H30 Mn N4 O8 -","- C152 H120 Mn4 N16 O32 -","4","1","HB6182","Jian-Rong Su; Li Zhang; Duan-Jun Xu","Aqua(4-hydroxybenzoato-κ<i>O</i>)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II) 4-hydroxybenzoate monohydrate","Acta Crystallographica Section E","2005","61","5","m939","m941","10.1107/S1600536805011694","","","0.71069","MoKα","","0.085","0.046","","","0.077","0.088","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205724","8.4061","0.0007","5.0843","0.0004","10.7278","0.0008","90","","90","","90","","458.5","0.06","93","2","93","2","","","","","","","","3","P n m a","-P 2ac 2n","62","PrCu~5-x~In~1+x~","","","- Cu4.76 In1.24 Pr -","- Cu4.763 In1.237 Pr -","- Cu19.052 In4.948 Pr4 -","4","0.5","HB6183","Bobev, Svilen; Bauer, Eric D.","PrCu~5{-~<i>x</i>}In~1+<i>x~</i> [<i>x</i> = 0.24(1)] with the orthorhombic CeCu~6~ structure type","Acta Crystallographica Section E","2005","61","5","i79","i81","10.1107/S1600536805011797","","","0.71073","MoKα","","0.0205","0.016","","","0.0316","0.0326","","","","","","1.136","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205725","8.4056","0.0007","5.0939","0.0004","10.738","0.0008","90","","90","","90","","459.77","0.06","93","2","93","2","","","","","","","","3","P n m a","-P 2ac 2n","62","CeCu~5-x~In~1+x~","cerium copper indium","","- Ce Cu4.82 In1.17 -","- Ce Cu4.822 In1.178 -","- Ce4 Cu19.288 In4.712 -","4","0.5","HB6184","Bobev, Svilen; Bauer, Eric D.","CeCu~5{-~<i>x</i>}In~1+<i>x~</i> [<i>x</i> = 0.17(1)] with the orthorhombic CeCu~6~ structure","Acta Crystallographica Section E","2005","61","5","i89","i90","10.1107/S1600536805012249","","","0.71073","MoKα","","0.0225","0.0201","","","0.0494","0.0502","","","","","","1.23","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205726","9.705","0.004","10.205","0.004","10.866","0.004","96.481","0.005","111.579","0.005","116.199","0.005","847.7","0.6","183","2","183","2","","","","","","","","7","P -1","-P 1","2","Bis(ferrocenoyl thioureylene)ethane","1,2-Bis(ferrocenylcarbonylthioureido)ethane chloroform trisolvate","","- C28 H28 Cl6 Fe2 N4 O2 S2 -","- C28 H28 Cl6 Fe2 N4 O2 S2 -","- C28 H28 Cl6 Fe2 N4 O2 S2 -","1","0.5","HB6186","Duan, Xine; Zhang, Zhao; Huo, Fangjun","1,2-Bis(ferrocenylcarbonylthioureido)ethane chloroform disolvate","Acta Crystallographica Section E","2005","61","5","m1004","m1005","10.1107/S1600536805012705","","","0.71073","MoKα","","0.0749","0.0684","","","0.1554","0.1591","","","","","","1.127","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205727","8.157","0.001","6.7568","0.0008","17.451","0.002","90","","94.697","0.002","90","","958.6","0.2","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","catena-Poly[[aquazinc(II)]-μ-2-carboxylatophenoxyacetato]","","- C9 H8 O6 Zn -","- C9 H8 O6 Zn -","- C36 H32 O24 Zn4 -","4","1","HB6187","Yang, Yan; Meng, Fa-Yan; Zeng, Ming-Hua; Ng, Seik Weng","<i>catena</i>-Poly[[aquazinc(II)]-μ-2-carboxylatophenoxyacetato]","Acta Crystallographica Section E","2005","61","5","m986","m988","10.1107/S1600536805012729","","","0.71073","MoKα","","0.026","0.022","","","0.058","0.06","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205728","7.15","0.002","8.573","0.003","11.171","0.003","98.316","0.004","98.953","0.004","98.42","0.004","659.2","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","6-Cyano-3,3-dimethyl-5-methylsulfanyl-1,3-dihydro-2-oxo-1-thia- 3b,4,8-triazaindacene 1,1-dioxide","","- C11 H10 N4 O3 S2 -","- C11 H10 N4 O3 S2 -","- C22 H20 N8 O6 S4 -","2","1","HG6151","Tian, Li; Wang, Da-Xiang","6-Cyano-3,3-dimethyl-5-methylsulfanyl-1,3-dihydro-2-oxo-1-thia-3b,4,8-triazaindacene 1,1-dioxide","Acta Crystallographica Section E","2005","61","5","o1286","o1287","10.1107/S1600536805010329","","","0.71073","MoKα","","0.0447","0.0393","","","0.1184","0.1208","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205729","10.384","0.002","11.867","0.002","12.659","0.003","90.98","0.003","108.339","0.003","111.211","0.002","1365.2","0.5","183","2","183","2","","","","","","","","4","P -1","-P 1","2","","Dianilinodimethylsilane","","- C14 H18 N2 Si -","- C14 H18 N2 Si -","- C56 H72 N8 Si4 -","4","2","HG6152","Dong, Hai-Lin; Tong, Hong-Bo; Wei, Xue-Hong; Huang, Shu-Ping; Liu, Dian-Sheng","Dianilinodimethylsilane","Acta Crystallographica Section E","2005","61","5","o1354","o1355","10.1107/S1600536805011037","","","0.71073","MoKα","","0.0852","0.0785","","","0.1515","0.1552","","","","","","1.231","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205730","7.6811","0.0015","9.754","0.002","14.357","0.003","90","","90","","90","","1075.6","0.4","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Naphthalene-1,4,5,8-tetracarboxylic 1,8-anhydride","","- C14 H6 O7 -","- C14 H6 O7 -","- C56 H24 O28 -","4","1","HG6153","Xu, Yan-Qing; Yuan, Da-Qiang; Zhou, You-Fu; Wu, Ming-Yan; Hong, Mao-Chun","Naphthalene-1,4,5,8-tetracarboxylic 1,8-anhydride","Acta Crystallographica Section E","2005","61","5","o1294","o1296","10.1107/S1600536805009463","","","0.71073","MoKα","","0.0821","0.0634","","","0.128","0.1385","","","","","","1.093","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205731","19.1786","0.0009","7.7058","0.0003","14.0757","0.0007","90","","92.373","0.002","90","","2078.41","0.16","296.1","","","","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C23 H23 F O8 -","- C23 H23 F O8 -","- C92 H92 F4 O32 -","4","1","HG6158","Zhou, Feng-Yan; Jian, Shan-Zhong; He, Xue-Ying; Wang, Yan-Guang","(5<i>R</i>,5a<i>R</i>,8a<i>R</i>,9<i>S</i>)-5-(3,4-dihydroxy-5-methoxyphenyl)-9-fluoro-5,8,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-<i>d</i>]-1,3-dioxol-6(5a<i>H</i>)-one acetone solvate","Acta Crystallographica Section E","2005","61","5","o1374","o1376","10.1107/S1600536805011189","","","0.7107","MoKα","","","0.047","","","","0.132","","","","","","1.007","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205732","25.035","0.002","25.035","0.002","11.929","0.002","90","","90","","90","","7476.5","1.5","293","2","293","2","","","","","","","","6","I -4","I -4","82","","1-N-methyl-spiro[2.3']oxindole-spiro[3.2""]5""-(4-chloro)phenyl -10""-(4-chloro)benzylidene-2"",3"",6"",7"",8"",9""-hexahydro-5H,10H- cyclohepteno[1,2-d]thiazolo[3,2-a]pyrimidin-3""-one-4-(2,4- dichloro)phenyl-pyrrolidine","","- C41 H32 Cl4 N4 O2 S -","- C41 H32 Cl4 N4 O2 S -","- C328 H256 Cl32 N32 O16 S8 -","8","1","HG6161","Hu, Xiao-Fen; Feng, Ya-Qing; Liu, Xin-Gang; Qiao, Kang-Jian","10''-(4-Chlorobenzylidene)-5''-(4-chlorophenyl)-4'-(2,4-dichlorophenyl)-1'-methyl-2,3,2'',3'',7'',8'',9'',10''-octahydro-1<i>H</i>,5''<i>H</i>,6''<i>H</i>-indole-3-spiro-2'-pyrrolidine-3'-spiro-2''-cyclohepteno[1,2-<i>d</i>]thiazolo[3,2-<i>a</i>]pyrimidine-2,3''-dione","Acta Crystallographica Section E","2005","61","5","o1411","o1413","10.1107/S1600536805011621","","","0.71073","MoKα","","0.1156","0.0485","","","","0.1678","","","","","","1.004","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"2205733","7.602","0.002","23.09","0.006","10.711","0.003","90","","92.05","0.02","90","","1878.9","0.9","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","10-(5-chloro-2-hydroxybenzylidene)anthrone acetonitrile solvate","","- C23 H16 Cl N O2 -","- C23 H16 Cl N O2 -","- C92 H64 Cl4 N4 O8 -","4","1","HG6163","Wei Zhou; Jie Yan; Wei-Xiao Hu; Chun-Nian Xia","10-(5-Chloro-2-hydroxybenzylidene)anthrone acetonitrile solvate","Acta Crystallographica Section E","2005","61","5","o1523","o1524","10.1107/S1600536805011955","","","0.71073","MoKα","","0.1998","0.0499","","","0.1141","0.1586","","","","","","0.984","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205734","7.2253","0.0001","8.1217","0.0001","32.7768","0.0004","90","","90","","90","","1923.4","0.04","293","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H23 F O6 -","- C22 H23 F O6 -","- C88 H92 F4 O24 -","4","1","HG6164","Jian-Hua Zhong; Shan-Zhong Jian; Xue-Ying He; Yan-Guang Wang","(5α,8α,9β,11<i>S</i>)-5,7,8,9-Tetrahydro-11-(fluoromethyl)-9-(3,4,5-trimethoxyphenyl)-5,8-methano-1,3-dioxolo[4,5-<i>h</i>][2]benzoxepin","Acta Crystallographica Section E","2005","61","5","o1280","o1282","10.1107/S1600536805010366","","","0.71069","MoKα","","","0.05","","","","0.1428","","","","","","1.091","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205735","8.759","0.002","10.488","0.003","12.08","0.003","90","","110.015","0.005","90","","1042.7","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H10 Br N3 O -","- C9 H10 Br N3 O -","- C36 H40 Br4 N12 O4 -","4","1","HG6165","Xiang-Chao Zeng; Yu-Xia Li; Shi-Hai Xu; Po-Run Liu","<i>N</i>-Methyl-3-(4-bromo-1<i>H</i>-pyrrole-2-carbonyl)aminopropionitrile","Acta Crystallographica Section E","2005","61","5","o1291","o1293","10.1107/S160053680501038X","","","0.71073","MoKα","","0.0595","0.0431","","","0.11","0.1203","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205736","13.228","0.009","19.64","0.014","11.524","0.008","90","","114.024","0.011","90","","2735","3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","[4-(2,2-Diphenyl-vinyl)-phenyl]-diphenyl- amine. n-hexane(1/0.25)","","- C33.5 H28.5 N -","- C33.5 H28.5 N -","- C134 H114 N4 -","4","1","HG6166","Chu, Ji-Cheng; Li, Wei; Liu, Dong-Zhi; Cao, Xiao-Dan","[4-(2,2-Diphenylvinyl)phenyl]diphenylamine <i>n</i>-hexane 0.25 solvate","Acta Crystallographica Section E","2005","61","5","o1372","o1373","10.1107/S1600536805011177","","","0.71073","MoKα","","0.122","0.0687","","","0.2033","0.2434","","","","","","1.092","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2205737","10.482","0.0011","13.1288","0.0015","10.0749","0.0011","90","","103.719","0.004","90","","1346.9","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(μ~4~-Disulfido-1:2κ^2^S;3:4κ^2^S')bis(μ~2~-ethylthiolato- κ^2^Fe,Fe')tetrakis[tricarbonyliron(II)(Fe—Fe)]","","- C16 H10 Fe4 O12 S4 -","- C16 H10 Fe4 O12 S4 -","- C32 H20 Fe8 O24 S8 -","2","0.5","HG6168","Cheng, Lan-Xia; Ma, Cheng-Bing; Hu, Ming-Qiang; Chen, Chang-Neng","(μ~4~-Disulfido-1:2κ^2^<i>S</i>,<i>S</i>;3:4κ^2^<i>S</i>',<i>S</i>')bis(μ~2~-ethylthiolato-κ^<i>2^</i><i>S</i>:<i>S</i>)tetrakis[tricarbonyliron(II)(Fe—Fe)]","Acta Crystallographica Section E","2005","61","5","m892","m894","10.1107/S1600536805011165","","","0.71073","MoKα","","","0.0402","","","0.0854","0.0935","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205738","9.735","0.0007","10.9349","0.001","13.0522","0.001","90","","103.544","0.006","90","","1350.78","0.19","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H9 Cl3 N2 -","- C13 H9 Cl3 N2 -","- C52 H36 Cl12 N8 -","4","1","HG6169","Ton, Quoc Coung; Bolte, Michael","A co-crystal of 1,10-phenanthroline and chloroform","Acta Crystallographica Section E","2005","61","5","o1406","o1407","10.1107/S1600536805011669","","","0.71073","MoKα","","0.0609","0.0445","","","0.1113","0.1194","","","","","","1.022","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205739","10.662","0.002","18.315","0.004","7.6831","0.0015","90","","98.377","0.003","90","","1484.3","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6,7-dihydro-6-methyl-3-(methylthio)-1-p-tolylpyrano[4,3-c]pyrazol-4(1H)-one","","- C15 H16 N2 O2 S -","- C15 H16 N2 O2 S -","- C60 H64 N8 O8 S4 -","4","1","HG6170","Jing-Jun Hao; You-Ming Wang; Zheng-Ming Li; Hai-Bing Song","6,7-Dihydro-6-methyl-3-(methylsulfanyl)-1-(<i>p</i>-tolyl)pyrano[4,3-<i>c</i>]pyrazol-4(1<i>H</i>)-one","Acta Crystallographica Section E","2005","61","5","o1424","o1425","10.1107/S1600536805011931","","","0.71073","MoKα","","0.0639","0.0379","","","0.0943","0.1099","","","","","","0.983","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205740","8.2271","0.0007","9.4663","0.0008","9.5945","0.0009","97.559","0.007","90.415","0.007","90.238","0.007","740.7","0.11","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H38 Cu O14 S8 -","- C12 H38 Cu O14 S8 -","- C12 H38 Cu O14 S8 -","1","0.5","HG6171","Bieller, Susanne; Lerner, Hans-Wolfram; Bolte, Michael","Hexakis(dimethyl sulfoxide)copper(II) bis(hydrogen sulfate)","Acta Crystallographica Section E","2005","61","5","m928","m929","10.1107/S1600536805011670","","","0.71073","MoKα","","0.0233","0.0232","","","0.0581","0.0581","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205741","10.25","0.002","10.691","0.002","12.263","0.003","105.46","0.03","110.74","0.03","92.3","0.03","1197.7","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Methyl 3-(dimethylamino)-2-(2-{1-[3-(2-methylphenyl)-1,2,4-oxadiazol -5-yl]-2-(dimethylamino)vinyloxyl}phenyl)acrylate","","- C25 H28 N4 O4 -","- C25 H28 N4 O4 -","- C50 H56 N8 O8 -","2","1","HG6172","Pu, Yue-Qing; Wang, Hai-Bo; Chen, Jia-Hui; Wang, Jin-Tang","Methyl 3-(dimethylamino)-2-(2-{2-(dimethylamino)-1-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]vinyloxy}phenyl)acrylate","Acta Crystallographica Section E","2005","61","5","o1426","o1428","10.1107/S160053680501189X","","","0.71073","MoKα","","0.1035","0.0596","","","0.1598","0.1929","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205742","12.371","0.002","8.6873","0.0016","9.9175","0.0018","90","","120.599","0.003","90","","917.4","0.3","298","2","298","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Bis(2-methylimidazol-1-yl)methane","","- C9 H12 N4 -","- C9 H12 N4 -","- C36 H48 N16 -","4","0.5","HK6004","Jin, Chuan-Ming; Gong, Chu-Ru","Bis(2-methylimidazol-1-yl)methane","Acta Crystallographica Section E","2005","61","5","o1494","o1495","10.1107/S160053680501247X","","","0.71073","MoKα","","0.0756","0.0681","","","0.1592","0.1686","","","","","","1.083","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205743","11.583","0.001","11.583","0.001","10.747","0.001","90","","90","","90","","1441.9","0.2","289","2","289","2","","","","","","","","5","P 4/n n c :2","-P 4a 2bc","126","","Tetrakis(3,5-lutidine)dichloronickel(II)","","- C28 H36 Cl2 N4 Ni -","- C28 H36 Cl2 N4 Ni -","- C56 H72 Cl4 N8 Ni2 -","2","0.125","IS6061","Xiang-Sheng Xu; Ya-Ping Lü; Dong-Shun Deng; Mao-Lin Hu; Zhi-Min Jin","Tetrakis(3,5-lutidine)dichloronickel(II)","Acta Crystallographica Section E","2005","61","5","m889","m891","10.1107/S1600536805011141","","","0.71073","MoKα","","0.0497","0.0282","","","0.0697","0.075","","","","","","0.909","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205744","8.4152","0.0003","8.7177","0.0003","9.3451","0.0003","67.769","0.002","87.591","0.002","69.878","0.002","592.8","0.04","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H26 Cu2 N2 O6 -","- C24 H26 Cu2 N2 O6 -","- C24 H26 Cu2 N2 O6 -","1","0.5","IS6064","Overgaard, Jacob; Chevallier, Marie-Agnes; Iversen, Bo B.","Bis(μ-diacetylacetonato)bis[pyridinecopper(II)]","Acta Crystallographica Section E","2005","61","5","m922","m924","10.1107/S1600536805011360","","","0.71073","MoKα","","0.0475","0.0312","","","0.0771","0.08","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205745","7.3184","0.0004","9.8767","0.0006","12.5639","0.0007","76.6","0.003","88.384","0.003","79.414","0.003","868.28","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H34 Co2 N4 O16 -","- C34 H34 Co2 N4 O16 -","- C34 H34 Co2 N4 O16 -","1","0.5","IS6065","Dao-Yong Wang; Gang Liu; Bo Zheng; Jun Lu; Huai-Ming Hu","Bis[tetraaqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II)] 1,2,4,5-benzenetetracarboxylate","Acta Crystallographica Section E","2005","61","5","m925","m927","10.1107/S160053680501161X","","","0.71073","MoKα","","0.0442","0.0352","","","0.0831","0.0871","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205746","6.2548","0.0003","16.258","0.0004","11.46","0.0004","90","","91.601","0.001","90","","1164.92","0.07","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Pentaaqua(oxydiacetato-κ^3^O,O',O"")strontium(II) monohydrate","","- C4 H16 O11 Sr -","- C4 H16 O11 Sr -","- C16 H64 O44 Sr4 -","4","1","IS6068","Gaduo; Jian-Rong Su; Duan-Jun Xu","Pentaaqua(oxydiacetato-κ^3^<i>O</i>,<i>O</i>',<i>O</i>'')strontium(II) monohydrate","Acta Crystallographica Section E","2005","61","5","m950","m952","10.1107/S1600536805012201","","","0.71073","MoKα","","0.033","0.028","","","0.078","0.08","","","","","","1.251","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205747","26.552","0.007","7.3127","0.0019","15.933","0.004","90","","119.648","0.003","90","","2688.6","1.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-Methoxy-4-[2-methyl-5-oxo-4,5-dihydro-1,3-oxazol-4-ylidene)methyl]phenyl acetate","","- C14 H13 N O5 -","- C14 H13 N O5 -","- C112 H104 N8 O40 -","8","1","JH6002","Xiangqian Wang; Mingjie Zhang; Zhaobin Qi; Shanshan Ma","2-Methoxy-4-[2-methyl-5-oxo-4,5-dihydro-1,3-oxazol-4-ylidene)methyl]phenyl acetate","Acta Crystallographica Section E","2005","61","5","o1265","o1266","10.1107/S1600536805010196","","","0.71073","MoKα","","0.1126","0.0433","","","0.1124","0.137","","","","","","0.969","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205748","13.616","0.002","5.9421","0.0009","12.7479","0.0019","90","","99.952","0.003","90","","1015.9","0.3","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Amino-5-(2-phenyl-1,2,3-triazol-4-yl)-1,3,4-oxadiazole","","- C10 H8 N6 O -","- C10 H8 N6 O -","- C40 H32 N24 O4 -","4","1","KP6022","Fenhua Wang; Zhanglan Qin; Jiangsheng Huang","2-Amino-5-(2-phenyl-1,2,3-triazol-4-yl)-1,3,4-oxadiazole","Acta Crystallographica Section E","2005","61","5","o1343","o1344","10.1107/S1600536805010901","","","0.71073","MoKα","","0.0787","0.045","","","0.109","0.124","","","","","","0.948","","","","has coordinates,has Fobs","211413","2020-10-21","18:00:00",""
"2205749","9.6168","0.0013","9.7218","0.0013","10.7494","0.0015","64.237","0.002","71.31","0.002","80.941","0.002","857.2","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N-phenyl-benzimidic acid 2-allyl-phenyl ester","","- C22 H19 N O -","- C22 H19 N O -","- C44 H38 N2 O2 -","2","1","KP6049","Guo, Yuping; Zhao, Bing; Li, Chunbao; Gao, Weimin; Li, Jie; Li, Yang","<i>N</i>-Phenylbenzimidic acid 2-allylphenyl ester","Acta Crystallographica Section E","2005","61","5","o1335","o1336","10.1107/S1600536805011104","","","0.71073","MoKα","","0.0571","0.0361","","","0.0922","0.1006","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205750","11.418","0.0007","13.9536","0.0008","3.8525","0.0002","90","","90","","90","","613.79","0.06","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","5-nitro-2-thiophenecarboxaldehyde","5-nitrothiophene-2-carbaldehyde","","- C5 H3 N O3 S -","- C5 H3 N O3 S -","- C20 H12 N4 O12 S4 -","4","1","LH6379","McBurney, Brian; Crundwell, Guy; Updegraff III, James B.; Zeller, Matthias; Hunter, Allen D.","5-Nitrothiophene-2-carbaldehyde","Acta Crystallographica Section E","2005","61","5","o1221","o1222","10.1107/S1600536805009979","","","0.71073","MoKα","","0.0273","0.0273","","","0.0748","0.0748","","","","","","1.179","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205751","7.671","0.002","16.268","0.005","10.884","0.003","90","","110.415","0.005","90","","1272.9","0.6","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H13 N3 O3 -","- C14 H13 N3 O3 -","- C56 H52 N12 O12 -","4","1","LH6389","Yu, Ming; Chen, Xin; Jing, Zuo-Liang","Isonicotinic acid (2-hydroxy-3-methoxybenzylidene)hydrazide","Acta Crystallographica Section E","2005","61","5","o1345","o1346","10.1107/S1600536805011025","","","0.71073","MoKα","","0.0845","0.0511","","","0.1024","0.1156","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205752","6.7867","0.0009","7.0884","0.0009","9.562","0.0013","107.597","0.002","101.854","0.002","97.474","0.002","419.92","0.1","100","2","100","2","","","","","","","","4","P -1","-P 1","2","(2E)-N,N'-bis(pyridin-4-ylmethyl)but-2-enediamide dihydrate","(2E)-N,N'-bis(pyridin-4-ylmethyl)but-2-enediamide dihydrate","","- C16 H20 N4 O4 -","- C16 H20 N4 O4 -","- C16 H20 N4 O4 -","1","0.5","LH6390","Gareth O. Lloyd","(2<i>E</i>)-<i>N,N</i>'-Bis(pyridin-4-ylmethyl)but-2-enediamide dihydrate","Acta Crystallographica Section E","2005","61","5","o1218","o1220","10.1107/S1600536805009980","","","0.71073","MoKα","","0.0423","0.0398","","","0.1087","0.1112","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205753","7.4","0.002","16.462","0.005","10.999","0.003","90","","98.558","0.004","90","","1325","0.6","298","2","298","2","","","","","","","","4","C 1 c 1","C -2yc","9","3-aceto-4-(4-hydroxyphenethylamino)-3-ene-butenone","3-Acetoxy-4-(4-hydroxyphenethylamino)but-3-en-1-one","","- C14 H17 N O3 -","- C14 H17 N O3 -","- C56 H68 N4 O12 -","4","1","LH6395","Zhang, Yong-Bin; Guo, Wei; Hao, Jun-Sheng; Li, Dong-Hong; Huang, Shu-Ping; Xia, Chi-Zhong","3-Acetoxy-4-(4-hydroxyphenethylamino)but-3-en-1-one","Acta Crystallographica Section E","2005","61","5","o1318","o1320","10.1107/S1600536805010706","","","0.71073","MoKα","","0.0508","0.0494","","","0.1115","0.1123","","","","","","1.203","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205754","8.2741","0.0002","13.1807","0.0005","5.7182","0.0003","90","","90","","90","","623.62","0.04","120","2","120","2","","","","","","","","5","P n a 21","P 2c -2n","33","2-Chloronicotinic acid","2-Chloropyridine-3-carboxylic acid","","- C6 H4 Cl N O2 -","- C6 H4 Cl N O2 -","- C24 H16 Cl4 N4 O8 -","4","1","LH6397","Souza, Marcus V. N. de; Wardell, Solange M. S. V.; Howie, R. Alan","2-Chloropyridine-3-carboxylic acid","Acta Crystallographica Section E","2005","61","5","o1347","o1349","10.1107/S160053680501024X","","","0.71073","MoKα","","0.0613","0.0545","","","0.1282","0.1329","","","","","","1.19","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205755","25.705","0.009","7.912","0.004","24.636","0.008","90","","112.742","0.008","90","","4621","3","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","μ^2^-Diphosphorus(P—P)-1:2κ^2^P,P;1:2κ^2^P',P' bis[η^5^-ethoxycarbonylcyclopentadienyl]- bis(carbonyl-1κC)bis(carbonyl-2κC)dimolybdenum(I)(Mo—Mo)]","","- C20 H18 Mo2 O8 P2 -","- C20 H18 Mo2 O8 P2 -","- C160 H144 Mo16 O64 P16 -","8","1","LH6398","Yao-Cheng Shi; Bei-Bei Zhu; Rong Guo","μ~2~-Diphosphorus(P—P)-1:2κ^2^<i>P</i>,<i>P</i>;1:2κ^2^<i>P</i>',<i>P</i>'-bis[η^5^-ethoxycarbonylcyclopentadienyl]-bis(carbonyl-1κ<i>C</i>)bis(carbonyl-2κ<i>C</i>)dimolybdenum(I)(Mo—Mo)]","Acta Crystallographica Section E","2005","61","5","m844","m845","10.1107/S1600536805010573","","","0.71073","MoKα","","0.0612","0.0352","","","0.0846","0.0918","","","","","","1.062","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205756","5.276","0.002","9.307","0.004","24.841","0.007","90","","95.64","0.02","90","","1213.9","0.8","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Oxcarbazepine","10-oxo-10,11-dihydro-5H-dibenzo[b,f]azepine-5-carboxamide","","- C15 H12 N2 O2 -","- C15 H12 N2 O2 -","- C60 H48 N8 O8 -","4","1","LH6401","Hempel, Andrew; Camerman, Norman; Camerman, Arthur; Mastropaolo, Donald","Oxcarbazepine: structure and anticonvulsant activity","Acta Crystallographica Section E","2005","61","5","o1313","o1315","10.1107/S1600536805010676","","","1.54178","CuKα","","0.0466","0.0373","","","0.1167","0.1244","","","","","","0.813","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205757","10.2998","0.0002","18.5245","0.0003","21.966","0.0003","90","","94.118","0.001","90","","4180.26","0.12","220","2","220","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Bis[tris(3,5-dimethylpyrazolyl)methane]nickel(II)][tetrachloronickel(II)] methanol water solvate","","- C33 H50 Cl4 N12 Ni2 O2 -","- C33 H48 Cl4 N12 Ni2 O -","- C132 H192 Cl16 N48 Ni8 O4 -","4","1","LH6402","Annie Michaud; Frédéric-Georges Fontaine; Davit Zargarian","[Bis[tris(3,5-dimethylpyrazolyl)methane]nickel(II)][tetrachloronickelate(II)]‒methanol‒water (1/1/1)","Acta Crystallographica Section E","2005","61","5","m904","m906","10.1107/S1600536805011128","","","1.54178","CuKα","","0.0562","0.0509","","","0.1523","0.1561","","","","","","1.131","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205758","8.394","0.003","5.158","0.002","26.972","0.006","90","","101.47","0.02","90","","1144.5","0.7","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","felbamate","2-Phenyl-1,3-propanediol dicarbamate","","- C11 H14 N2 O4 -","- C11 H14 N2 O4 -","- C44 H56 N8 O16 -","4","1","LH6403","Hempel, Andrew; Camerman, Norman; Mastropaolo, Donald; Camerman, Arthur","Felbamate: a carbamate-type anticonvulsant","Acta Crystallographica Section E","2005","61","5","o1381","o1383","10.1107/S1600536805011347","","","1.54178","CuKα","","0.046","0.0335","","","0.0887","0.0932","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205759","9.984","0.002","12.04","0.003","14.36","0.004","96.74","0.02","95.82","0.02","126.51","0.03","1345.8","0.8","294","2","294","2","","","","","","","","4","P -1","-P 1","2","methylfelbamate","2-Methyl-2-phenyl-1,3-propanediol dicarbamate","","- C12 H16 N2 O4 -","- C12 H16 N2 O4 -","- C48 H64 N8 O16 -","4","2","LH6404","Hempel, Andrew; Camerman, Norman; Mastropaolo, Donald; Camerman, Arthur","Methylfelbamate","Acta Crystallographica Section E","2005","61","5","o1384","o1386","10.1107/S1600536805011335","","","1.54178","CuKα","","0.0659","0.0448","","","0.1047","0.111","","","","","","1.025","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205760","18.2966","0.0005","5.06225","0.0001","15.7245","0.0004","90","","104.557","0.0015","90","","1409.68","0.06","295","","295","","","","","","","","","2","P 1 21 1","P 2yb","4","Dibenz[a,c]anthracene","1,2:5,6-Dibenzanthracene","","- C22 H14 -","- C22 H14 -","- C88 H56 -","4","2","LH6405","Fernandes, Philippe; Florence, Alastair; Shankland, Kenneth; David, Bill","Powder diffraction study of 1,2:3,4-dibenzanthracene","Acta Crystallographica Section E","2005","61","5","o1483","o1485","10.1107/S1600536805012171","","","1.54056","CuKα1","","","","","","","","","","1.64","","","","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205761","11.597","0.003","14.213","0.003","7.827","0.002","90","","90.15","0.02","90","","1290.1","0.5","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Nafimidone monohydrate","2-(1H-imidazol-1-yl)-1-(2-naphthyl)ethanone monohydrate","","- C15 H14 N2 O2 -","- C15 H14 N2 O2 -","- C60 H56 N8 O8 -","4","1","LH6406","Hempel, Andrew; Camerman, Norman; Camerman, Arthur; Mastropaolo, Donald","Nafimidone monohydrate: an imidazole anticonvulsant","Acta Crystallographica Section E","2005","61","5","o1387","o1389","10.1107/S1600536805011487","","","1.54178","CuKα","","0.1044","0.055","","","0.1517","0.1743","","","","","","0.917","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205762","15.315","0.007","5.573","0.003","17.487","0.008","90","","99.863","0.009","90","","1470.5","1.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Diphenylguanidinium-monohydrogen-oxalate (1/1)","","- C15 H15 N3 O4 -","- C15 H15 N3 O4 -","- C60 H60 N12 O16 -","4","1","LH6408","Mao-Lin Hu; Wei-Dong Wang","Diphenylguanidinium hydrogen oxalate","Acta Crystallographica Section E","2005","61","5","o1408","o1410","10.1107/S1600536805011591","","","0.71073","MoKα","","0.105","0.0877","","","0.1837","0.1988","","","","","","1.323","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205763","14.379","0.002","13.234","0.002","19.705","0.003","90","","104","0.03","90","","3638.3","1","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[aqua(2,2'-bipyridine-κ^2^N,N')manganese(II)]-μ- 4-carboxylatophenoxyacetato-κ^3^O,O':O'']","","- C19 H16 Mn N2 O6 -","- C19 H16 Mn N2 O6 -","- C152 H128 Mn8 N16 O48 -","8","1","LH6411","Gao, Shan; Huo, Li-Hua; Liu, Ji-Wei; Zhao, Hui","<i>catena</i>-Poly[[aqua(2,2'-bipyridine-κ^2^<i>N,N</i>')manganese(II)]-μ-4-carboxylatophenoxyacetato-κ^3^<i>O,O</i>':<i>O</i>'']","Acta Crystallographica Section E","2005","61","5","m989","m991","10.1107/S1600536805012584","","","0.71073","MoKα","","0.1334","0.0659","","","0.1303","0.146","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205764","11.6604","0.0015","8.0103","0.0011","8.9702","0.0016","90","","90","","90","","837.8","0.2","278","2","293","2","","","","","","","","4","P m m n :2","-P 2ab 2a","59","neodymium triiodide nonahydrate","neodymium triiodide nonahydrate","","- H18 I3 Nd O9 -","- I3 Nd O9 -","- I6 Nd2 O18 -","2","0.25","MG6032","Timofte, Tudor; Babai, Arash; Meyer, Gerd; Mudring, Anja","Neodymium triiodide nonahydrate","Acta Crystallographica Section E","2005","61","5","i87","i88","10.1107/S160053680501216X","","","0.71073","MoKα","","0.0652","0.0476","","","0.1312","0.1433","","","","","","1.021","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205765","12.791","0.002","6.4448","0.0016","12.068","0.003","90","","104.741","0.016","90","","962.1","0.4","298","","298","","","","","","","","","4","P 1 21 1","P 2yb","4","","(R)-1-Phenyl-1-ethylammonium (R)-2-hydroxymethyl-2-(2-naphthyl)propanoate","","- C22 H25 N O3 -","- C22 H25 N O3 -","- C44 H50 N2 O6 -","2","1","NC6025","Ohba, Shigeru; Tsutsumi, Tomomi; Terao, Yosuke; Miyamoto, Kenji; Ohta, Hiromichi","(<i>R</i>)-1-Phenyl-1-ethylammonium (<i>R</i>)-2-hydroxymethyl-2-(2-naphthyl)propanoate","Acta Crystallographica Section E","2005","61","5","o1283","o1285","10.1107/S1600536805010305","","","0.71073","MoKα","","","0.0484","","","","0.1022","","","","","","0.973","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205766","15.142","0.001","11.6395","0.0008","11.2429","0.0014","90","","111.363","0.007","90","","1845.4","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,3-di(2-furyl)-2-propen-1-one","","- C11 H8 O3 -","- C11 H8 O3 -","- C88 H64 O24 -","8","2","NC6027","Ocak Ískeleli, Nazan; Işık, Şamil; Özdemir, Zuhal; Bilgin, Altan","(<i>E</i>)-1,3-Di(2-furyl)-2-propen-1-one","Acta Crystallographica Section E","2005","61","5","o1356","o1358","10.1107/S1600536805011244","","","0.71073","MoKα","","0.0486","0.0377","","","0.0899","0.0947","","","","","","1.029","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205767","10.4667","0.0017","6.2976","0.0007","14.072","0.002","90","","103.738","0.019","90","","901","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","Hepta-ammonium bis(hydrogenphosphate) phosphate","heptaammonium bis(hydrogenphosphate) phosphate","","- H30 N7 O12 P3 -","- H30 N7 O12 P3 -","- H60 N14 O24 P6 -","2","1","NC6029","Nolte, Matthias; Pantenburg, Ingo; Meyer, Gerd","(NH~4~)~7~(HPO~4~)~2~(PO~4~), heptaammonium bis(hydrogenphosphate) phosphate","Acta Crystallographica Section E","2005","61","5","i84","i86","10.1107/S1600536805012018","","","0.71073","MoKα","","0.0392","0.0306","","","0.0713","0.0839","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205768","15.59","0.003","7.528","0.0015","15.755","0.003","90","","107.85","0.03","90","","1760","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-ferrocenyl-3-(2-hydroxymethylphenyl)aminobut-2-en-1-one","","- C21 H21 Fe N O2 -","- C21 H21 Fe N O2 -","- C84 H84 Fe4 N4 O8 -","4","1","NG6111","Yao-Cheng Shi","Hydrogen-bonded <i>R</i>~2~^2^(16) dimers in 1-ferrocenyl-3-(2-hydroxymethylphenyl)aminobut-2-en-1-one","Acta Crystallographica Section E","2005","61","5","m811","m812","10.1107/S1600536805009104","","","0.71073","MoKα","","0.1049","0.0564","","","0.1424","0.1766","","","","","","0.962","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205769","19.385","0.005","7.5134","0.0019","14.859","0.004","90","","126.487","0.003","90","","1740","0.8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Diiodidobis(4-methylpyridine N-oxide-?O)zinc(II)","","- C12 H14 I2 N2 O2 Zn -","- C12 H14 I2 N2 O2 Zn -","- C48 H56 I8 N8 O8 Zn4 -","4","0.5","NG6123","Shi, Jing-Min; Liu, Zhe; Lu, Jian-Jun; Liu, Lian-Dong","Diiodidobis(4-methylpyridine <i>N</i>-oxide-κO)zinc(II)","Acta Crystallographica Section E","2005","61","5","m856","m857","10.1107/S160053680501072X","","","0.71073","MoKα","","0.036","0.0301","","","0.0722","0.0747","","","","","","1.036","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205770","8.1038","0.0007","21.675","0.001","12.6164","0.0009","90","","94.126","0.006","90","","2210.3","0.3","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(1-Benzylimidazole)(chloro)bis(dimethylglyoximato)cobalt(III)","","- C18 H24 Cl Co N6 O4 -","- C18 H24 Cl Co N6 O4 -","- C72 H96 Cl4 Co4 N24 O16 -","4","1","NG6128","Shen, Xu-Jie; Pan, Qin-He; Xiao, Li-Ping; Xu, Ru-Ren","(1-Benzyl-1<i>H</i>-imidazole)chlorobis(dimethylglyoximato)cobalt(III)","Acta Crystallographica Section E","2005","61","5","m936","m938","10.1107/S1600536805011359","","","0.71073","MoKα","","0.082","0.0454","","","0.0997","0.1121","","","","","","0.92","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205771","14.748","0.005","14.748","","6.465","0.008","90","","90","","90","","1406.2","1.8","293","2","293","2","","","","","","","","4","I -4","I -4","82","","Tetrakis[4-(trifluoromethyl)phenyl]stannane","","- C28 H16 F12 Sn -","- C28 H16 F12 Sn -","- C56 H32 F24 Sn2 -","2","0.25","NG6134","Young, David J.; Manuaba, Putra; Healy, Peter C.; Tiekink, Edward R. T.","Tetrakis[4-(trifluoromethyl)phenyl]stannane","Acta Crystallographica Section E","2005","61","5","m956","m957","10.1107/S1600536805012213","","","0.71069","MoKα","","0.099","0.051","","","0.134","0.157","","","","","","0.98","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205772","7.2955","0.0005","8.3616","0.0006","11.93","0.0008","89.059","0.001","88.827","0.001","70.549","0.001","686.04","0.08","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Diaquadibenzimidazolebis(5-fluoro-2,4-dioxo-1,2,3,4-tetrahydropyrimidine- 1-acetato)nickel(II)","","- C26 H24 F2 N8 Ni O10 -","- C26 H24 F2 N8 Ni O10 -","- C26 H24 F2 N8 Ni O10 -","1","0.5","NG6139","Mao-Lin Hu; Wei-Dong Wang","Diaquadibenzimidazolebis(5-fluoro-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-1-acetato)nickel(II)","Acta Crystallographica Section E","2005","61","5","m975","m977","10.1107/S1600536805012432","","","0.71073","MoKα","","0.0308","0.0291","","","0.073","0.0741","","","","","","1.064","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205773","10.712","0.009","15.593","0.013","9.556","0.008","90","","90","","90","","1596","2","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","Potassium tris(2-aminoethanesulfonato-κ^2^<i>N</i>,<i>O</i>)nickelate(II)","","- C6 H18 K N3 Ni O9 S3 -","- C6 H18 K N3 Ni O9 S3 -","- C24 H72 K4 N12 Ni4 O36 S12 -","4","1","OB6493","Yi-Min Jiang; Jin-Hua Cai; Zhi-Min Liu","Potassium tris(2-aminoethanesulfonato-κ^2^<i>N</i>,<i>O</i>)nickelate(II)","Acta Crystallographica Section E","2005","61","5","m878","m880","10.1107/S1600536805010846","","","0.71073","MoKα","","0.046","0.041","","","0.082","0.085","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205774","17.822","0.004","9.536","0.002","21.256","0.005","90","","97.445","0.017","90","","3582","1.4","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","trans-Dibromotetra(3-tert-butylpyrazole-κN)nickel(II)","","- C28 H48 Br2 N8 Ni -","- C28 H48 Br2 N8 Ni -","- C112 H192 Br8 N32 Ni4 -","4","1","OB6496","Annie Michaud; Frédéric-Georges Fontaine; Davit Zargarian","<i>trans</i>-Dibromotetra(3-<i>tert</i>-butylpyrazole-κ<i>N</i>)nickel(II)","Acta Crystallographica Section E","2005","61","5","m846","m848","10.1107/S1600536805010597","","","1.54178","CuKα","","0.0465","0.045","","","0.124","0.1254","","","","","","1.061","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205775","11.8053","0.001","15.6404","0.0015","22.432","0.002","90","","90","","90","","4141.8","0.6","193","2","193","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","10-Amino-3,3,6,6-tetramethyl-9-(4-bromophenyl)-3,4,5,6,9,10-hexahydroacridine- 1,8(2H,7H)-dione","","- C23 H27 Br N2 O2 -","- C23 H27 Br N2 O2 -","- C184 H216 Br8 N16 O16 -","8","1","OB6497","Shu-Jiang Tu; Jin-Peng Zhang; Xiao-Tong Zhu; Jia-Ning Xu; Qian Wang","10-Amino-9-(4-bromophenyl)-3,3,6,6-tetramethyl-3,4,5,6,9,10-hexahydroacridine-1,8(2<i>H</i>,7<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","5","o1491","o1493","10.1107/S160053680501202X","","","0.7107","MoKα","","0.0473","0.0423","","","0.0993","0.1018","","","","","","1.163","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205776","6.1829","0.0008","7.0696","0.0008","7.3023","0.0006","70.443","0.008","80.153","0.008","63.973","0.01","270.16","0.06","295","2","295","2","","","","","","","","3","P -1","-P 1","2","triquinoyl octahydrate","Dodecahydroxycyclohexane dihydrate","","- C6 H16 O14 -","- C6 H16 O14 -","- C6 H16 O14 -","1","0.5","OB6498","Klapötke, Thomas M.; Polborn, Kurt; Weigand, Jan J.","Dodecahydroxycyclohexane dihydrate","Acta Crystallographica Section E","2005","61","5","o1393","o1395","10.1107/S1600536805010007","","","0.71073","MoKα","","0.0348","0.0328","","","0.0886","0.0908","","","","","","1.098","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205777","7.5031","0.0013","19.61","0.003","18.401","0.004","90","","99.894","0.007","90","","2667.2","0.8","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,3,5-Trichloro-4-methoxy-6-[2,3,5-trichloro-4-methoxy-6- (2,3,5,6-tetrachloro-4-methoxyphenoxy)phenoxy]phenol","","- C21 H10 Cl10 O6 -","- C21 H10 Cl10 O6 -","- C84 H40 Cl40 O24 -","4","1","OB6499","Hashizume, Daisuke; Koshino, Hiroyuki; Lee, In-Kyoung; Yoo, Ick-Dong","2,3,5-Trichloro-4-methoxy-6-[2,3,5-trichloro-4-methoxy-6-(2,3,5,6-tetrachloro-4-methoxyphenoxy)phenoxy]phenol","Acta Crystallographica Section E","2005","61","5","o1367","o1369","10.1107/S1600536805011220","","","0.71073","MoKα","","0.046","0.0339","","","0.0741","0.0781","","","","","","1.067","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205778","17.518","0.003","16.667","0.003","18.414","0.003","90","","113.25","0.01","90","","4939.8","1.5","93.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C94 H132 N2 O18 Zn3 -","- C94 H132 N2 O18 Zn3 -","- C188 H264 N4 O36 Zn6 -","2","0.5","OB6501","Mizuguchi, Jin; Makino, Takashi","Diacetonitrileheptakis[μ-3,5-bis(1,1-dimethylethyl)-2-hydroxybenzoato-κ^2^<i>O</i>,<i>O</i>']trizinc(II)","Acta Crystallographica Section E","2005","61","5","m953","m955","10.1107/S1600536805011980","","","1.5418","CuKα","","","0.0644","","","","0.1644","","","","","","1.032","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205779","8.171","0.002","8.774","0.002","16.385","0.004","93.826","0.006","94.393","0.006","98.725","0.006","1154","0.5","203.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C21 H15 Cl In N O6 W2 -","- C21 H15 Cl In N O6 W2 -","- C42 H30 Cl2 In2 N2 O12 W4 -","2","1","OB6502","Nakazawa, Hiroshi; Itazaki, Masumi; Owaribe, Mari","Chloropyridinebis[tricarbonyl(η^5^-cyclopentadienyl)tungstenio]indium","Acta Crystallographica Section E","2005","61","5","m945","m946","10.1107/S1600536805011992","","","0.7107","MoKα","","","0.0516","","","","0.0941","","","","","","1.052","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205780","8.511","0.0004","13.526","0.001","8.6612","0.0005","90","","114.119","0.005","90","","910.03","0.1","297.2","","24","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","4-chloro-3-nitrocoumarin","4-chloro-3-nitro-2H- chromen-2-one","","- C9 H4 Cl N O4 -","- C9 H4 Cl N O4 -","- C36 H16 Cl4 N4 O16 -","4","1","OB6503","Fujii, Isao; Mano, Yoshihiro; Hirayama, Noriaki","4-Chloro-3-nitrocoumarin: an unusual non-bonding C—Cl···O=C interaction","Acta Crystallographica Section E","2005","61","5","o1456","o1458","10.1107/S1600536805011943","","","1.5418","CuKα","","","0.0471","","","","0.1984","","","","","","1.206","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205781","8.2117","0.0006","8.2117","0.0006","27.44","0.003","90","","90","","90","","1850.3","0.3","293","2","293","2","","","","","","","","6","P 43","P 4cw","78","","1,3,3,5-tetramethyl-6'-chloro-8'-bromoSpiro[(2'H,1'- benzopyran)-2,2'-indolines]","","- C20 H19 Br Cl N O -","- C20 H19 Br Cl N O -","- C80 H76 Br4 Cl4 N4 O4 -","4","1","OB6504","Hui Guo; Yong-Bin Gao; Jie Han; Ji-Ben Meng","8-Bromo-6-chloro-1',3',3',5'-tetramethylspiro[2<i>H</i>-1-benzopyran-2,2'-indoline]","Acta Crystallographica Section E","2005","61","5","o1461","o1462","10.1107/S1600536805011864","","","0.71073","MoKα","","0.0413","0.029","","","0.0654","0.069","","","","","","1.017","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205782","25.216","0.003","9.9757","0.0009","25.566","0.003","90","","108.566","0.003","90","","6096.4","1.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","diethyl cis-1,2,3,4,5,10-hexahydro-7,8-dimethyl-1,4-dioxo-2,3,4a,10a- tetraazabenzo[g]cyclopent[cd]azulene-2a,10b-dicarboxylate chloroform disolvate","","- C22 H26 Cl6 N4 O6 -","- C22 H26 Cl6 N4 O6 -","- C176 H208 Cl48 N32 O48 -","8","1","OB6507","Wei, Fa-Qian; Wu, An-Xin","Diethyl <i>cis</i>-1,2,3,4,5,10-hexahydro-7,8-dimethyl-1,4-dioxo-2,3,4a,10a-tetraazabenzo[<i>g</i>]cyclopent[<i>cd</i>]azulene-2a,10b-dicarboxylate chloroform disolvate","Acta Crystallographica Section E","2005","61","5","o1453","o1455","10.1107/S1600536805012183","","","0.71073","MoKα","","0.0947","0.0582","","","0.1126","0.1192","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205783","12.5448","0.0008","13.0525","0.0008","13.3493","0.0009","90","","102.731","0.001","90","","2132.1","0.2","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aquabis[2-(2-pyridyl)-1H-benzimidazolato]zinc(II)","","- C24 H18 N6 O Zn -","- C24 H18 N6 O Zn -","- C96 H72 N24 O4 Zn4 -","4","1","OB6509","Yang, Jian-Kui; Zeng, Ming-Hua; Ng, Seik Weng","Aquabis[2-(2-pyridyl)-1<i>H</i>-benzimidazolato]zinc(II)","Acta Crystallographica Section E","2005","61","5","m992","m993","10.1107/S1600536805012614","","","0.71073","MoKα","","0.064","0.048","","","0.121","0.131","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205784","6.625","0.001","8.525","0.001","9.821","0.002","92.62","0.01","103.42","0.01","96.89","0.01","534.07","0.15","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Disodium 3-oxobutane-2,2-diylbis(diazeniumdiolate) dihydrate","","- C4 H10 N4 Na2 O7 -","- C4 H10 N4 Na2 O7 -","- C8 H20 N8 Na4 O14 -","2","1","OM6232","Arulsamy, Navamoney; Bohle, D. Scott","Disodium 3-oxobutane-2,2-diylbis(diazeniumdiolate) dihydrate","Acta Crystallographica Section E","2005","61","5","m838","m840","10.1107/S1600536805009803","","","0.71073","MoKα","","0.0455","0.0434","","","0.1146","0.1169","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205785","13.682","0.0002","9.732","0.0001","17.1014","0.0002","90","","104.964","0.001","90","","2199.89","0.05","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Fe(TTP)(THF)~2~]","Difuran(5,10,15,20-tetra-p-tolylporphyrinato)iron(II)","","- C56 H52 Fe N4 O2 -","- C56 H52 Fe N4 O2 -","- C112 H104 Fe2 N8 O4 -","2","0.5","OM6233","Hu, Chuan-Jiang; Noll, Bruce C.; Scheidt, W. Robert.","High-spin [Fe(TTP)(THF)~2~]","Acta Crystallographica Section E","2005","61","5","m830","m831","10.1107/S1600536805009633","","","0.71073","MoKα","","0.046","0.0375","","","0.0947","0.102","","","","","","1.038","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205786","14.433","0.002","7.6395","0.0008","18.089","0.002","90","","111.527","0.002","90","","1855.4","0.4","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-Poly[[cis-diaqua(2,2'-bipyridine)zinc(II)]-μ-5-sulfonatosalicylato]","","- C17 H16 N2 O8 S Zn -","- C17 H16 N2 O8 S Zn -","- C68 H64 N8 O32 S4 Zn4 -","4","1","OM6234","Fan, Sai-Rong; Zhu, Long-Guan; Xiao, Hong-Ping","<i>catena</i>-Poly[[<i>cis</i>-diaqua(2,2'-bipyridine)zinc(II)]-μ-5-sulfonatosalicylato]","Acta Crystallographica Section E","2005","61","5","m804","m806","10.1107/S1600536805009645","","","0.71073","MoKα","","0.0319","0.0301","","","0.0815","0.0829","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205787","19.2667","0.0017","11.1275","0.001","6.6484","0.0006","90","","90","","90","","1425.4","0.2","298","2","298","2","","","","","","","","6","P n a 21","P 2c -2n","33","","(μ-Formato-κ^2^O:O')aquachloro(1,10-phenanthroline-κ^2^N,N')manganese(II) monohydrate","","- C13 H13 Cl Mn N2 O4 -","- C13 H13 Cl Mn N2 O4 -","- C52 H52 Cl4 Mn4 N8 O16 -","4","1","OM6236","Jing Xiong; Wei-Dong Wang; Hong-Ping Xiao; Mao-Lin Hu","(μ-Formato-κ^2^<i>O</i>:<i>O</i>')aquachloro(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II) monohydrate","Acta Crystallographica Section E","2005","61","5","m901","m903","10.1107/S1600536805011311","","","0.71073","MoKα","","0.0501","0.0457","","","0.0894","0.0913","","","","","","1.104","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205788","16.0767","0.0012","11.2793","0.001","8.9528","0.0005","90","","90","","90","","1623.4","0.2","150","2","150","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","N,N-Bis-(3-methylphenyl)-N-(4-methylphenyl)amine","","- C21 H21 N -","- C21 H21 N -","- C84 H84 N4 -","4","0.5","RN6045","Manifar, Touraj; Rohani, Sohrab; Jennings, Michael, C.","<i>N</i>,<i>N</i>-Bis-(3-methylphenyl)-<i>N</i>-(4-methylphenyl)amine","Acta Crystallographica Section E","2005","61","5","o1297","o1299","10.1107/S1600536805010457","","","0.71073","MoKα","","0.101","0.0583","","","0.1468","0.1696","","","","","","1.058","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205789","7.642","0.005","10.1","0.007","15.25","0.01","90","","101.275","0.008","90","","1154.3","1.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-Amino-1-(1,5-dimethyl-1H-pyrazol-4-ylcarbonyl)-3-methylsulfanyl- 1H-1,2,4-triazole","","- C9 H12 N6 O S -","- C9 H12 N6 O S -","- C36 H48 N24 O4 S4 -","4","1","RZ6057","Li-Rong Wen; Ming Li; Zi-Qin Ke; Xiao Wang","5-Amino-1-(1,5-dimethyl-1<i>H</i>-pyrazol-4-ylcarbonyl)-3-methylsulfanyl-1<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2005","61","5","o1231","o1232","10.1107/S1600536805010019","","","0.71073","MoKα","","0.048","0.0427","","","0.1331","0.1383","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205790","5.7572","0.0014","11.545","0.003","14.778","0.004","78.575","0.004","81.022","0.003","81.362","0.004","943.7","0.4","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","2-(1H-Benzo-1,2,3-triazol-1-yl)-4,4-dimethyl-3-oxo-N-phenylpentanethioamide monohydrate","","- C19 H22 N4 O2 S -","- C19 H22 N4 O2 S -","- C38 H44 N8 O4 S2 -","2","1","RZ6062","Liangzhong Xu; Shuanghua Yang; Yongqi Qin; Yaxun Yang; Yongwei Huang","2-(1<i>H</i>-Benzo-1,2,3-triazol-1-yl)-4,4-dimethyl-3-oxo-<i>N</i>-phenylpentanethioamide monohydrate","Acta Crystallographica Section E","2005","61","5","o1267","o1268","10.1107/S1600536805010238","","","0.71073","MoKα","","0.107","0.0617","","","0.1417","0.1513","","","","","","0.797","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205791","4.9278","0.0006","12.6217","0.0014","19.601","0.002","90","","90","","90","","1219.1","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Ethyl 3-oxo-1,2-benzoisothiazoline-2-acetate 1,1-dioxide","","- C11 H11 N O5 S -","- C11 H11 N O5 S -","- C44 H44 N4 O20 S4 -","4","1","RZ6064","Xu, Liang-Zhong; Si, Guo-Dong; Li, Zai-Feng; Yang, Shuang-Hua; Li, Kai","Ethyl 3-oxo-1,2-benzisothiazoline-2-acetate 1,1-dioxide","Acta Crystallographica Section E","2005","61","5","o1329","o1330","10.1107/S1600536805010949","","","0.71073","MoKα","","0.0354","0.0291","","","0.0732","0.0754","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205792","8.363","0.007","6.898","0.006","11.524","0.01","90","","96.879","0.012","90","","660","1","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","4-Phenyl-5-(1',5'-dimethyl-4'-pyrazolyl)-1,2,4-triazol-3-thione","","- C13 H13 N5 S -","- C13 H13 N5 S -","- C26 H26 N10 S2 -","2","0.5","RZ6065","Wen, Li-Rong; Ke, Zi-Qin; Li, Ming; Guo, Wei-Si","3-(1,5-Dimethylpyrazol-4-yl)-4-phenyl-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","5","o1436","o1438","10.1107/S1600536805011748","","","0.71073","MoKα","","0.0509","0.0368","","","0.0922","0.1002","","","","","","1.066","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205793","9.109","0.001","9.2626","0.001","9.7553","0.0011","103.411","0.002","102.791","0.002","107.081","0.002","727.28","0.14","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","4-(4-nitrophenyl)-2,3,3a,4,5,9b-hexahydro furo[3,2-c]quinoline","","- C17 H16 N2 O3 -","- C17 H16 N2 O3 -","- C34 H32 N4 O6 -","2","1","RZ6066","K. Ravikumar; B. Sridhar; M. Mahesh; V. V. Narayana Reddy","4-(4-Nitrophenyl)-2,3,3a,4,5,9b-hexahydrofuro[3,2-<i>c</i>]quinoline","Acta Crystallographica Section E","2005","61","5","o1419","o1421","10.1107/S160053680501175X","","","0.71073","MoKα","","0.0687","0.056","","","0.1514","0.1633","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205794","16.859","0.009","5.667","0.003","12.58","0.007","90","","90.685","0.009","90","","1201.8","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Z)-2-(2-(propan-2-ylidene)hydrazono)-3-phenylthiazolidin-4-one","","- C12 H13 N3 O S -","- C12 H13 N3 O S -","- C48 H52 N12 O4 S4 -","4","1","RZ6067","Xu, Liang-Zhong; Li, Kai; Song, Hai-Bin; Huang, Yong-Wei; Zhou, Kai","(<i>Z</i>)-3-Phenyl-2-(propan-2-ylidenehydrazono)thiazolidin-4-one","Acta Crystallographica Section E","2005","61","5","o1417","o1418","10.1107/S1600536805011815","","","0.71073","MoKα","","0.1152","0.0511","","","0.1131","0.1323","","","","","","0.891","","","","has coordinates,has disorder,has Fobs","201973","2020-10-21","18:00:00",""
"2205795","5.1151","0.0009","9.579","0.0018","18.426","0.003","87.292","0.003","83.782","0.003","87.021","0.004","895.5","0.3","292","1","292","1","","","","","","","","6","P -1","-P 1","2","","N-[5-(1E)-Styryl-1,3,4-thiadiazol-2-yl]-4-Bromophenoxy-acetamide","","- C18 H14 Br N3 O2 S -","- C18 H14 Br N3 O2 S -","- C36 H28 Br2 N6 O4 S2 -","2","1","RZ6068","Song, Xinjian; Tan, Xiaohong; Meng, Xianggao; Wang, Yangang","2-(4-Bromophenoxy)-<i>N</i>-[5-(<i>E</i>)-styryl-1,3,4-thiadiazol-2-yl]acetamide","Acta Crystallographica Section E","2005","61","5","o1422","o1423","10.1107/S1600536805011803","","","0.71073","MoKα","","0.1493","0.0678","","","0.1318","0.1849","","","","","","0.972","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205796","12.01","0.002","10.401","0.001","16.988","0.002","90","","108.178","0.002","90","","2016.2","0.5","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-(But-3-enyl)pyridinium-2-carboxylate‒5-butylpyridine-2-carboxylic acid (1/1)","","- C20 H24 N2 O4 -","- C19.999 H24 N2 O4 -","- C79.996 H96 N8 O16 -","4","1","RZ6069","Wang, Jun; Li, Guang-Wei; Lin, Yong-Cheng; Zhou, Shi-Ning; Ng, Seik Weng","5-(But-3-enyl)pyridinium-2-carboxylate‒5-butylpyridine-2-carboxylic acid (1/1), a co-crystal from <i>Fusarium moniliforme</i>","Acta Crystallographica Section E","2005","61","5","o1515","o1516","10.1107/S1600536805012675","","","0.71073","MoKα","","0.118","0.063","","","0.181","0.229","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205797","8.5277","0.0008","14.2285","0.0013","11.5972","0.0011","90","","93.59","0.002","90","","1404.4","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(o-Methoxyphenyl)-1,3,4,4a,5,6,7,8a-octahydro-2H-pyrano[2,3-d]pyrimidin- 2-thione","","- C14 H18 N2 O2 S -","- C14 H18 N2 O2 S -","- C56 H72 N8 O8 S4 -","4","1","SG6001","Lei Yan; Yu-Lin Zhu; Yuan-Jiang Pan","4-(<i>o</i>-Methoxyphenyl)-1,3,4,4a,5,6,7,8a-octahydro-2<i>H</i>-pyrano[2,3-<i>d</i>]pyrimidine-2-thione","Acta Crystallographica Section E","2005","61","5","o1228","o1230","10.1107/S1600536805010068","","","0.71073","MoKα","","0.0378","0.0303","","","0.0901","0.0931","","","","","","1.123","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205798","12.6304","0.0013","50.875","0.007","11.017","0.003","90","","112.5","0.01","90","","6540","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-[4-methylpiperdinemethyl]-2-[4-bromophenyl]- 6-methyl-8-trifluromethylimidazo[1,2-a][1,8]naphthyridinium picrate","","- C31 H27 Br F3 N7 O7 -","- C31 H27 Br F3 N7 O7 -","- C248 H216 Br8 F24 N56 O56 -","8","2","SG6002","Chellamuthu Muthamizhchelvan; Kolandaivelu Saminathan; Krishnan SethuSankar; Jan Fraanje; Rene Peschar; Kandasamy Sivakumar","1-(4-Methylpiperdinemethyl)-2-(4-bromophenyl)-6-methyl-8-trifluoromethylimidazo[1,2-<i>a</i>][1,8]naphthyridinium picrate","Acta Crystallographica Section E","2005","61","5","o1377","o1380","10.1107/S160053680501144X","","","1.54178","CuKα","","0.1594","0.0811","","","0.1918","0.2568","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205799","7.7118","0.0004","9.1503","0.0004","11.6969","0.0006","100.192","0.003","95.379","0.002","101.908","0.003","787.58","0.07","123","2","123","2","","","","","","","","4","P -1","-P 1","2","carbamazepine N,N-dimethylformamide solvate","carbamazepine N,N-dimethylformamide solvate","","- C18 H19 N3 O2 -","- C18 H19 N3 O2 -","- C36 H38 N6 O4 -","2","1","SG6004","Johnston, Andrea; Florence, Alastair J.; Kennedy, Alan R.","Carbamazepine <i>N,N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2005","61","5","o1509","o1511","10.1107/S1600536805012535","","","0.71073","MoKα","","0.0781","0.0477","","","0.1029","0.1167","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205800","11.887","0.002","11.775","0.002","19.293","0.003","90","","92.171","0.002","90","","2698.5","0.8","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H52 Cl4 N4 O10 Sn2 -","- C52 H52 Cl4 N4 O10 Sn2 -","- C104 H104 Cl8 N8 O20 Sn4 -","2","0.5","SG6005","Min Hong; Handong Yin; Daqi Wang; Gang Li","Bis(3-chlorobenzyl)tin(IV) ester of pyruvic acid 4-hydroxybenzoylhydrazone","Acta Crystallographica Section E","2005","61","5","m1006","m1008","10.1107/S1600536805012663","","","0.71073","MoKα","","0.043","0.0295","","","0.0718","0.0825","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205801","6.692","0.0013","7.647","0.0015","12.997","0.003","83.72","0.03","77.11","0.03","80.69","0.03","637.9","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Bis(3-nitrobenzoato)bis(3-pyridylmethanol-N,O)copper(II) complex","","- C26 H22 Cu N4 O10 -","- C26 H22 Cu N4 O10 -","- C26 H22 Cu N4 O10 -","1","0.5","SJ6056","Petra Stachová; Dušan Valigura; Marian Koman; Glowiak Tadeus","<i>catena</i>-Poly[[bis(2-nitrobenzoato-κ<i>O</i>)copper(II)]di-μ-3-pyridylmethanol-κ^2^<i>N</i>,<i>O</i>;κ^2^<i>O</i>:<i>N</i>]","Acta Crystallographica Section E","2005","61","5","m994","m996","10.1107/S1600536805011608","","","0.71073","MoKα","","0.0259","0.0247","","0.0656","","0.0649","","","1.086","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205802","7.726","0.0003","11.7276","0.0005","14.6536","0.0008","90","","90","","90","","1327.73","0.11","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-(5-Indanyloxy)phthalonitrile","","- C17 H12 N2 O -","- C17 H12 N2 O -","- C68 H48 N8 O4 -","4","1","SJ6060","Yazıcı, Serap; Akdemir, Nesuhi; Aǧar, Erbil; Özil, Musa; Şenel, İsmet","4-(5-Indanyloxy)phthalonitrile","Acta Crystallographica Section E","2005","61","5","o1304","o1305","10.1107/S1600536805010330","","","0.71073","MoKα","","0.0385","0.0345","","","0.0861","0.0878","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205803","8.37","0.002","11.847","0.003","14.825","0.004","90","","93.096","0.005","90","","1467.9","0.6","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Oxocrebanine","8H-Benzo[g][1,3]benzodioxolo[6,5,4-de]quinolin-8-one","","- C19 H13 N O5 -","- C19 H13 N O5 -","- C76 H52 N4 O20 -","4","1","SJ6062","Din, Laily Bin; Abdullah, Aryanti; Yamin, Bohari M.","8<i>H</i>-Benzo[<i>g</i>][1,3]benzodioxolo[6,5,4-<i>de</i>]quinolin-8-one (oxocrebanine)","Acta Crystallographica Section E","2005","61","5","o1450","o1452","10.1107/S1600536805012195","","","0.71073","MoKα","","0.0691","0.0507","","","0.1321","0.1436","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205804","11.6831","0.0013","11.8477","0.0013","12.9212","0.0014","111.911","0.002","111.296","0.002","92.437","0.002","1512.9","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","(E)-1-(2-hydroxy-3,4-dimethoxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one","","- C17 H16 O5 -","- C17 H16 O5 -","- C68 H64 O20 -","4","2","SJ6064","J. Radha Krishna; N. Jagadeesh Kumar; M. Krishnaiah; C. Venkata Rao; Y. Koteswara Rao; Vedavati G. Puranik","(<i>E</i>)-1-(2-Hydroxy-3,4-dimethoxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2005","61","5","o1323","o1325","10.1107/S1600536805010731","","","0.71073","MoKα","","0.047","0.0427","","","0.1131","0.1178","","","","","","1.057","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205805","10.5756","0.0006","10.5907","0.0006","14.4795","0.0008","90","","107.548","0.001","90","","1546.28","0.15","293","2","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H14 O4 -","- C21 H14 O4 -","- C84 H56 O16 -","4","1","SJ6065","Zhi-Peng Chen; Duan-Ming Tan; Cheng-Yong Su; Zun-Le Xu","2,3-Epoxy-13c-methoxy-1,13c-dihydrodibenzo[<i>a</i>,<i>kl</i>]xanthan-1-one","Acta Crystallographica Section E","2005","61","5","o1308","o1309","10.1107/S1600536805010378","","","0.71073","MoKα","","","0.0443","","","","0.1368","","","","","","1.048","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205806","5.207","0.0005","14.0918","0.0018","18.1737","0.0018","90","","90","","90","","1333.5","0.3","296","","296","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(<i>E</i>)-2-methoxy-6-[(2-trifluoromethylphenylimino)methyl]phenol","","- C15 H12 F3 N O2 -","- C15 H12 F3 N O2 -","- C60 H48 F12 N4 O8 -","4","1","SJ6066","Şahin, Onur; Büyükgüngör, Orhan; Albayrak, Çiǧdem; Odabaşoǧlu, Mustafa","(<i>E</i>)-2-Methoxy-6-[(2-trifluoromethylphenylimino)methyl]phenol","Acta Crystallographica Section E","2005","61","5","o1288","o1290","10.1107/S1600536805010342","","","0.71073","MoKα","","0.0779","0.0537","","","0.1146","0.1231","","","","","","0.891","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205807","14.5546","0.0006","11.5095","0.0004","13.9115","0.0006","90","","90.487","0.002","90","","2330.32","0.16","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H18 Cu N2 O14 -","- C22 H18 Cu N2 O14 -","- C88 H72 Cu4 N8 O56 -","4","0.5","SJ6068","Lei Wang; Dong-Hui Zhou; Jing-Ping Zhang","<i>catena</i>-Poly[[[bis(2-pyridinecarboxylato-κ^2^<i>N</i>,<i>O</i>)copper(II)]-μ-benzene-1,2,4,5-tetracarboxylic acid] dihydrate]","Acta Crystallographica Section E","2005","61","5","m958","m960","10.1107/S1600536805011979","","","0.71073","MoKα","","0.0369","0.0274","","","0.0699","0.0722","","","","","","0.951","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205808","7.4713","0.0012","7.7792","0.0007","13.3329","0.0012","85.785","0.006","86.057","0.009","82.954","0.009","765.59","0.16","296","2","296","1","","","","","","","","5","P -1","-P 1","2","","Dichlorobis(1H-benzimidazole-κN^3^)cobalt(II)","","- C14 H12 Cl2 Co N4 -","- C14 H12 Cl2 Co N4 -","- C28 H24 Cl4 Co2 N8 -","2","1","SJ6069","Yoe-Reyes, Francisco-Javier; Bernès, Sylvain; Barba-Behrens, Noráh","Dichlorobis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)cobalt(II)","Acta Crystallographica Section E","2005","61","5","m875","m877","10.1107/S1600536805010718","","","0.71073","MoKα","","0.0467","0.0366","","","0.0917","0.0971","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205809","6.9836","0.0014","15.597","0.003","17.506","0.004","90","","90","","90","","1906.8","0.7","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Catena-poly[aqua(2,2'-bipyridine)copper(II)-μ-benzene-1,4-dioxyacetato]","","- C20 H18 Cu N2 O7 -","- C20 H18 Cu N2 O7 -","- C80 H72 Cu4 N8 O28 -","4","1","SJ6070","Gao, Shan; Huo, Li-Hua; Liu, Ji-Wei; Zhao, Hui","Catena-poly[aqua(2,2'-bipyridine)copper(II)-μ-benzene-1,4-dioxyacetato]","Acta Crystallographica Section E","2005","61","5","m895","m897","10.1107/S1600536805011372","","","0.71073","MoKα","","0.098","0.058","","","0.078","0.086","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205810","7.368","0.013","8.368","0.014","12.07","0.02","88.59","0.03","88.38","0.03","69.92","0.03","699","2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Bis(aqua)bis(benzimidazole-κN)bis(5-fluorouracil-1-acetate-κO)cobalt(II)","","- C26 H24 Co F2 N8 O10 -","- C26 H24 Co F2 N8 O10 -","- C26 H24 Co F2 N8 O10 -","1","0.5","SJ6071","Mao-Lin Hu; Nan-Wen Zhu; Hong-Ping Xiao","Bis(aqua)bis(benzimidazole-κ<i>N</i>)bis(5-fluorouracil-1-acetate-κ<i>O</i>)cobalt(II)","Acta Crystallographica Section E","2005","61","5","m898","m900","10.1107/S1600536805011323","","","0.71073","MoKα","","0.0585","0.0538","","","0.1378","0.1423","","","","","","1.062","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205811","12.686","0.002","8.588","0.001","15.422","0.003","90","","108","0.01","90","","1598","0.5","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 O5 -","- C18 H18 O5 -","- C72 H72 O20 -","4","1","SJ6072","Wu, Hui; Xu, Zhou; Liang, Yong-Min","(<i>E</i>)-1-(2-Hydroxyphenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2005","61","5","o1434","o1435","10.1107/S1600536805011761","","","0.71073","MoKα","","0.1623","0.0398","","","0.0289","0.0354","","","","","","0.799","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205812","21.474","0.011","11.008","0.006","16.044","0.008","90","","90","","90","","3793","3","358","2","85","2","","","","","","","","6","P c c a","-P 2a 2ac","54","","Bis[2,4-bis(2-pyridyl-κN)-6-(4-pyridyl)-1,3,5-triazine-κN^3^]ruthenium(II) bis(hexafluorophosphate)","","- C36 H24 F12 N12 P2 Ru -","- C36 H24 F12 N12 P2 Ru -","- C144 H96 F48 N48 P8 Ru4 -","4","0.5","SJ6074","Hartshorn, Richard M.; Zibaseresht, Ramin; Robinson, Ward T.","Bis[2,4-bis(2-pyridyl-κ<i>N</i>)-6-(4-pyridyl)-1,3,5-triazine-κ<i>N</i>^3^]ruthenium(II) bis(hexafluorophosphate)","Acta Crystallographica Section E","2005","61","5","m981","m983","10.1107/S1600536805012420","","","0.71073","MoKα","","0.0797","0.0584","","","0.1295","0.1373","","","","","","1.156","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205813","41.91","0.02","3.952","0.003","28.84","0.013","90","","126.87","0.04","90","","3821","4","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[Pyridine (2‒aniline‒N‒[‒(2‒oxyphenyl)methylene]‒2‒oxoethanehydrazonethionic acid)Ni(II)]","","- C20 H16 N4 Ni O2 S -","- C20 H16 N4 Ni O2 S -","- C160 H128 N32 Ni8 O16 S8 -","8","1","SU6171","Vladimir N. Yarovenko; Alexander V. Shirokov; Pavel A. Kondrashev; Victor B. Rybakov; Igor V. Zavarzin; Mikhail M. Krayushkin","{<i>N</i>-Anilino-2-[(2-oxidophenyl)methylenehydrazono]-2-sulfidoacetamide}pyridinenickel(II)","Acta Crystallographica Section E","2005","61","5","m964","m966","10.1107/S1600536805012134","","","0.71073","MoKα","","0.1081","0.0444","","","0.0673","0.0845","","","","","","0.968","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205814","5.18","0.0004","16.56","0.0014","10.2271","0.0008","90","","104.02","0.006","90","","851.16","0.12","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Acetyl-3-amino-1-benzofuran","","- C10 H9 N O2 -","- C10 H9 N O2 -","- C40 H36 N4 O8 -","4","1","SU6184","Ocak Ískeleli, Nazan; Kazak, Canan; Kırılmış, Cumhur; Koca, Murat","2-Acetyl-3-amino-1-benzofuran","Acta Crystallographica Section E","2005","61","5","o1212","o1213","10.1107/S1600536805009712","","","0.71073","MoKα","","0.0497","0.0353","","","0.0987","0.1028","","","","","","1.065","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205815","8.8508","0.001","10.7516","0.0012","12.7592","0.0015","114.218","0.002","95.77","0.002","94.022","0.002","1093.4","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Aquachloro[5-hydroxyisophthalato(1-)](1,10-phenanthroline)copper(II) 2.5-hydrate","","- C20 H20 Cl Cu N2 O8.5 -","- C20 H20 Cl Cu N2 O8.5 -","- C40 H40 Cl2 Cu2 N4 O17 -","2","1","SU6185","Hong-Ping Xiao; Wei-Dong Wang; Wei-Bing Zhang; Jia-Guo Wang","Aquachloro[5-hydroxyisophthalato(1{-})](1,10-phenanthroline)copper(II) 2.5-hydrate","Acta Crystallographica Section E","2005","61","5","m841","m843","10.1107/S1600536805009724","","","0.71073","MoKα","","0.0562","0.05","","","0.152","0.1557","","","","","","1.132","","","","has coordinates,has Fobs","199607","2020-10-21","18:00:00",""
"2205816","9.807","0.007","9.193","0.006","26.607","0.017","90","","90","","90","","2399","3","292","2","292","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-chloro-4,4'-dimethoxybiphenyl","","- C14 H13 Cl O2 -","- C14 H13 Cl O2 -","- C112 H104 Cl8 O16 -","8","1","TK6213","Ting-Feng, Tan; Jian-Xin, Zhang; Ji-Ben, Meng","An asymmetric biphenyl compound: 3-chloro-4,4'-dimethoxybiphenyl","Acta Crystallographica Section E","2005","61","5","o1210","o1211","10.1107/S1600536805009323","","","0.71073","MoKα","","0.114","0.063","","","0.109","0.131","","","","","","1.07","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205817","11.586","0.0012","11.82","0.0011","12.652","0.0013","96.5","0.003","107.03","0.002","101.69","0.004","1594.5","0.3","299","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C52 H78 N8 Ni3 O14 -","- C52 H78 N8 Ni3 O14 -","- C52 H78 N8 Ni3 O14 -","1","0.5","TK6216","Arıcı, Cengiz; Yüzer, Devrim; Atakol, Orhan; Fuess, Hartmut; Svoboda, Ingrid","A linear homotrinuclear nickel(II) complex with a reduced ONNO-type Schiff base","Acta Crystallographica Section E","2005","61","5","m919","m921","10.1107/S1600536805011396","","","0.71073","MoKα","","","0.05","","","","0.129","","","","","","0.95","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205818","9.4122","0.0001","12.1852","0.0002","17.5851","0.0002","90","","105.44","0.0006","90","","1944.04","0.04","293","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","tetrakis(μ-6-ammoniohexanoato-1kO:2κO')bis[chlorocopper(II)] dichloride tetrahydrate","","- C24 H60 Cl4 Cu2 N4 O12 -","- C24 H60 Cl4 Cu2 N4 O12 -","- C48 H120 Cl8 Cu4 N8 O24 -","2","0.5","TK6218","Lah, Nina; Leban, Ivan","Tetrakis(μ-6-ammoniohexanoato-1κ<i>O</i>:2κ<i>O</i>')bis[chlorocopper(II)] dichloride tetrahydrate","Acta Crystallographica Section E","2005","61","5","m835","m837","10.1107/S1600536805009992","","","0.71073","MoKα","","0.066","0.036","","","0.074","0.083","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205819","13.3335","0.0009","12.1528","0.0008","9.621","0.0006","90","","90","","90","","1558.98","0.18","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H28 Cl N O4 -","- C12 H28 Cl N O4 -","- C48 H112 Cl4 N4 O16 -","4","1","TK6220","Fujihara, Takashi; Kato, Masaru; Nagasawa, Akira","Tetra-<i>n</i>-propylammonium perchlorate","Acta Crystallographica Section E","2005","61","5","o1439","o1440","10.1107/S1600536805012006","","","0.71073","MoKα","","0.067","0.049","","","0.102","0.108","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205820","8.7325","0.0011","9.0677","0.0012","13.6287","0.0017","98.41","0.002","108.229","0.002","102.689","0.002","972.7","0.2","292","2","292","2","","","","","","","","3","P -1","-P 1","2","","Methyl 1-hydroxy-2-naphthoate","","- C12 H10 O3 -","- C12 H10 O3 -","- C48 H40 O12 -","4","2","TK6222","Jin, Long-Fei; Xiao, Feng-Ping","Methyl 1-hydroxy-2-naphthoate","Acta Crystallographica Section E","2005","61","5","o1520","o1522","10.1107/S1600536805012626","","","0.71073","MoKα","","0.106","0.068","","","0.179","0.216","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205821","10.236","0.002","12.937","0.002","13.614","0.002","62.419","0.002","88.218","0.002","84.286","0.002","1589.8","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","Carbamazepine‒2,2,2-trifluoroethanol (1/1)","5H-dibenzo[b,f]azepine-5-carboxamide‒2,2,2-trifluoroethanol (1/1)","","- C17 H15 F3 N2 O2 -","- C17 H15 F3 N2 O2 -","- C68 H60 F12 N8 O8 -","4","2","WK6047","Lohani, Sachin; Zhang, Yuegang; Chyall, Leonard J.; Mougin-Andres, Patricia; Muller, Francis X.; Grant, David J. W.","Carbamazepine‒2,2,2-trifluoroethanol (1/1)","Acta Crystallographica, Section E","2005","61","5","o1312","o1310","10.1107/S1600536805010299","","","0.71073","MoKα","","0.0682","0.0464","","","0.1217","0.1403","","","","","","1.052","","","","has coordinates","211332","2020-10-21","18:00:00",""
"2205822","9.9708","0.0005","13.0403","0.0007","19.3556","0.001","103.383","0.001","99.003","0.001","98.203","0.001","2375.9","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","μ-oxalato-1κ^2^O,O':2κ^2^O'',O'''tetrakis(phenylpyridine-κ^2^C,N)\- diiridium(III) acetone 1.974 solvate","","- C51.92 H43.85 Ir2 N4 O5.97 -","- C51.922 H43.844 Ir2 N4 O5.974 -","- C103.844 H87.688 Ir4 N8 O11.948 -","2","1","WM6056","DeRosa, Maria C.; Enright, Gary D.; Evans, Christopher E. B.; Crutchley, Robert J.","The photodecomposition product μ-oxalato-1κ^2^<i>O</i>,<i>O</i>':2κ^2^<i>O</i>'',<i>O</i>'''-bis{bis[2-(2-pyridyl)phenyl-κ^2^<i>C</i>,<i>N</i>]iridium(III)}‒acetone (1/1.974)","Acta Crystallographica Section E","2005","61","5","m967","m969","10.1107/S1600536805008809","","","0.71073","MoKα","","0.0628","0.0397","","","0.087","0.098","","","","","","1.012","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205823","14.394","0.003","8.0685","0.0018","20.505","0.005","90","","90.53","0.004","90","","2381.3","0.9","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Ammonium antimony iodide","Triammonium nonaiododiantimonate(III)","","- H12 I9 N3 Sb2 -","- I9 N3 Sb2 -","- I36 N12 Sb8 -","4","1","WM6059","Zhang, Hui; Fang, Liang; Yuan, Run-Zhang","Triammonium nonaiododiantimonate(III), (NH~4~)~3~[Sb~2~I~9~]","Acta Crystallographica Section E","2005","61","5","i70","i72","10.1107/S1600536805011098","","","0.71073","MoKα","","0.0735","0.0406","","","0.0787","0.0892","","","","","","1.009","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205824","10.188","0.002","10.188","0.002","10.188","0.002","90","","90","","90","","1057.5","0.4","295","2","295","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","Ammonium manganese sulfate","Diammonium dimanganese(II) trissulfate(IV)","","- H8 Mn2 N2 O12 S3 -","- H8 Mn2 N2 O12 S3 -","- H32 Mn8 N8 O48 S12 -","4","0.333333","WM6061","Zhang, Xian-Ming; Hao, Zheng-Ming; Ng, Seik Weng","Langbeinite-type (NH~4~)~2~Mn~2~(SO~4~)~3~","Acta Crystallographica, Section E","2005","61","5","i82","i83","10.1107/S1600536805011736","","","0.71073","MoKα","","0.035","0.03","","","0.069","0.071","","","","","","1.05","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2205825","7.868","0.005","15.258","0.007","8.052","0.006","90","","90","","90","","966.6","1","120","2","120","2","","","","","","","","3","P n m a","-P 2ac 2n","62","Ce20 Au1.72 Ge14.28","Pentacerium gold tetragermanium","","- Au0.43 Ce5 Ge3.58 -","- Au0.429 Ce5 Ge3.571 -","- Au1.716 Ce20 Ge14.284 -","4","0.5","WM6062","Bobev, Svilen; Bauer, Eric D.","Ce~5~Au~<i>x~</i>Ge~4{-~<i>x</i>} [<i>x</i> = 0.43(2)] with the orthorhombic Sm~5~Ge~4~ structure type","Acta Crystallographica Section E","2005","61","5","i73","i75","10.1107/S160053680501113X","","","0.71073","MoKα","","0.0317","0.0282","","","0.0545","0.0555","","","","","","1.101","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205826","8.1395","0.0009","6.9394","0.0008","6.6014","0.0007","90","","90","","90","","372.87","0.07","293","2","293","2","","","","","","","","4","P m n 21","P 2ac -2","31","silver cadmium gallium sulfide","silver dicadmium(II) gallium tetrasulfide","","- Ag Cd2 Ga S4 -","- Ag Cd2 Ga S4 -","- Ag2 Cd4 Ga2 S8 -","2","0.5","WM6063","Pervukhina, Natalie V.; Atuchin, Viktor V.; Parasyuk, Oleg V.","Redetermination of the quaternary phase silver dicadmium gallium tetrasulfide, AgCd~2~GaS~4~","Acta Crystallographica Section E","2005","61","5","i91","i93","10.1107/S1600536805012341","","","0.71073","MoKα","","0.0472","0.0376","","","0.108","0.1133","","","","","","1.077","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205827","6.7964","0.0003","6.7964","0.0003","24.7282","0.0014","90","","90","","90","","1142.22","0.1","153","2","153","2","","","","","","","","3","P 41","P 4w","76","Cerium disilicate","Dicerium disilicate","","- Ce4 O14 Si4 -","- Ce4 O14 Si4 -","- Ce16 O56 Si16 -","4","1","WM6067","Bin Deng; James A. Ibers","Dicerium disilicate, Ce~2~[Si~2~O~7~]","Acta Crystallographica Section E","2005","61","5","i76","i78","10.1107/S1600536805011049","","","0.71073","MoKα","","0.0258","0.0243","","","0.0548","0.0554","","","","","","1.153","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205828","10.1565","0.0011","18.879","0.002","14.2904","0.0015","90","","107.548","0.002","90","","2612.6","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Z)-Ethyl 3-(4-methoxyphenyl)-2-[(triphenylphosphoranylidene)amino]prop- 2-enoate","","- C30 H28 N O3 P -","- C30 H28 N O3 P -","- C120 H112 N4 O12 P4 -","4","1","WN6341","Ding, Jin-Chang; Huang, Xiao-Bo; Wu, Hua-Yue; Liu, Miao-Chang; Hu, Mao-Lin","(<i>Z</i>)-Ethyl 3-(4-methoxyphenyl)-2-[(triphenylphosphoranylidene)amino]prop-2-enoate","Acta Crystallographica Section E","2005","61","5","o1259","o1260","10.1107/S1600536805010275","","","0.71073","MoKα","","0.0858","0.0661","","","0.1427","0.153","","","","","","1.119","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205829","14.158","0.009","11.075","0.007","17.877","0.001","90","","108.776","0.001","90","","2654","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","4-morpholinyl{2-[1-(2-pyridinyl)ethylidene]diazan-2-iumylidene}methanethiolate","4-morpholinyl{2-[1-(2-pyridinyl)ethylidene]diazan-2-iumylidene}methanethiolate","","- C12 H16 N4 O S -","- C12 H16 N4 O S -","- C96 H128 N32 O8 S8 -","8","2","WN6344","Hoong-Kun Fun; Suchada Chantrapromma; V. Suni; A. Sreekanth; S. Sivakumar; M. R. Prathapachandra Kurup","4-Morpholinyl{2-[1-(2-pyridinyl)ethylidene]diazan-2-iumylidene}methanethiolate","Acta Crystallographica Section E","2005","61","5","o1337","o1339","10.1107/S1600536805010974","","","0.71073","MoKα","","0.0658","0.0442","","","0.1091","0.1249","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205830","19.7026","0.0015","11.2427","0.0008","12.2043","0.0009","90","","124.45","0.001","90","","2229.3","0.3","283","2","283","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Methyl 4,6-dichlorochroman-2-carboxylate","","- C11 H10 Cl2 O3 -","- C11 H10 Cl2 O3 -","- C88 H80 Cl16 O24 -","8","1","WN6345","Wei Huang; Zhongzhen Zhou; Peiliang Zhao; Qiong Chen; Deyou Teng; Guangfu Yang","Methyl 4,6-dichlorochroman-2-carboxylate","Acta Crystallographica Section E","2005","61","5","o1273","o1275","10.1107/S1600536805010421","","","0.71073","MoKα","","0.0358","0.0328","","","0.0888","0.0915","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205831","9.3158","0.0013","6.4393","0.0009","17.399","0.002","90","","92.022","0.002","90","","1043.1","0.2","283","2","283","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(2,4-Dihydroxyphenyl)-N,N-dimethyl-2-oxoacetamide","","- C10 H11 N O4 -","- C10 H11 N O4 -","- C40 H44 N4 O16 -","4","1","WN6346","Wei Huang; Peiliang Zhao; Zhongzhen Zhou; Qiong Chen; Deyou Teng; Guangfu Yang","2-(2,4-Dihydroxyphenyl)-<i>N,N</i>-dimethyl-2-oxoacetamide","Acta Crystallographica Section E","2005","61","5","o1505","o1506","10.1107/S1600536805012699","","","0.71073","MoKα","","0.0661","0.0493","","","0.1356","0.1483","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205832","7.133","0.003","22.536","0.008","7.056","0.003","90","","90","","90","","1134.2","0.8","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C4 H16 Cu N10 O2 -","- C4 H16 Cu N10 O2 -","- C16 H64 Cu4 N40 O8 -","4","0.5","WN6348","Su, Ying-Lan; Lu, Li-Ping; Li, Xue-Mei; Zhu, Miao-Li","Bis(biguanido-κ^2^<i>N</i>,<i>N</i>')copper(II) dihydrate","Acta Crystallographica Section E","2005","61","5","m910","m912","10.1107/S160053680501127X","","","0.71073","MoKα","","0.0465","0.0403","","","0.0923","0.096","","","","","","1.195","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205833","6.2128","0.0007","10.0405","0.0011","17.4701","0.0019","90","","90","","90","","1089.8","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Ethyl 3,5-dinitro salicylate","","- C9 H8 N2 O7 -","- C9 H8 N2 O7 -","- C36 H32 N8 O28 -","4","1","WW6364","Jin, Long-Fei; Xiao, Feng-Ping","Ethyl 3,5-dinitrosalicylate","Acta Crystallographica Section E","2005","61","5","o1263","o1264","10.1107/S160053680501041X","","","0.71073","MoKα","","0.0699","0.0501","","","0.1164","0.1264","","","","","","1.088","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205834","22.162","0.006","5.8941","0.0017","9.743","0.003","90","","91.12","0.004","90","","1272.4","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Morpholinomethyl-2-naphthol","","- C15 H17 N O2 -","- C15 H17 N O2 -","- C60 H68 N4 O8 -","4","1","WW6372","Ma, Shan-Shan; Zhang, Ming-Jie; Yuan, Dong-Yan; Qi, Zhao-Bin","1-Morpholinomethyl-2-naphthol","Acta Crystallographica Section E","2005","61","5","o1370","o1371","10.1107/S1600536805011384","","","0.71073","MoKα","","0.0778","0.0456","","","0.1189","0.1318","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205835","15.721","0.004","12.082","0.003","21.386","0.006","90","","104.346","0.006","90","","3935.4","1.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(3,4-Methylenedioxyphenyl)-1-(2-furyl)-3-(p-toluenesulfonylamino) propan-1-one","","- C21 H19 N O6 S -","- C21 H19 N O6 S -","- C168 H152 N8 O48 S8 -","8","2","WW6374","Yu, Zhifang; Liu, Yi; Gu, Xiuyan; Zhao, Bing","3-(3,4-Methylenedioxyphenyl)-1-(2-furyl)-3-(<i>p</i>-toluenesulfonylamino)propan-1-one","Acta Crystallographica Section E","2005","61","5","o1333","o1334","10.1107/S1600536805010779","","","0.71073","MoKα","","0.1314","0.0607","","","0.1478","0.1954","","","","","","0.999","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2205836","7.235","0.0014","9.56","0.0019","15.454","0.003","90","","97.03","0.03","90","","1060.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-[3-(Methoxyl)phenyl]-5-chloromethyl-1,2,4-oxadiazole","","- C10 H9 Cl N2 O2 -","- C10 H9 Cl N2 O2 -","- C40 H36 Cl4 N8 O8 -","4","1","WW6385","Wang, Hai-Bo; Pu, Yue-Qing; Chen, Jia-Hui; Wang, Jin-Tang","5-Chloromethyl-3-(3-methoxyphenyl)-1,2,4-oxadiazole","Acta Crystallographica Section E","2005","61","5","o1446","o1447","10.1107/S1600536805012067","","","0.71073","MoKα","","0.1908","0.0692","","","0.1678","0.2311","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205837","26.167","0.006","14.15","0.004","32.116","0.007","90","","97.91","0.02","90","","11778","5","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Bis[μ-bis(4-nitrophenyl) phosphato-κ^2^O:O']bis{[bis(2-pyridylmethyl)amine- κ^3^N,N',N''']copper(II)} diperchlorate acetonitrile hemisolvate","","- C49 H41.5 Cl2 Cu2 N10.5 O24 P2 -","- C49 H41.5 Cl2 Cu2 N10.5 O24 P2 -","- C392 H332 Cl16 Cu16 N84 O192 P16 -","8","1","XU6000","Butcher, Ray J.; Gultneh, Yilma; Allwar","Bis[μ-bis(4-nitrophenyl)phosphato-κ^2^<i>O</i>:<i>O</i>']bis{[bis(2-pyridylmethyl)amine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>''']copper(II)} diperchlorate acetonitrile hemisolvate","Acta Crystallographica Section E","2005","61","5","m818","m821","10.1107/S160053680500992X","","","0.71073","MoKα","","0.16","0.065","","","0.128","0.168","","","","","","1.012","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2205838","7.165","0.002","9.709","0.003","13.999","0.005","92.878","0.005","102.008","0.004","102.174","0.005","926.6","0.5","293","","293","","","","","","","","","6","P -1","-P 1","2","","Bis[1-ferrocenyl-3-(2,6-dimethylphenyl)aminobut-2-en-1-onato]nickel(II)","","- C44 H44 Fe2 N2 Ni O2 -","- C44 H44 Fe2 N2 Ni O2 -","- C44 H44 Fe2 N2 Ni O2 -","1","0.5","XU6001","Shi, Yao-Cheng","Bis[1-ferrocenyl-3-(2,6-dimethylphenyl)aminobut-2-en-1-onato]nickel(II)","Acta Crystallographica Section E","2005","61","5","m873","m874","10.1107/S1600536805010962","","","0.71073","MoKα","","0.048","0.033","","","0.076","0.091","","","","","","1.079","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205839","9.8745","0.0007","17.3467","0.0011","21.7544","0.0014","90","","90","","90","","3726.3","0.4","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Poly[(1,10-phenanthroline)(μ~4~-4-sulfonatobenzoato)lead(II) hydrate]","","- C19 H14 N2 O6 Pb S -","- C19 H12 N2 O6 Pb S -","- C152 H96 N16 O48 Pb8 S8 -","8","1","XU6002","Zhang, Li-Ping; Zhu, Long-Guan; Xiao, Hong-Ping","Poly[(1,10-phenanthroline-κ^2^<i>N,N</i>')lead(II) μ~4~-(4-sulfonatobenzoato-κ^4^<i>O,O</i>':O'',<i>O</i>''' hydrate]","Acta Crystallographica Section E","2005","61","5","m860","m862","10.1107/S1600536805010925","","","0.71073","MoKα","","0.047","0.032","","","0.066","0.071","","","","","","1.012","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2205840","14.949","0.004","13.366","0.002","7.324","0.008","90","","101.214","0.008","90","","1435.5","1.6","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-(2-hydroxy-4-isopropoxyphenyl)-2-phenylethanone","","- C17 H18 O3 -","- C17 H18 O3 -","- C68 H72 O12 -","4","1","YA6236","Zhang, Shu-Ping; Wang, Xiao-Bing; Zhang, Zun-Ting","1-(2-Hydroxy-4-isopropoxyphenyl)-2-phenylethanone","Acta Crystallographica Section E","2005","61","5","o1257","o1258","10.1107/S1600536805010408","","","0.71073","MoKα","","0.099","0.046","","","0.081","0.096","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205841","7.7657","0.0019","27.655","0.006","9.902","0.002","90","","102.526","0.004","90","","2075.9","0.8","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N,N'-bis{3-cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazol-5- yl}-1,4-benzenediamide bis(dimethylformamide) solvate","","- C36 H26 Cl4 F6 N10 O4 -","- C36 H26 Cl4 F6 N10 O4 -","- C72 H52 Cl8 F12 N20 O8 -","2","0.5","YA6241","Chen, Di-Mei; Zhong, Ping; Yang, Zhi-Ping; Hu, Mao-Lin","<i>N</i>,<i>N</i>'-Bis{3-cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1<i>H</i>-pyrazol-5-yl}-1,4-benzenediamide dimethylformamide disolvate<i></i>","Acta Crystallographica Section E","2005","61","5","o1362","o1363","10.1107/S1600536805011153","","","0.71073","MoKα","","0.145","0.098","","","0.268","0.248","","","","","","1.18","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205842","12.3011","0.0017","12.3846","0.0013","14.187","0.002","90","","114.338","0.011","90","","1969.2","0.5","293","1","293","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H10 O4 S7 -","- C15 H10 O4 S7 -","- C60 H40 O16 S28 -","4","1","YA6243","Wang, Yan-Ling; Yu, Wen-Tao; Xu, Dong; Wang, Xin-Qiang; Zhang, Guang-Hui; Feng, Lin","4,5-Bis(phenylsulfonylthio)-1,3-dithiolane-2-thione","Acta Crystallographica Section E","2005","61","5","o1432","o1433","10.1107/S1600536805011876","","","0.71073","MoKα","","0.171","0.066","","","0.124","0.185","","","","","","1.13","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205843","10.2012","0.0006","26.7355","0.0015","11.0576","0.0006","90","","107.65","0.0009","90","","2873.8","0.3","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","tetrakis(trimethylsilyl) isocyanatomethylenebisphosphonate","","- C14 H37 N O7 P2 Si4 -","- C14 H37 N O7 P2 Si4 -","- C56 H148 N4 O28 P8 Si16 -","4","1","AC6169","Petrov, Petar Y.; McDonald, Robert; Lukowski, Robert D.; Cavell, Ronald G.; Angelov, Christo M.","Tetrakis(trimethylsilyl) isocyanatomethylenebisphosphonate","Acta Crystallographica Section E","2005","61","6","o1549","o1551","10.1107/S1600536805013735","","","0.71073","MoKα","","0.0417","0.0352","","","0.0969","0.1023","","","","","","1.031","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205844","9.071","0.0003","10.0861","0.0005","10.1864","0.0003","100.147","0.001","115.39","0.001","108.728","0.001","741.78","0.05","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","Tetraamminehydroxonitrosylruthenium(III) tetranitropalladate(II) monohydrate","","- H15 N9 O11 Pd Ru -","- H15 N9 O11 Pd Ru -","- H30 N18 O22 Pd2 Ru2 -","2","1","AC6171","Il'in, Maxim A.; Kuratieva, Natalia V.; Kirichenko, Olga A.; Baidina, Iraida A.; Naumov, Dmirty Yu.; Korolkow, Ilya V.; Emel'yanov, Vyacheslav A.","Tetraamminehydroxonitrosylruthenium(III) tetranitropalladate(II) monohydrate","Acta Crystallographica Section E","2005","61","6","i126","i128","10.1107/S1600536805016673","","","0.71073","MoKα","","0.0194","0.0175","","","0.0442","0.0449","","","","","","1.072","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205845","8.274","0.003","9.125","0.002","10.623","0.002","76.31","0.02","81.34","0.02","66.51","0.03","713.3","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-Methoxy-6-methyl-3-nitro-4-(2-nitroprop-1-enyl)phenyl acetate","","- C13 H14 N2 O7 -","- C13 H14 N2 O7 -","- C26 H28 N4 O14 -","2","1","AC6172","Evan G. Moore; Paul Meredith; Paul V. Bernhardt","2-Methoxy-6-methyl-3-nitro-4-(2-nitroprop-1-enyl)phenyl acetate","Acta Crystallographica Section E","2005","61","6","o1709","o1711","10.1107/S1600536805014212","","","0.71073","MoKα","","0.1231","0.0464","","","0.1143","0.1435","","","","","","1.009","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205846","7.5119","0.0004","16.9551","0.0009","17.1127","0.0009","90","","90.821","0.001","90","","2179.3","0.2","295","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diaqua(benzimidazole)(nitrato-κO)(1,10-phenanthroline)cadmium(II) nitrate","","- C19 H18 Cd N6 O8 -","- C19 H18 Cd N6 O8 -","- C76 H72 Cd4 N24 O32 -","4","1","AC6173","Xiong, Jing; Lei, Xin-Xiang; Ng, Seik Weng","Diaqua(benzimidazole)(nitrato-κ<i>O</i>)(1,10-phenanthroline)cadmium(II) nitrate","Acta Crystallographica Section E","2005","61","6","m1097","m1098","10.1107/S1600536805014388","","","0.71073","MoKα","","0.054","0.046","","","0.132","0.137","","","","","","1.13","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205847","11.1249","0.0006","21.926","0.001","14.6557","0.0007","90","","107.096","0.001","90","","3416.9","0.3","295","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aquabis(hexamethylenetetramine-κN)bis(2-hydroxy-trans-cinnamato- κ^2^O,O')cadmium trihydrate","","- C30 H46 Cd N8 O10 -","- C30 H46 Cd N8 O10.004 -","- C120 H184 Cd4 N32 O40.016 -","4","1","AC6174","Cheng, Ya-Qian; Shi, Qian; Dai, Lin-Li; Ng, Seik Weng","Aquabis(hexamethylenetetramine-κ<i>N</i>)bis(2-hydroxy-<i>trans</i>-cinnamato-κ^2^<i>O</i>,<i>O</i>')cadmium trihydrate","Acta Crystallographica Section E","2005","61","6","m1240","m1242","10.1107/S1600536805016545","","","0.71073","MoKα","","0.052","0.042","","","0.098","0.103","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205848","7.294","0.002","8.762","0.002","8.891","0.002","64.87","0.01","70.1","0.01","73.79","0.01","477.6","0.2","174","2","174","2","","","","","","","","4","P -1","-P 1","2","","2,3,5,6-tetrachlorodicyanobenzene‒anthracene (1/1)","","- C22 H10 Cl4 N2 -","- C22 H10 Cl4 N2 -","- C22 H10 Cl4 N2 -","1","0.5","AC6175","Britton, Doyle","2,3,5,6-Tetrachloro-1,4-dicyanobenzene‒anthracene (1/1)","Acta Crystallographica Section E","2005","61","6","o1707","o1708","10.1107/S1600536805014674","","","0.71073","MoKα","","0.056","0.043","","","0.113","0.121","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205849","8.666","0.002","10.125","0.003","4.7776","0.0012","90","","93.98","0.01","90","","418.19","0.19","173","2","173","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","2,6-Dibromo-4-chlorobenzonitrile","","- C7 H2 Br2 Cl N -","- C7 H2 Br2 Cl N -","- C14 H4 Br4 Cl2 N2 -","2","0.5","AC6176","Britton, Doyle","2,6-Dibromo-4-chlorobenzonitrile","Acta Crystallographica Section E","2005","61","6","o1726","o1727","10.1107/S1600536805014686","","","0.71073","MoKα","","0.023","0.022","","","0.056","0.057","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205850","10.0277","0.0002","7.9202","0.0002","23.2669","0.0006","90","","90.985","0.001","90","","1847.62","0.08","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[tetrakis(methylsulfanyl)tetrathiafulvalenium] oxalate dichloride","","- C22 H24 Cl2 O4 S16 -","- C22 H24 Cl2 O4 S16 -","- C44 H48 Cl4 O8 S32 -","2","0.5","AT6006","Lei Wang; Jing-Ping Zhang; Bin Zhang","Bis[tetrakis(methylsulfanyl)tetrathiafulvalenium] oxalate dichloride","Acta Crystallographica Section E","2005","61","6","o1674","o1676","10.1107/S1600536805014121","","","0.71073","MoKα","","0.111","0.039","","","0.081","0.093","","","","","","0.91","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205851","3.8956","0.0003","11.3796","0.0014","18.3249","0.0018","90","","90","","90","","812.35","0.14","296","","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-Acetamidobenzonitrile","","- C9 H8 N2 O -","- C9 H8 N2 O -","- C36 H32 N8 O4 -","4","1","AT6007","Burcu Arslan; Canan Kazak; Cumhur Kirilmis; Murat Koca; Orhan Büyükgüngör","2-Acetamidobenzonitrile","Acta Crystallographica Section E","2005","61","6","o1652","o1653","10.1107/S1600536805013152","","","0.71073","MoKα","","0.042","0.032","","","0.077","0.079","","","","","","0.92","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205852","11.314","0.002","7.951","0.0016","19.598","0.004","90","","103.08","0.03","90","","1717.2","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl 2-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-ylmethoxy]phenylacetate","","- C18 H15 Cl N2 O4 -","- C18 H15 Cl N2 O4 -","- C72 H60 Cl4 N8 O16 -","4","1","AT6008","Wang, Hai-Bo; Pu, Yue-Qing; Chen, Jia-Hui; Wang, Jin-Tang","Methyl 2-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-ylmethoxy]phenylacetate","Acta Crystallographica Section E","2005","61","6","o1858","o1860","10.1107/S1600536805015138","","","0.71073","MoKα","","0.13","0.06","","","0.13","0.15","","","","","","0.98","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205853","5.2868","0.0013","8.5968","0.0011","13.878","0.002","74.39","0.19","89.598","0.018","88.87","0.01","607.4","0.6","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","1-(4-bromophenyl)-2-(2-propenylsulfonyl)ethanone","","- C11 H11 Br O3 S -","- C11 H11 Br O3 S -","- C22 H22 Br2 O6 S2 -","2","1","AT6009","David J. Young; Malcolm D. King; Peter C. Healy","1-(4-Bromophenyl)-2-(2-propenylsulfonyl)ethanone","Acta Crystallographica Section E","2005","61","6","o1668","o1669","10.1107/S1600536805014522","","","0.7107","MoKα","","0.111","0.034","","","0.071","0.088","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205854","8.0593","0.0003","8.4334","0.0003","9.8099","0.0004","111.688","0.002","91.079","0.002","99.634","0.002","608.44","0.04","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","Bis(2,2'-dipyridylamine)dimethanolcopper(II) hexafluorosilicate","","- C22 H26 Cu F6 N6 O2 Si -","- C22 H26 Cu F6 N6 O2 Si -","- C22 H26 Cu F6 N6 O2 Si -","1","0.5","BD6002","Casellas, Helene; Pevec, Andrej; Kozlevcar, Bojan; Gamez, Patrick; Reedijk, Jan","Bis(2,2'-dipyridylamine)dimethanolcopper(II) hexafluorosilicate","Acta Crystallographica Section E","2005","61","6","m1120","m1122","10.1107/S1600536805014777","","","0.71073","MoKα","","0.0414","0.0319","","","0.0696","0.0742","","","","","","1.06","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205855","6.0466","0.0018","19.314","0.006","11.452","0.003","90","","91.034","0.004","90","","1337.2","0.7","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3,4-Dichlorobenzaldehyde (2-hydroxybenzoyl)hydrazone","","- C14 H10 Cl2 N2 O2 -","- C14 H10 Cl2 N2 O2 -","- C56 H40 Cl8 N8 O8 -","4","1","BD6005","Ma, Jian; Zhang, Shu-Ping; Sheng, Liang-Quan; Fan, Min; Yang, Ya-Li; Shao, Si-Chang","3,4-Dichlorobenzaldehyde (2-hydroxybenzoyl)hydrazone","Acta Crystallographica Section E","2005","61","6","o1747","o1748","10.1107/S1600536805014789","","","0.71073","MoKα","","0.0677","0.0393","","","0.0859","0.1024","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205856","16.823","0.004","7.179","0.002","19.847","0.005","90","","90","","90","","2397","1.1","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1-Allyl-4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxylic acid","","- C13 H15 N O4 -","- C13 H15 N O4 -","- C104 H120 N8 O32 -","8","1","BH6001","Shishkina, Svetlana V.; Shishkin, Oleg V.; Ukrainets, Igor V.; Kolesnik, Elena V.","1-Allyl-4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxylic acid","Acta Crystallographica Section E","2005","61","6","o1833","o1835","10.1107/S1600536805015175","","","0.71073","MoKα","","0.1559","0.0471","","","0.1099","0.1322","","","","","","0.846","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205857","13.3944","0.0005","13.6063","0.0006","26.354","0.001","90","","90","","90","","4803","0.3","295","2","295","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","catena-Poly-[[[triaquazinc(II)]-μ-chloro-[aquacucurbit[5]urilpotassium(I)]] tetrachlorozincate(II) pentahydrate]","","- C30 H48 Cl5 K N20 O19 Zn2 -","- C30 H48 Cl5 K N20 O19 Zn2 -","- C120 H192 Cl20 K4 N80 O76 Zn8 -","4","0.5","BH6002","Liu, Jing-Xin; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","<i>catena</i>-Poly[[[triaquazinc(II)]-μ-chloro-[aquacucurbit[5]urilpotassium(I)]] tetrachlorozincate(II) pentahydrate]","Acta Crystallographica Section E","2005","61","6","m1021","m1023","10.1107/S1600536805012845","","","0.71073","MoKα","","0.051","0.044","","","0.128","0.134","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205858","19.531","0.002","25.5","0.002","7.8777","0.0007","90","","104.847","0.002","90","","3792.4","0.6","295","2","295","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","Bis(2-aminoethylaminium-κN^2^)bis(dimethylglyoximato-κ^2^N,N')cobalt(III) dichloro(dimethylglyoximato-κ^2^N,N')(dimethylglyoxime-κ^2^N,N')cobalt(III) dichloride 0.75-hydrate","","- C20 H47.5 Cl4 Co2 N12 O8.75 -","- C20 H47.5 Cl4 Co2 N12 O8.75 -","- C80 H190 Cl16 Co8 N48 O35 -","4","0.5","BH6003","Shen, Xu-Jie; Xiao, Li-Ping; Xu, Ru-Ren","Bis(2-aminoethylaminium-κ<i>N</i>^2^)bis(dimethylglyoximato-κ^2^<i>N,N</i>')cobalt(III) dichloro(dimethylglyoximato-κ^2^<i>N,N</i>')(dimethylglyoxime-κ^2^<i>N,N</i>')cobaltate(III) dichloride 0.75-hydrate","Acta Crystallographica Section E","2005","61","6","m1185","m1187","10.1107/S1600536805015552","","","0.71073","MoKα","","0.1067","0.0482","","","0.1261","0.1437","","","","","","1.044","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2205859","10.941","0.003","9.135","0.002","20.013","0.004","90","","103.605","0.004","90","","1944.1","0.8","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[[aqua(1,10-phenanthroline)manganese(II)]-μ-endo-norbornene- cis-5,6-dicarboxylato] monohydrate]","","- C21 H20 Mn N2 O6 -","- C21 H20 Mn N2 O6 -","- C84 H80 Mn4 N8 O24 -","4","1","BH6004","Mao-Lin Hu; Nan-Wen Zhu","<i>catena</i>-Poly[[[aqua(1,10-phenanthroline)manganese(II)]-μ-<i>endo</i>-norbornene-<i>cis</i>-5,6-dicarboxylato] monohydrate]","Acta Crystallographica Section E","2005","61","6","m1105","m1107","10.1107/S1600536805014017","","","0.71073","MoKα","","0.0481","0.0403","","","0.0947","0.0992","","","","","","1.066","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205860","6.26","0.001","7.248","0.001","9.451","0.002","105.29","0.03","100.19","0.03","106.27","0.03","382.23","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","catena-Poly[[bis(4-aminopyrimidine-κN^1^)copper(II)]-di-μ-dicyanamido- κ^4^N^1^:N^3^]","","- C12 H10 Cu N12 -","- C12 H10 Cu N12 -","- C12 H10 Cu N12 -","1","0.5","BH6005","Kožíšek, Jozef; García Díaz, Jesús; Fronc, Marek; Svoboda, Ingrid","<i>catena</i>-Poly[[bis(4-aminopyrimidine-κ<i>N</i>^1^)copper(II)]-di-μ-dicyanamido-κ^4^<i>N</i>^1^:<i>N</i>^3^]","Acta Crystallographica Section E","2005","61","6","m1150","m1152","10.1107/S160053680501514X","","","0.71073","MoKα","","0.0268","0.0251","","","0.0632","0.0639","","","","","","1.04","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205861","54.925","0.011","5.8189","0.0012","21.628","0.004","90","","98.14","0.03","90","","6843","2","120","2","120","2","","","","","","","","4","C 1 2 1","C 2y","5","","10-Methoxy-5H-dibenz[b,f]azepine","","- C15 H13 N O -","- C15 H13 N O -","- C360 H312 N24 O24 -","24","6","BH6006","Basavegowda Nagaraj; Hemmige S. Yathirajan; Daniel E. Lynch","10-Methoxy-5<i>H</i>-dibenz[<i>b</i>,<i>f</i>]azepine","Acta Crystallographica Section E","2005","61","6","o1757","o1759","10.1107/S1600536805015059","","","0.71073","MoKα","","0.1101","0.0553","","","0.1242","0.1455","","","","","","1.182","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205862","9.3181","0.0012","11.6211","0.0015","13.9327","0.0018","87.052","0.002","76.227","0.002","77.46","0.002","1430.4","0.3","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","(4-Biphenylacetato)tricyclohexyltin(IV)","","- C32 H44 O2 Sn -","- C32 H44 O2 Sn -","- C64 H88 O4 Sn2 -","2","1","BH6007","Lai-Jin Tian; Yu-Xi Sun; Yi-Zhen Gao; Guo-Ming Yang","(4-Biphenylacetato)tricyclohexyltin(IV)","Acta Crystallographica Section E","2005","61","6","m1199","m1200","10.1107/S160053680501617X","","","0.71073","MoKα","","0.0322","0.0301","","","0.0789","0.0807","","","","","","1.051","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205863","7.2499","0.0004","9.4445","0.0006","20.8273","0.0012","90","","93.159","0.001","90","","1423.91","0.15","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[aqua(nitrato-κ^2^O,O')(1,10-phenanthroline)cadmium(II)]-μ- nitrato-κ^2^O:O']","","- C12 H10 Cd N4 O7 -","- C12 H10 Cd N4 O7 -","- C48 H40 Cd4 N16 O28 -","4","1","BR6190","Mao-Lin Hu; Fan Chen; Shun Wang","<i>catena</i>-Poly[[aqua(nitrato-κ^2^<i>O,O</i>')(1,10-phenanthroline)cadmium(II)]-μ-nitrato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","6","m1058","m1060","10.1107/S1600536805013899","","","0.71073","MoKα","","0.0273","0.0243","","","0.057","0.0585","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205864","11.332","0.005","9.519","0.005","23.514","0.008","90","","94.735","0.003","90","","2527.8","1.9","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[(tetrahydrofuran-κO)lithium(I)]-μ-1,1,3,3- tetraphenyltriphosphane-κ^2^P^1^,P^3^:κP^2^]","","- C28 H28 Li O P3 -","- C28 H28 Li O P3 -","- C112 H112 Li4 O4 P12 -","4","1","BR6191","Wioleta Domanska; Jaroslaw Chojnacki; Jerzy Pikies","<i>catena</i>-Poly[[(tetrahydrofuran-κ<i>O</i>)lithium(I)]-μ-1,1,3,3-tetraphenyltriphosphane-κ^2^<i>P</i>^1^,<i>P</i>^3^:κ<i>P</i>^2^]","Acta Crystallographica Section E","2005","61","6","m1114","m1116","10.1107/S1600536805014613","","","0.71073","MoKα","","0.0741","0.0639","","","0.1325","0.1386","","","","","","1.144","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205865","20.863","0.004","10.7899","0.0019","7.363","0.0013","90","","90","","90","","1657.5","0.5","273","2","273","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Acetonitriledichloro(1,4,7-triazacyclodecane)cobalt(III) perchlorate","","- C9 H20 Cl3 Co N4 O4 -","- C9 H20 Cl3 Co N4 O4 -","- C36 H80 Cl12 Co4 N16 O16 -","4","0.5","BT6641","Guo, Hui; Ren Yan-Wei; Li, Jun; Zhang, Feng-Xing","Acetonitriledichloro(1,4,7-triazacyclodecane)cobalt(III) perchlorate","Acta Crystallographica Section E","2005","61","6","m1080","m1081","10.1107/S1600536805014042","","","0.71073","MoKα","","0.0659","0.0414","","","0.1098","0.1177","","","","","","1.055","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205866","21.382","0.004","7.407","0.0015","13.372","0.003","90","","125.34","0.03","90","","1727.6","0.9","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Methyl indole-3-carboxylate","","- C10 H9 N O2 -","- C10 H9 N O2 -","- C80 H72 N8 O16 -","8","1","BT6646","Hu, Shen-Cai; Zhu, Hai-Liang; Hong, Kui; Yu, Zi-Niu; Tan, Ren-Xiang","Methyl indole-3-carboxylate","Acta Crystallographica Section E","2005","61","6","o1654","o1656","10.1107/S1600536805012109","","","0.71073","MoKα","","0.0789","0.0559","","","0.1357","0.152","","","","","","1.063","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205867","13.6953","0.0014","9.0282","0.0015","16.302","0.002","90","","106.983","0.007","90","","1927.7","0.5","291","1","291","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(E,E)-α-(Methoxyimino)-2-[({1-[3-(trifluoromethyl)phenyl]ethyl- idene}amino)oxymethyl]benzeneacetic acid","","- C19 H17 F3 N2 O4 -","- C19 H17 F3 N2 O4 -","- C76 H68 F12 N8 O16 -","4","1","BT6649","Banerjee, Kaushik; Ligon, Axel Patrick; Schürmann, Markus; Preut, Hans; Spiteller, Michael","(<i>E,E</i>)-α-(Methoxyimino)-2-[({1-[3-(trifluoromethyl)phenyl]ethylidene}amino)oxymethyl]benzeneacetic acid","Acta Crystallographica Section E","2005","61","6","o1528","o1529","10.1107/S1600536805012900","","","0.71073","MoKα","","0.1647","0.0363","","","0.0645","0.0937","","","","","","1.051","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2205868","8.0652","0.0006","8.2977","0.0006","18.409","0.0013","80.057","0.001","84.796","0.001","69.754","0.001","1137.86","0.14","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","4'-(4-Methoxyphenyl)-1-methylchroman-3-spiro-3'-pyrrolidine-2'-spiro-2''- indan-4,1'',3''-trione","","- C28 H23 N O4 -","- C28 H23 N O4 -","- C56 H46 N2 O8 -","2","1","BT6653","S. Selvanayagam; D. Velmurugan; K. Ravikumar; J. Jayashankaran; R. Raghunathan","4'-(4-Methoxyphenyl)-1-methylchroman-3-spiro-3'-pyrrolidine-2'-spiro-2''-indan-4,1'',3''-trione","Acta Crystallographica Section E","2005","61","6","o1582","o1584","10.1107/S1600536805013206","","","0.71073","MoKα","","0.0593","0.0523","","","0.1461","0.1556","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205869","9.5561","0.0006","16.1035","0.0011","15.2631","0.001","90","","91.213","0.01","90","","2348.3","0.3","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","7'-(4-Methoxyphenyl)-chroman-3-spiro-6'-hexahydro-1H-pyrrolo[1,2-c]thiazole- 5'-spiro-3''-1''H-indole-4,2''(3''H)-dione","","- C28 H24 N2 O4 S -","- C28 H24 N2 O4 S -","- C112 H96 N8 O16 S4 -","4","1","BT6657","S. Selvanayagam; Jasmin Paul; D. Velmurugan; K. Ravikumar; R. Rathna Durga; R. Raghunathan","7'-(4-Methoxyphenyl)chroman-3-spiro-6'-hexahydro-1<i>H</i>-pyrrolo[1,2-<i>c</i>]thiazole-5'-spiro-3''-1''<i>H</i>-indole-4,2''(3''<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","6","o1585","o1587","10.1107/S1600536805013218","","","0.71073","MoKα","","0.054","0.047","","","0.1207","0.1262","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205870","9.2614","0.0009","18.4306","0.0019","9.8602","0.001","90","","99.382","0.002","90","","1660.6","0.3","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-Butyl-N-o-tolyl-benzenesulfonamide","","- C17 H21 N O2 S -","- C17 H21 N O2 S -","- C68 H84 N4 O8 S4 -","4","1","BT6659","G. Usha; S. Selvanayagam; D. Velmurugan; K. Ravikumar; P. Jaisankar; P. C. Srinivasan","<i>N</i>-Butyl-<i>N</i>-<i>o</i>-tolylbenzenesulfonamide","Acta Crystallographica Section E","2005","61","6","o1916","o1918","10.1107/S160053680501562X","","","0.71073","MoKα","","0.0771","0.0611","","","0.1655","0.1794","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205871","7.147","0.0005","11.854","0.0008","15.456","0.001","106.45","0.02","95.17","0.01","91.02","0.02","1249.4","0.2","293","2","293","2","","","","","","","","4","P 1","P 1","1","L-Leucine L-leucinium picrate","L-Leucine L-leucinium picrate","","- C18 H29 N5 O11 -","- C18 H29 N5 O11 -","- C36 H58 N10 O22 -","2","2","BT6660","K. Anitha; S. Athimoolam; R. K. Rajaram","<small>L</small>-Leucine <small>L</small>-leucinium picrate","Acta Crystallographica Section E","2005","61","6","o1604","o1606","10.1107/S1600536805014030","","","0.71073","MoKα","","0.0719","0.0507","","","0.1353","0.1495","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205872","22.48","0.0014","22.1594","0.0015","7.7029","0.0006","90","","90","","90","","3837.1","0.5","173","1","173","1","","","","","","","","5","P n a 21","P 2c -2n","33","","Methyl (Z,E)-α-methoxyimino-α-(1-{[3- (trifluoromethyl)phenyl]ethylideneaminooxymethyl}benzene)acetate","","- C20 H19 F3 N2 O4 -","- C20 H19 F3 N2 O4 -","- C160 H152 F24 N16 O32 -","8","2","BT6661","Banerjee, Kaushik; Ligon, Axel Patrick; Schürmann, Markus; Preut, Hans; Spiteller, Michael","Methyl (<i>Z,E</i>)-α-(methoxyimino)-2-[({1-[3-(trifluoromethyl)phenyl]ethylidene}amino)oxymethyl]benzeneacetate","Acta Crystallographica Section E","2005","61","6","o1569","o1570","10.1107/S160053680501336X","","","0.71073","MoKα","","0.0867","0.0329","","","0.0458","0.0502","","","","","","0.864","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205873","7.5713","0.0003","10.9972","0.0004","20.0451","0.0006","90","","101.55","0.002","90","","1635.22","0.1","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E,E)-2-(4-Methylphenylmethylene)-6-(4-nitrophenylmethylene)cyclohexanone","","- C21 H19 N O3 -","- C21 H19 N O3 -","- C84 H76 N4 O12 -","4","1","BT6665","Quail, J. Wilson; Doroudi, Alireza; Pati, Hari N.; Das, Umashankar; Dimmock, Jonathan R.","(<i>E,E</i>)-2-(4-Methylphenylmethylene)-6-(4-nitrophenylmethylene)cyclohexanone","Acta Crystallographica Section E","2005","61","6","o1795","o1797","10.1107/S1600536805015102","","","0.71073","MoKα","","0.0815","0.0478","","","0.112","0.1297","","","","","","1.034","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205874","15.5155","0.0007","13.6328","0.0009","7.7777","0.0006","90","","101.344","0.003","90","","1613","0.18","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(E,E)-2-(4-Fluorophenylmethylene)-6-(4-nitrophenylmethylene)cyclohexanone","","- C20 H16 F N O3 -","- C20 H16 F N O3 -","- C80 H64 F4 N4 O12 -","4","1","BT6666","Quail, J. Wilson; Doroudi, Alireza; Pati, Hari N.; Das, Umashankar; Dimmock, Jonathan R.","(<i>E</i>,<i>E</i>)-2-(4-Fluorophenylmethylene)-6-(4-nitrophenylmethylene)cyclohexanone","Acta Crystallographica Section E","2005","61","6","o1774","o1776","10.1107/S160053680501490X","","","0.71073","MoKα","","0.1125","0.0585","","","0.1137","0.1353","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205875","8.7481","0.0008","19.0068","0.0018","12.494","0.0012","90","","95.891","0.002","90","","2066.4","0.3","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 2-(1H-indol-3-ylmethyl)-1,2,3,3a,4,11c- hexahydronaphtho[2',1':2,3]pyrano[4,5-b]pyrrole-2-carboxylate","","- C26 H24 N2 O3 -","- C26 H24 N2 O3 -","- C104 H96 N8 O12 -","4","1","BT6667","S. Karthick; S. Selvanayagam; D. Velmurugan; K. Ravikumar; M. Arumugam; R. Raghunathan","Methyl 2-(1<i>H</i>-indol-3-ylmethyl)-1,2,3,3a,4,11c-hexahydronaphtho[2',1':2,3]pyrano[4,5-<i>b</i>]pyrrole-2-carboxylate","Acta Crystallographica Section E","2005","61","6","o1780","o1782","10.1107/S1600536805015114","","","0.71073","MoKα","","0.0628","0.0504","","","0.1502","0.1623","","","","","","1.012","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205876","8.0256","0.0012","33.58","0.005","8.0957","0.0011","90","","111.566","0.005","90","","2029.1","0.5","291","1","291","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl (E,Z)-α-(methoxyimino)-2-[({1-[3- (trifluoromethyl)phenyl]ethylidene}amino)oxymethyl]benzeneacetate","","- C20 H19 F3 N2 O4 -","- C20 H19 F3 N2 O4 -","- C80 H76 F12 N8 O16 -","4","1","BT6668","Banerjee, Kaushik; Ligon, Axel Patrick; Schürmann, Markus; Preut, Hans; Spiteller, Michael","Methyl (<i>E,Z</i>)-α-(methoxyimino)-2-[({1-[3-(trifluoromethyl)phenyl]ethylidene}amino)oxymethyl]benzeneacetate","Acta Crystallographica Section E","2005","61","6","o1752","o1753","10.1107/S1600536805014972","","","0.71073","MoKα","","0.0899","0.0361","","","0.0686","0.0728","","","","","","0.978","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205877","7.7602","0.0011","9.8884","0.0014","13.965","0.002","108.074","0.002","94.933","0.002","109.974","0.002","935.1","0.2","273","2","273","2","","","","","","","","3","P -1","-P 1","2","","8,12-Dioxa-1,7,10(1,2)-tribenzenacyclododecaphane-2,5-dien-4-one","","- C25 H20 O3 -","- C25 H20 O3 -","- C50 H40 O6 -","2","1","BT6669","V. Vinodhkumar; S. Selvanayagam; D. Velmurugan; K. Ravikumar; M. Poornachandran; R. Raghunathan","8,12-Dioxa-1,7,10(1,2)-tribenzenacyclododecaphane-2,5-dien-4-one","Acta Crystallographica Section E","2005","61","6","o1839","o1841","10.1107/S1600536805015631","","","0.71073","MoKα","","0.0604","0.0513","","","0.1432","0.1523","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205878","10.006","0.002","10.801","0.002","17.705","0.004","89.63","0.03","83.97","0.03","69.75","0.03","1784.3","0.7","200","2","200","2","","","","","","","","3","P -1","-P 1","2","","33,5,9,12-Tetra-tert-butyl-10,14-dicyclohexyl-2,8- dioxatetracyclo[5.4.0.2^1,9^.1^3,7^]tetradeca-4,12-diene-6,11-dione","","- C40 H62 O4 -","- C40 H62 O4 -","- C80 H124 O8 -","2","1","BT6670","Meindl, Kathrin; Maslovskaya, Lidiya A.; Noltemeyer, Mathias; Savchenko, Andrei I.","3,5,9,12-Tetra-<i>tert</i>-butyl-10,14-dicyclohexyl-2,8-dioxatetracyclo[5.4.0.2^1,9^.1^3,7^]tetradeca-4,12-diene-6,11-dione","Acta Crystallographica Section E","2005","61","6","o1950","o1952","10.1107/S1600536805016582","","","0.71073","MoKα","","0.0666","0.0525","","","0.1293","0.1428","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205879","7.329","0.003","10.168","0.005","10.66","0.005","67.126","0.005","80.663","0.008","71.7","0.008","694.2","0.6","130","2","130","2","","","","","","","","4","P -1","-P 1","2","diethylaminium 3,5-dinitrosalicylate","Diethylaminium 3,5-dinitrosalicylate","","- C11 H15 N3 O7 -","- C11 H15 N3 O7 -","- C22 H30 N6 O14 -","2","1","BT6671","Graham Smith; Urs D. Wermuth; Jonathan M. White","Diethylaminium 3,5-dinitrosalicylate at 130K","Acta Crystallographica Section E","2005","61","6","o1836","o1838","10.1107/S1600536805015199","","","0.71073","MoKα","","0.0757","0.0648","","","0.1868","0.1954","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205880","35.035","0.006","5.8335","0.001","16.049","0.003","90","","116.837","0.002","90","","2926.8","0.9","290","2","290","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[bis(benzotriazolato)di-μ-oxo-lead(II)]","","- C12 H8 N6 O2 Pb2 -","- C12 H8 N6 O2 Pb2 -","- C96 H64 N48 O16 Pb16 -","8","1","CF6406","V. C. Sharma; U. Lal; Tej Singh; Deepak Chopra; T. N. Guru Row","Poly[bis(benzotriazolato)di-μ-oxo-dilead(II)]","Acta Crystallographica Section E","2005","61","6","m1108","m1110","10.1107/S160053680501439X","","","0.71073","MoKα","","0.0605","0.0558","","","0.1823","0.188","","","","","","1.132","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205881","9.5847","0.0017","14.953","0.003","14.508","0.003","90","","99.694","0.004","90","","2049.6","0.7","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dichlorobis(1,10-phenanthroline)mercury(II)","","- C24 H16 Cl2 Hg N4 -","- C24 H16 Cl2 Hg N4 -","- C96 H64 Cl8 Hg4 N16 -","4","1","CF6415","Ramezanipour, Farshid; Aghabozorg, Hossein; Soleimannejad, Janet","Dichlorobis(1,10-phenanthroline)mercury(II)","Acta Crystallographica Section E","2005","61","6","m1194","m1196","10.1107/S1600536805015813","","","0.71073","MoKα","","0.0394","0.0367","","","0.0877","0.0895","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205882","10.521","0.003","16.629","0.005","14.08","0.004","90","","105.315","0.005","90","","2375.9","1.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-{[(1Z)-(3-methyl-5-oxo-1-phenyl-1,5-dihydropyrazol-4- ylidene)(phenyl)methyl]amino}-3-phenylpropanoate","","- C28 H27 N3 O3 -","- C28 H27 N3 O3 -","- C112 H108 N12 O12 -","4","1","CF6420","Xin Zhang; Hua-Ling Zhu; Hai-Zhen Xu; Mei Dong","Ethyl 2-{[(1<i>Z</i>)-(3-methyl-5-oxo-1-phenyl-1,5-dihydropyrazol-4-ylidene)(phenyl)methyl]amino}-3-phenylpropanoate","Acta Crystallographica Section E","2005","61","6","o1629","o1630","10.1107/S1600536805014182","","","0.71073","MoKα","","0.0948","0.0511","","","0.1097","0.1298","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205883","15.194","0.0015","15.908","0.003","13.227","0.002","90","","90","","90","","3197","0.8","120","2","120","2","","","","","","","","5","P c a 21","P 2c -2ac","29","calcium nitrate(15-crown-5)","Bis(nitrato-κ^2^O,O')(1,4,7,10,13-pentaoxacyclopentadecane)calcium(II)","","- C10 H20 Ca N2 O11 -","- C10 H20 Ca N2 O11 -","- C80 H160 Ca8 N16 O88 -","8","2","CF6421","Brown, Michael D.; Levason, William; Webster, Michael","Bis(nitrato-κ^2^<i>O,O</i>')(1,4,7,10,13-pentaoxacyclopentadecane)calcium(II)","Acta Crystallographica Section E","2005","61","6","m1015","m1017","10.1107/S1600536805012973","","","0.71073","MoKα","","0.0516","0.0402","","","0.0832","0.0887","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205884","11.979","0.002","5.202","0.001","19.773","0.003","90","","92.22","0.02","90","","1231.2","0.4","292","2","292","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(3-Chlorophenyl)chroman-4-one","","- C15 H11 Cl O2 -","- C15 H11 Cl O2 -","- C60 H44 Cl4 O8 -","4","1","CF6422","Hui Wu; Zhou Xu; Yu Wan; Yongmin Liang; Kaibei Yu","2-(3-Chlorophenyl)chroman-4-one","Acta Crystallographica Section E","2005","61","6","o1692","o1693","10.1107/S1600536805014637","","","0.71073","MoKα","","0.0757","0.0366","","","0.0739","0.0832","","","","","","0.872","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205885","9.2012","0.0001","16.9571","0.0003","26.3555","0.0004","90","","90","","90","","4112.13","0.11","190","","190","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-Acetamido-N-benzyl-1,4-imino-1,2,4-trideoxy-L-arabinitol","","- C14 H20.67 N2 O3.33 -","- C14 H20.6667 N2 O3.33333 -","- C168 H248 N24 O40 -","12","3","CF6423","Christopher C. Harding; J.S Shane Rountree; David J. Watkin; Andrew R. Cowley; Terry D. Butters; Mark R. Wormald; Raymond A. Dwek; George W. J. Fleet","2-Acetamido-<i>N</i>-benzyl-1,4-imino-1,2,4-trideoxy-<small>L</small>-arabinitol 0.33-hydrate","Acta Crystallographica Section E","2005","61","6","o1683","o1685","10.1107/S1600536805014455","","","0.71073","MoKα","","0.0893","0.0464","","0.1116","0.0961","0.1116","","","","","","0.8135","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205886","6.6195","0.0002","10.4127","0.0003","16.3294","0.0007","90","","90","","90","","1125.53","0.07","190","","190","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2R,3R,4R)-Methyl 2-bromo-3,4-dihydroxy-3,4-O-isopropylidenetetrahydrofuran- 2-carboxylate","","- C9 H13 Br O5 -","- C9 H13 Br O5 -","- C36 H52 Br4 O20 -","4","1","CF6424","Probert, Michael R.; Watkin, David J.; Stewart, Alistair J.; Storer, Richard; Fleet, George W. J.","(2<i>R</i>,3<i>R</i>,4<i>R</i>)-Methyl 2-bromo-3,4-dihydroxy-3,4-<i>O</i>-isopropylidenetetrahydrofuran-2-carboxylate","Acta Crystallographica Section E","2005","61","6","o1718","o1720","10.1107/S1600536805014467","","","0.71073","MoKα","","0.0501","0.0501","","0.097","0.097","0.097","","","","","","0.9731","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205887","10.0697","0.0013","12.7025","0.0017","10.7016","0.0014","90","","94.706","0.002","90","","1364.2","0.3","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis(ethyldiphenylphosphino)ethylenediamine P,P'-dioxide","","- C30 H34 N2 O2 P2 -","- C30 H34 N2 O2 P2 -","- C60 H68 N4 O4 P4 -","2","0.5","CF6425","Sevil Irisli; Ayten Sen","<i>N</i>,<i>N</i>'-Bis(ethyldiphenylphosphino)ethylenediamine <i>P</i>,<i>P</i>'-dioxide","Acta Crystallographica Section E","2005","61","6","o1939","o1941","10.1107/S160053680501665X","","","0.71073","MoKα","","0.0741","0.0584","","","0.1342","0.1433","","","","","","1.084","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205888","12.07","0.002","7.7088","0.0015","7.3332","0.0015","90","","91.42","0.03","90","","682.1","0.2","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Poly[[dimethanolmagnesium(II)]-μ-p-phenylenedioxydiacetato]","","- C12 H16 Mg O8 -","- C12 H16 Mg O8 -","- C24 H32 Mg2 O16 -","2","0.5","CF6426","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui","Poly[[dimethanolmagnesium(II)]-μ-<i>p</i>-phenylenedioxydiacetato]: a three-dimensional magnesium(II) coordination polymer","Acta Crystallographica Section E","2005","61","6","m1117","m1119","10.1107/S1600536805014625","","","0.71073","MoKα","","0.0765","0.0628","","","0.1591","0.1664","","","","","","1.082","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205889","13.819","0.002","21.354","0.003","21.991","0.003","90","","128.931","0.006","90","","5048.1","1.3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Diisopropyl {(4-methylbenzothiazol-2-ylamino)[4-(trifluoromethyl)phenyl]methyl}phosphonate","","- C22 H26 F3 N2 O3 P S -","- C22 H26 F3 N2 O3 P S -","- C176 H208 F24 N16 O24 P8 S8 -","8","2","CI6544","Song, Yang; Baoan, Song; Guoping, Zhang; Linhong, Jin; Deyu, Hu; Wei, Xue","Diisopropyl {(4-methylbenzothiazol-2-ylamino)[4-(trifluoromethyl)phenyl]methyl}phosphonate","Acta Crystallographica Section E","2005","61","6","o1662","o1664","10.1107/S1600536805014327","","","0.71073","MoKα","","0.2144","0.0615","","","0.1565","0.228","","","","","","0.934","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205890","16.244","0.002","7.767","0.0008","15.3043","0.0019","90","","90","","90","","1930.9","0.4","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","poly[bis(N-methylformamide)tetra-μ-thiocyanato-cadmium(II)mercury(II)]","","- C8 H10 Cd Hg N6 O2 S4 -","- C8 H10 Cd Hg N6 O2 S4 -","- C32 H40 Cd4 Hg4 N24 O8 S16 -","4","1","CI6548","Wang, Xin Qiang; Yu, Wen Tao; Xu, Dong; Zhang, Guang Hui","Polymeric bis(<i>N</i>-methylformamide)tetrathiocyanatocadmium(II)mercury(II)","Acta Crystallographica Section E","2005","61","6","m1147","m1149","10.1107/S1600536805015394","","","0.71069","MoKα","","0.0716","0.0409","","","0.0713","0.0807","","","","","","0.969","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205891","13.9158","0.0007","14.8078","0.0008","26.3807","0.0014","90","","90","","90","","5436.1","0.5","291","2","293","2","","","","","","","","3","C 2 2 21","C 2c 2","20","Incanilin","(20S,24R)-Incanilin","","- C30 H48 O4 -","- C30 H48 O4 -","- C240 H384 O32 -","8","1","CI6569","Hernández-Ortega, Simón; Parra Delgado, Hortensia; Martínez, Mariano","Incaniline (isoargentatin A) from <i>Parthenium argentatum</i>","Acta Crystallographica Section E","2005","61","6","o1921","o1923","10.1107/S1600536805016429","","","0.71073","MoKα","","0.0618","0.0494","","","0.1114","0.1166","","","","","","1.024","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205892","10.6759","0.0006","6.9487","0.0004","16.4346","0.0006","90","","102.164","0.003","90","","1191.81","0.11","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ethyl (E)-4-(2-formylphenoxy)but-2-enoate","","- C13 H14 O4 -","- C13 H14 O4 -","- C52 H56 O16 -","4","1","CI6571","Williamson, Craig; Storey, John M. D.; Harrison, William T. A.","Ethyl (<i>E</i>)-4-(2-formylphenoxy)but-2-enoate","Acta Crystallographica Section E","2005","61","6","o1566","o1568","10.1107/S1600536805013164","","","0.71073","MoKα","","0.0847","0.0478","","","0.1091","0.1262","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205893","13.905","0.002","17.965","0.003","20.505","0.004","90","","101.026","0.007","90","","5027.7","1.5","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(4-Bromophenyl)-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazolo[3,4-b]pyridine- 6(7H)-one","","- C19 H16 Br N3 O -","- C19 H16 Br N3 O -","- C228 H192 Br12 N36 O12 -","12","3","CI6572","Feng Shi; Shu-Jiang Tu; Song-Lei Zhu","4-(4-Bromophenyl)-3-methyl-1-phenyl-4,5-dihydro-1<i>H</i>-pyrazolo[3,4-<i>b</i>]pyridin-6(7<i>H</i>)-one","Acta Crystallographica Section E","2005","61","6","o1601","o1603","10.1107/S1600536805014029","","","0.7107","MoKα","","0.0905","0.0788","","","0.1517","0.1568","","","","","","1.13","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205894","25.429","0.009","8.209","0.005","10.502","0.006","90","","95.595","0.009","90","","2182","2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1-phenyl-3-(1H-1,2,4-triazol-1-yl)propan-1-one hemihydrate","","- C11 H12 N3 O1.5 -","- C11 H12 N3 O1.5 -","- C88 H96 N24 O12 -","8","1","CI6573","Jun Wan; Chun-Li Li; Xue-Mei Li; Shu-Sheng Zhang; Hong Xu; Ping-Kai Ouyang","1-Phenyl-3-(1<i>H</i>-1,2,4-triazol-1-yl)propan-1-one hemihydrate","Acta Crystallographica Section E","2005","61","6","o1641","o1642","10.1107/S1600536805013358","","","0.71073","MoKα","","0.0552","0.0451","","","0.1155","0.1231","","","","","","1.053","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205895","14.979","0.003","13.609","0.003","25.164","0.005","90","","90","","90","","5129.7","1.8","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Bis(5-bromo-N-cyclohexylsalicylideneaminato)nickel(II)","","- C26 H30 Br2 N2 Ni O2 -","- C26 H30 Br2 N2 Ni O2 -","- C208 H240 Br16 N16 Ni8 O16 -","8","1","CI6575","Sun, Yu-Xi; Yang, Guang; Chen, Guang; Sun, Min; Zhang, Hong-Lin","Bis(5-bromo-<i>N</i>-cyclohexylsalicylideneaminato)nickel(II): an orthorhombic polymorph","Acta Crystallographica Section E","2005","61","6","m1103","m1104","10.1107/S1600536805014339","","","0.71073","MoKα","","0.0977","0.0488","","","0.1155","0.138","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205896","14.4737","0.0005","14.6771","0.0005","15.1822","0.0006","90","","106.877","0.001","90","","3086.28","0.19","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Tetrakis(4-amino-3-methylpyridine)diisothiocyanatocadmium(II)","Tetrakis(4-amino-3-methylpyridine)diisothiocyanatocadmium(II)","","- C26 H32 Cd N10 S2 -","- C26 H32 Cd N10 S2 -","- C104 H128 Cd4 N40 S8 -","4","0.5","CI6576","Xiao-Jun Feng; Suchada Chantrapromma; Hoong-Kun Fun; Yu-Peng Tian","Tetrakis(4-amino-3-methylpyridine)diisothiocyanatocadmium(II)","Acta Crystallographica Section E","2005","61","6","m1077","m1079","10.1107/S1600536805013978","","","0.71073","MoKα","","0.0238","0.0213","","","0.0564","0.0586","","","","","","1.116","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205897","8.1669","0.0008","24.11","0.002","14.4666","0.0014","90","","104.057","0.002","90","","2763.2","0.4","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","3β-hydroxylupan-29-oic acid","2-(9-hydroxy-3a,5a,5b,8,8,11a-(hexamethylicosahydro-1H-cyclopenta[a]chrysen- 1-yl)propanoic acid","","- C30 H50 O3 -","- C30 H50 O3 -","- C120 H200 O12 -","4","2","CI6578","Pakakrong Thongdeeying; Suchada Chantrapromma; Hoong-Kun Fun; Shazia Anjum; Shamsher Ali; Chanita Ponglimanont","2-(9-Hydroxy-3a,5a,5b,8,8,11a-hexamethylicosahydro-1<i>H</i>-cyclopenta[<i>a</i>]chrysen-1-yl)propanoic acid (3β-hydroxylupan-29-oic acid)","Acta Crystallographica Section E","2005","61","6","o1861","o1863","10.1107/S1600536805015606","","","0.71073","MoKα","","0.0936","0.0531","","","0.0996","0.1168","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205898","8.5129","0.0013","30.047","0.004","11.1308","0.0018","90","","90","","90","","2847.1","0.7","293","","293","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-[(4-Phenylthiazol-2-yl)hydrazonomethyl]phenol","","- C16 H13 N3 O S -","- C16 H13 N3 O S -","- C128 H104 N24 O8 S8 -","8","1","CI6579","Dinçer, Muharrem; Özdemir, Namık; Çukurovalı, Alaaddin; Yılmaz, İbrahim","2-[(4-Phenylthiazol-2-yl)hydrazonomethyl]phenol","Acta Crystallographica Section E","2005","61","6","o1712","o1714","10.1107/S1600536805014418","","","0.71073","MoKα","","0.1699","0.0494","","","0.0707","0.0965","","","","","","0.905","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205899","20.1618","0.0004","11.9426","0.0003","11.3334","0.0002","90","","92.08","0.001","90","","2727.11","0.1","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(4-methoxylbenzoato)phenyl(trimethylsilylmethyl)tin(IV)","","- C26 H30 O6 Si Sn -","- C26 H30 O6 Si Sn -","- C104 H120 O24 Si4 Sn4 -","4","1","CI6580","Lin, Sen; Fu, Zhi-Fei; Fang, Xiao-Niu; Liu, Huan-Yu","Bis(4-methoxylbenzoato)phenyl(trimethylsilylmethyl)tin(IV)","Acta Crystallographica Section E","2005","61","6","m1161","m1162","10.1107/S1600536805015370","","","0.71073","MoKα","","0.0418","0.03","","","0.0827","0.0912","","","","","","1.009","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205900","13.66","0.0007","6.5247","0.0003","17.5754","0.0009","90","","111.726","0.001","90","","1455.18","0.13","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","5,7-Dihydroxy-6,2'-dimethoxyisoflavone","","- C17 H14 O6 -","- C17 H14 O6 -","- C68 H56 O24 -","4","1","CI6582","Nighat Sultana; M. Iqbal Choudhary; Shamsher Ali; Shazia Anjum; Hoong-Kun Fun; Atta-ur-Rahman","5,7-Dihydroxy-6,2'-dimethoxyisoflavone","Acta Crystallographica Section E","2005","61","6","o1812","o1814","10.1107/S1600536805015187","","","0.71073","MoKα","","0.0499","0.0385","","","0.099","0.1082","","","","","","1.037","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205901","5.6753","0.0011","7.795","0.0016","16.368","0.003","93.02","0.03","96","0.03","90.52","0.03","719.1","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","1,4-Bis(phenylsulfanyl)butane","","- C16 H18 S2 -","- C16 H18 S2 -","- C32 H36 S4 -","2","1","CI6585","Chen, Wei; Hou, Bao-Hong; Zhou, Li-Na; Wang, Jing-Kang; Li, Hong","1,4-Bis(phenylsulfanyl)butane","Acta Crystallographica Section E","2005","61","6","o1890","o1891","10.1107/S1600536805016120","","","0.71073","MoKα","","0.0929","0.0595","","","0.1661","0.2008","","","","","","0.959","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205902","7.806","0.002","9.901","0.003","29.307","0.008","90","","90","","90","","2265.1","1.1","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-(2-Nitrophenyl)-1H-benzimidazole","","- C13 H9 N3 O2 -","- C13 H9 N3 O2 -","- C104 H72 N24 O16 -","8","1","CI6588","Xue-Mei Li; Li-Ping Du; Ying Li; Shu-Sheng Zhang","2-(2-Nitrophenyl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2005","61","6","o1902","o1903","10.1107/S1600536805016417","","","0.71073","MoKα","","0.0567","0.0438","","","0.1047","0.1129","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205903","7.0484","0.0015","10.3371","0.0019","22.174","0.004","90","","98.547","0.006","90","","1597.7","0.5","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Amino-4-(4-chlorophenyl)-6-morpholinopyridine-3,5-dicarbonitrile","","- C17 H14 Cl N5 O -","- C17 H14 Cl N5 O -","- C68 H56 Cl4 N20 O4 -","4","1","CI6589","Shu-Jiang Tu; Tuan-Jie Li; Song-Lei Zhu; Xiang Zou; Qian Wang","2-Amino-4-(4-chlorophenyl)-6-morpholinopyridine-3,5-dicarbonitrile","Acta Crystallographica Section E","2005","61","6","o1883","o1884","10.1107/S1600536805016296","","","0.7107","MoKα","","0.0502","0.0409","","","0.0901","0.0952","","","","","","1.067","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205904","12.857","0.003","7.066","0.0012","13.541","0.0012","90","","109.56","0.017","90","","1159.2","0.4","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Prop-2-ynyl 3-(3,4-dihydroxyphenyl)prop-2-enoate monohydrate","","- C12 H12 O5 -","- C12 H12 O5 -","- C48 H48 O20 -","4","1","CV6482","Chun-Nian Xia; Wei Zhou; Wei-Xiao Hu","Prop-2-ynyl 3-(3,4-dihydroxyphenyl)prop-2-enoate monohydrate","Acta Crystallographica Section E","2005","61","6","o1783","o1784","10.1107/S1600536805014340","","","0.71073","MoKα","","0.0606","0.0338","","","0.0863","0.1009","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205905","25.564","0.001","4.141","0.002","15","0.002","90","","103.08","0.02","90","","1546.7","0.8","300","2","300","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N-Hydroxy-4,5-dimethylthiazole-2(3H)-thione hemihydrate","","- C5 H8 N O1.5 S2 -","- C5 H8 N O1.5 S2 -","- C40 H64 N8 O12 S16 -","8","1","CV6486","Hartung, Jens; Daniel, Kristina; Gottwald, Thomas; Svoboda, Ingrid; Fuess, Hartmut","<i>N</i>-Hydroxy-4,5-dimethylthiazole-2(3<i>H</i>)-thione hemihydrate","Acta Crystallographica Section E","2005","61","6","o1741","o1743","10.1107/S1600536805013851","","","0.71073","MoKα","","0.0461","0.0426","","","0.1157","0.1192","","","","","","1.061","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205906","29.4926","0.0015","10.1678","0.0003","19.7293","0.0003","90","","115.389","0.002","90","","5344.9","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(dimethylformamide)-2κ^2^O-dipyridine-1κN,3κN-bis(μ-2'-salicylbenzohydrazidato)-1κ^4^O,N,N',O':2κ^2^N,O'';2κ^2^N,O'':3κ^4^O,N,N',O'-trinickel(II) dimethylformamide disolvate hemihydrate","","- C50 H57 N10 Ni3 O10.5 -","- C50 H57 N10 Ni3 O10.5 -","- C200 H228 N40 Ni12 O42 -","4","0.5","CV6487","Ming-Xing Yang; Shen Lin","Bis(dimethylformamide-2κ<i>O</i>)dipyridine-1κ<i>N</i>,3κ<i>N</i>-bis(μ-2'-salicylbenzohydrazidato)-1κ^3^<i>O</i>,<i>N</i>,<i>O</i>':2κ^2^<i>N</i>,<i>O</i>'';2κ^2^<i>N</i>,<i>O</i>'':3κ^3^<i>O</i>,<i>N</i>,<i>O</i>'-trinickel(II) dimethylformamide disolvate hemihydrate","Acta Crystallographica Section E","2005","61","6","m1095","m1096","10.1107/S1600536805013875","","","0.71073","MoKα","","0.0729","0.0471","","","0.1245","0.1371","","","","","","0.981","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205907","6.227","0.001","8.36","0.001","11.624","0.003","76","0.02","78.4","0.02","75.05","0.02","561","0.2","299","2","299","2","","","","","","","","5","P -1","-P 1","2","","4-Methyl-5-(p-methoxyphenyl)thiazole-2(3H)-thione","","- C11 H11 N O S2 -","- C11 H11 N O S2 -","- C22 H22 N2 O2 S4 -","2","1","CV6488","Hartung, Jens; Daniel, Kristina; Svoboda, Ingrid; Fuess, Hartmut","5-(4-Methoxyphenyl)-4-methylthiazole-2(3<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","6","o1744","o1746","10.1107/S1600536805013863","","","0.71073","MoKα","","0.1196","0.0413","","","0.07","0.0877","","","","","","0.856","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205908","10.8255","0.0003","17.9119","0.0005","15.0647","0.0004","90","","90.423","0.001","90","","2921.05","0.14","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetraethylammonium bis(benzene-1,2-dithiolato)(2-disulfanylbenzenethiolato)niobate","","- C26 H32 N Nb S7 -","- C26 H32 N Nb S7 -","- C104 H128 N4 Nb4 S28 -","4","1","CV6492","Petrov, Pavel A.; Kuratieva, Natalia V.; Naumov, Dmitry Yu.; Konchenko, Sergei N.","Tetraethylammonium bis(benzene-1,2-dithiolato)(2-disulfanylbenzenethiolato)niobate","Acta Crystallographica Section E","2005","61","6","m1138","m1139","10.1107/S1600536805012869","","","0.71073","MoKα","","0.0404","0.0307","","","0.0777","0.0815","","","","","","1.04","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205909","7.656","0.003","10.707","0.005","10.933","0.005","73.065","0.006","84.573","0.007","86.058","0.007","852.7","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Chloro(pyridine-4-carbonitrile-κN^1^)(1,4,7-triazacyclononane- κ^3^N,N',N'')copper(II) perchlorate","","- C12 H19 Cl2 Cu N5 O4 -","- C12 H19 Cl2 Cu N5 O4 -","- C24 H38 Cl4 Cu2 N10 O8 -","2","1","CV6493","Yu-Hu Wang; Zhao-Dong Wang; Bin Li; Jie Qu; Xin Liu; Wen Gu; Wen-Zhen Wang","Chloro(pyridine-4-carbonitrile-κ<i>N</i>^1^)(1,4,7-triazacyclononane-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')copper(II) perchlorate","Acta Crystallographica Section E","2005","61","6","m1101","m1102","10.1107/S1600536805012870","","","0.71073","MoKα","","0.0466","0.0331","","","0.0799","0.0863","","","","","","1.017","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205910","10.8458","0.0006","17.0539","0.0009","25.9179","0.0013","90","","90","","90","","4793.9","0.4","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","catena-Poly[[diaqua(1,4,7,10,13,16-hexaoxacyclooctadecane)barium(II)]- μ-cyano-[dicyanoplatinum(II)]-μ-cyano]","","- C16 H28 Ba N4 O8 Pt -","- C16 H28 Ba N4 O8 Pt -","- C128 H224 Ba8 N32 O64 Pt8 -","8","1","CV6494","Olmstead, Marilyn M.; Lee, Moses A.; Stork, Jay R.","<i>catena</i>-Poly[[diaqua(1,4,7,10,13,16-hexaoxacyclooctadecane)barium(II)]-μ-cyano-[dicyanoplatinum(II)]-μ-cyano]","Acta Crystallographica Section E","2005","61","6","m1048","m1050","10.1107/S1600536805013887","","","0.71073","MoKα","","0.0291","0.018","","","0.0356","0.0394","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205911","7.5517","0.0007","11.3022","0.0012","13.4646","0.0013","90","","95.186","0.008","90","","1144.5","0.2","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Hydroxy-6-[(2-methoxyphenyl)aminomethylene]cyclohexa-2,4-dienone","","- C14 H13 N O3 -","- C14 H13 N O3 -","- C56 H52 N4 O12 -","4","1","CV6500","Şahin, Onur; Büyükgüngör, Orhan; Albayrak, Çiğdem; Odabaşoğlu, Mustafa","2-Hydroxy-6-[(2-methoxyphenyl)aminomethylene]cyclohexa-2,4-dienone","Acta Crystallographica Section E","2005","61","6","o1579","o1581","10.1107/S160053680501319X","","","0.71073","MoKα","","0.0792","0.0379","","","0.0844","0.0958","","","","","","0.846","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205912","12.267","0.003","13.083","0.003","20.919","0.006","90","","92.423","0.005","90","","3354.3","1.5","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis{5-amino-3-cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazol-4- yl}disulfide acetonitrile disolvate","","- C26 H14 Cl4 F6 N10 S2 -","- C26 H14 Cl4 F6 N10 S2 -","- C104 H56 Cl16 F24 N40 S8 -","4","0.5","CV6501","Tang, Ri-Yuan; Zhong, Ping; Li, Shu-Yan; Hu, Mao-Lin","Bis{5-amino-3-cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1<i>H</i>-pyrazol-4-yl} disulfide acetonitrile disolvate","Acta Crystallographica Section E","2005","61","6","o1564","o1565","10.1107/S1600536805013085","","","0.71073","MoKα","","0.0687","0.06","","","0.1634","0.1709","","","","","","1.038","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205913","9.5674","0.0002","11.702","0.0003","22.2785","0.0004","90","","90","","90","","2494.25","0.09","150","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-(10,11-Dihydrodibenz[b,f]azepin-5-yl)ethanone","","- C16 H15 N O -","- C16 H15 N O -","- C128 H120 N8 O8 -","8","2","CV6502","Basavegowda Nagaraj; Hemmige S. Yathirajan; Daniel E. Lynch","1-(10,11-Dihydrodibenz[<i>b</i>,<i>f</i>]azepin-5-yl)ethanone","Acta Crystallographica Section E","2005","61","6","o1609","o1610","10.1107/S1600536805013115","","","0.71073","MoKα","","0.0386","0.0314","","","0.0726","0.0763","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205914","9.357","0.004","12.439","0.002","13.103","0.003","116.8","0.017","108.38","0.02","80.91","0.02","1291.6","0.7","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Diphenyl 3,6-bis(4-chlorophenyl)-1,2-dihydro-1,2,4,5-tetrazine-1,2-dicarboxylate","","- C28 H18 Cl2 N4 O4 -","- C28 H18 Cl2 N4 O4 -","- C56 H36 Cl4 N8 O8 -","2","1","CV6503","Guang-Xiang Zhong; Lu-Ping Lv; Guo-Wu Rao; Weixiao Hu","Diphenyl 3,6-bis(4-chlorophenyl)-1,2-dihydro-1,2,4,5-tetrazine-1,2-dicarboxylate","Acta Crystallographica Section E","2005","61","6","o1552","o1553","10.1107/S1600536805013607","","","0.71073","MoKα","","0.0978","0.0347","","","0.0867","0.107","","","","","","1.02","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205915","24.083","0.003","7.784","0.003","24.461","0.004","90","","90.7","0.01","90","","4585","2","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3,6-Dipropyl-N,N'-di-o-tolyl-1,2,4,5-tetrazine-1,4-dicarboxamide","","- C24 H30 N6 O2 -","- C24 H30 N6 O2 -","- C192 H240 N48 O16 -","8","1","CV6504","Luping Lv; Guan-Xiang Zhong; Wei-Xiao Hu; Wei Zhou; Hai-Bo Shi","3,6-Dipropyl-<i>N,N</i>'-di-<i>o</i>-tolyl-1,2,4,5-tetrazine-1,4-dicarboxamide","Acta Crystallographica Section E","2005","61","6","o1622","o1623","10.1107/S1600536805013930","","","0.71073","MoKα","","0.1613","0.0674","","","0.2269","0.261","","","","","","1.189","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205916","6.952","0.002","8.522","0.003","30.12","0.009","90","","90","","90","","1784.5","1","292","","292","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-Carboxymethyl-2-(hydroxyquinolin-4-ylmethyl)-5-vinyl-1- azoniabicyclo[2.2.2]octane","","- C21 H24 N2 O3 -","- C21 H24 N2 O3 -","- C84 H96 N8 O12 -","4","1","CV6507","Li-Ping Zhang; Jian Lv; Yi , Li; Yong-Mei Wang","1-Carboxylatomethyl-2-(hydroxyquinolin-4-ylmethyl)-5-vinyl-1-azoniabicyclo[2.2.2]octane, a zwitterion of the Cinchona alkaloid complex","Acta Crystallographica Section E","2005","61","6","o1855","o1857","10.1107/S1600536805015709","","","0.71073","MoKα","","0.093","0.0605","","","0.1075","0.117","","","","","","1.084","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205917","8.6112","0.0009","21.669","0.002","8.1152","0.0008","90","","106.82","0.002","90","","1449.5","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(1H-1,2,3-Benzotriazol-1-yl)-1-(4-methoxyphenyl)propan-1-one","","- C16 H15 N3 O2 -","- C16 H15 N3 O2 -","- C64 H60 N12 O8 -","4","1","CV6508","Shu-Sheng Zhang; Jun Wan; Ying Li; Xue-Mei Li; Hong Xu; Ping-Kai Ouyang","3-(1<i>H</i>-1,2,3-Benzotriazol-1-yl)-1-(4-methoxyphenyl)propan-1-one","Acta Crystallographica Section E","2005","61","6","o1793","o1794","10.1107/S1600536805015126","","","0.71073","MoKα","","0.0519","0.0419","","","0.1078","0.1149","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205918","9.1761","0.0008","9.5962","0.0008","11.9113","0.001","72.526","0.001","78.339","0.002","82.942","0.002","977.63","0.14","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N,N-Diphenyl-2-(quinolin-8-yloxy)acetamide monohydrate","","- C23 H20 N2 O3 -","- C23 H20 N2 O3 -","- C46 H40 N4 O6 -","2","1","CV6509","Yong-Hong Wen; Shu-Sheng Zhang; Mao-Jie Li; Xue-Mei Li","<i>N</i>,<i>N</i>-Diphenyl-2-(quinolin-8-yloxy)acetamide monohydrate","Acta Crystallographica Section E","2005","61","6","o1807","o1809","10.1107/S1600536805015357","","","0.71073","MoKα","","0.064","0.0463","","","0.108","0.1202","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205919","11.0566","0.0016","11.3596","0.0017","11.4916","0.0017","117.554","0.002","99.937","0.003","102.83","0.002","1182.7","0.3","292","2","292","2","","","","","","","","4","P -1","-P 1","2","","Propyl 3,5-dinitrobenzoate","","- C10 H10 N2 O6 -","- C10 H10 N2 O6 -","- C40 H40 N8 O24 -","4","2","CV6511","Jin Longfei; Xiao Fengping","Propyl 3,5-dinitrobenzoate","Acta Crystallographica Section E","2005","61","6","o1826","o1827","10.1107/S160053680501528X","","","0.71073","MoKα","","0.0833","0.0557","","","0.1325","0.1515","","","","","","0.973","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205920","10.074","0.002","5.6289","0.0012","13.969","0.003","90","","110.074","0.004","90","","744","0.3","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","2-(3-Benzoylthioureido)ethanoic acid dimethyl sulfoxide solvate","","- C12 H16 N2 O4 S2 -","- C12 H16 N2 O4 S2 -","- C24 H32 N4 O8 S4 -","2","1","CV6512","Ngah, Nurziana; Shah, Nabihah M.; Kassim, Mohammad B.; Yamin, Bohari M.","2-(3-Benzoylthioureido)ethanoic acid dimethyl sulfoxide solvate","Acta Crystallographica Section E","2005","61","6","o1910","o1912","10.1107/S1600536805016491","","","0.71073","MoKα","","0.037","0.033","","","0.076","0.077","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205921","8.822","0.0011","11.641","0.002","21.504","0.003","75.865","0.011","87.731","0.01","72.474","0.012","2040.7","0.5","120","2","120","2","","","","","","","","3","P -1","-P 1","2","Osajin","5-hydroxy-3-(3-hydroxyphenyl)-8,8-dimethyl-6-(3-methylbut-2-enyl)- 4H,8H-pyrano[2,3-h]chromen-4-one","","- C25 H24 O5 -","- C25 H24 O5 -","- C100 H96 O20 -","4","2","CV6513","Lišková, Margita; Marek, Jaromír; Jankovská, Dagmar; Sukupová, Lada; Žemlička, Milan; Vančo, Jan","Osajin","Acta Crystallographica Section E","2005","61","6","o1848","o1850","10.1107/S1600536805015667","","","0.71073","MoKα","","0.1057","0.0486","","","0.109","0.1247","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205922","8.996","0.005","9.387","0.005","14.137","0.005","96.55","0.005","103.623","0.005","101.722","0.005","1119.5","0.9","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Carbonyl(triphenylarsine)(tropolonato)rhodium(I).","","- C26 H20 As O3 Rh -","- C26 H20 As O3 Rh -","- C52 H40 As2 O6 Rh2 -","2","1","CV6514","Steyl, Gideon; Roodt, Andreas","Carbonyl(triphenylarsine)(tropolonato)rhodium(I)","Acta Crystallographica Section E","2005","61","6","m1212","m1214","10.1107/S1600536805015679","","","0.71069","MoKα","","0.136","0.07","","","0.1612","0.1863","","","","","","0.921","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205923","5.5952","0.0005","7.1862","0.0006","30.882","0.003","90","","94.108","0.002","90","","1238.52","0.19","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4,4'-Dinonyl-2,2'-bipyridine","","- C28 H44 N2 -","- C28 H44 N2 -","- C56 H88 N4 -","2","0.5","CV6517","Fujihara, Takashi; Suzuki, Hajime; Nagasawa, Akira","4,4'-Dinonyl-2,2'-bipyridine","Acta Crystallographica Section E","2005","61","6","o1867","o1868","10.1107/S1600536805015849","","","0.71073","MoKα","","0.0718","0.0606","","","0.1471","0.154","","","","","","1.103","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205924","35.937","0.002","8.3365","0.0004","25.432","0.001","90","","126.076","0.001","90","","6158.1","0.5","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(8-hydroxyquinolinato-κ^2^N,O) lead(II)","","- C18 H12 N2 O2 Pb -","- C18 H12 N2 O2 Pb -","- C288 H192 N32 O32 Pb16 -","16","2","DN6216","Zhu, Li-Hong; Zeng, Ming-Hua; Ng, Seik Weng","Bis(quinolin-8-olato-κ^2^<i>N</i>,<i>O</i>)lead(II)","Acta Crystallographica Section E","2005","61","6","m1082","m1084","10.1107/S1600536805011852","","","0.71073","MoKα","","0.051","0.03","","","0.065","0.075","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205925","15.327","0.002","12.436","0.002","8.543","0.002","90","","113.5","0.02","90","","1493.3","0.5","173","2","446","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","2,2':6',2'':6'',2'''-quaterpyridine","2-(6-(6-(pyridin-2-yl)pyridin-2-yl)pyridin-2-yl)pyridine","","- C20 H14 N4 -","- C20 H14 N4 -","- C80 H56 N16 -","4","0.5","DN6221","M. Rolland; A. van der Lee; M. Barboiu","Dimorphism of 2,2':6',2'':6'',2'''-quaterpyridine","Acta Crystallographica Section E","2005","61","6","o1880","o1882","10.1107/S1600536805015618","","","0.71073","MoKα","","0.1087","0.0762","","","0.2145","0.2464","","","","","","1.141","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205926","15.256","0.002","5.8527","0.0005","15.751","0.0019","90","","95.373","0.01","90","","1400.2","0.3","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Hydroxy-2-[4-(2-hydroxyethyl)piperazin-1-ylmethyl]-6-methylpyran-4-one","","- C13 H20 N2 O4 -","- C13 H20 N2 O4 -","- C52 H80 N8 O16 -","4","1","DN6223","Ocak Ískeleli, Nazan; Işık, Şamil; Dilsiz Aytemir, Mutlu","3-Hydroxy-2-[4-(2-hydroxyethyl)piperazin-1-ylmethyl]-6-methylpyran-4-one","Acta Crystallographica Section E","2005","61","6","o1947","o1949","10.1107/S1600536805016697","","","0.71073","MoKα","","0.0699","0.0329","","","0.0681","0.0735","","","","","","0.783","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205927","5.7208","0.0009","7.9144","0.0008","17.447","0.002","90","","101.682","0.013","90","","773.58","0.17","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","sarcosine ammonium nitrate","N-methylglycine ammonium nitrate","","- C3 H11 N3 O5 -","- C3 H11 N3 O5 -","- C12 H44 N12 O20 -","4","1","ER6009","Rodrigues, V. H.; Ramos Silva, M.; Matos Beja, A.; Paixão, J. A.; Costa, M.M.R.R.","Sarcosine ammonium nitrate","Acta Crystallographica Section E","2005","61","6","o1631","o1633","10.1107/S1600536805012031","","","0.71074","MoKα","","0.0901","0.0413","","","0.1102","0.1298","","","","","","0.982","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205928","15.096","0.003","6.1108","0.0012","32.164","0.006","90","","90","","90","","2967.1","1","296","2","296","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","catena-Poly[[aquacadmium(II)]bis(μ-4,5-diphenyl-1H-imidazole-1-acetate- κ^3^N:O,O')]","","- C34 H28 Cd N4 O5 -","- C34 H28 Cd N4 O5 -","- C136 H112 Cd4 N16 O20 -","4","1","ER6011","Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua","<i>catena</i>-Poly[[aquacadmium(II)]bis(μ-4,5-diphenyl-1<i>H</i>-imidazole-1-acetate)-κ^3^<i>N</i>:<i>O</i>,<i>O</i>';κ^3^<i>O</i>,<i>O</i>':<i>N</i>]","Acta Crystallographica Section E","2005","61","6","m1012","m1014","10.1107/S160053680501295X","","","0.71073","MoKα","","0.039","0.0342","","","0.0889","0.0914","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205929","7.5645","0.0008","12.2332","0.0012","13.5558","0.0014","90","","102.867","0.002","90","","1222.9","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-[2-(3-Chlorophenyl)ethyl]pyridine-2-carbonitrile","","- C14 H11 Cl N2 -","- C14 H11 Cl N2 -","- C56 H44 Cl4 N8 -","4","1","ER6014","Xiangping, Li; Haiyong, Chen; Xiaomin, Wang; Changxin Zhou; Yu Zhao","3-[2-(3-Chlorophenyl)ethyl]pyridine-2-carbonitrile","Acta Crystallographica Section E","2005","61","6","o1810","o1811","10.1107/S1600536805013681","","","0.71073","MoKα","","0.0659","0.0483","","","0.1186","0.1273","","","","","","1.011","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205930","10.353","0.003","6.107","0.001","10.882","0.002","90","","102.23","0.02","90","","672.4","0.3","303","2","303","2","","","","","","","","5","P 1 21 1","P 2yb","4","","4-(4-Chlorophenyl)-2-(trichloromethylsulfanyl)-1,3-thiazole","","- C10 H5 Cl4 N S2 -","- C10 H5 Cl4 N S2 -","- C20 H10 Cl8 N2 S4 -","2","1","FL6158","Hartung, Jens; Schmidt, Philipp; Svoboda, Ingrid; Fuess, Hartmut","4-(4-Chlorophenyl)-2-(trichloromethylsulfanyl)-1,3-thiazole","Acta Crystallographica Section E","2005","61","6","o1736","o1737","10.1107/S160053680501305X","","","0.71073","MoKα","","0.0502","0.0321","","","0.0768","0.0847","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205931","7.3037","0.0005","15.287","0.001","14.985","0.001","90","","92.735","0.007","90","","1671.19","0.19","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-(4-Methoxyphenyl)-4-methyl-2-thioxo-2,3-dihydro-1,3-thiazol-3-yl benzoate","","- C18 H15 N O3 S2 -","- C18 H15 N O3 S2 -","- C72 H60 N4 O12 S8 -","4","1","FL6159","Hartung, Jens; Altermann, Sabine; Svoboda, Ingrid; Fuess, Hartmut","5-(4-Methoxyphenyl)-4-methyl-2-thioxo-2,3-dihydro-1,3-thiazol-3-yl benzoate at 100K","Acta Crystallographica Section E","2005","61","6","o1738","o1740","10.1107/S1600536805013061","","","0.71073","MoKα","","0.0474","0.0368","","","0.0856","0.09","","","","","","1.095","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205932","13.939","0.005","6.878","0.005","19.533","0.004","90","","114.279","0.017","90","","1707","1.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-[(2-chloro-3,4-dimethoxybenzylidene)amino]adamantane","","- C19 H24 Cl N O2 -","- C19 H24 Cl N O2 -","- C76 H96 Cl4 N4 O8 -","4","1","FL6162","Şamil Işık; Yavuz Köysal; Ebubekir Septiog̃lu; Ünsal Çalış","1-[(2-Chloro-3,4-dimethoxybenzylidene)amino]adamantane","Acta Crystallographica Section E","2005","61","6","o1851","o1852","10.1107/S1600536805015680","","","0.71069","MoKα","","0.0638","0.0451","","","0.1137","0.1224","","","","","","1.03","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205933","14.2591","0.0011","9.9334","0.0005","12.7325","0.001","90","","107.61","0.006","90","","1718.9","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-[(2-chloro-3,4-dimethoxybenzylidene)amino]adamantane","","- C19 H24 Cl N O2 -","- C19 H24 Cl N O2 -","- C76 H96 Cl4 N4 O8 -","4","1","FL6163","Şamil Işık; Yavuz Köysal; Ebubekir Septiog̃lu; Ünsal Çalış","2-[(2-Chloro-3,4-dimethoxybenzylidene)amino]adamantane","Acta Crystallographica Section E","2005","61","6","o1853","o1854","10.1107/S1600536805015692","","","0.71073","MoKα","","0.0557","0.0432","","","0.1179","0.1254","","","","","","1.048","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205934","16.0203","0.0009","7.5367","0.0004","11.1773","0.0006","90","","103.597","0.001","90","","1311.73","0.12","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,12-Diferrocenyldodecane","","- C32 H42 Fe2 -","- C32 H42 Fe2 -","- C64 H84 Fe4 -","2","0.5","FL6164","Bequeath, Danielle M.; Porter, Richard L.; Lufaso, Michael W.; Wagner, Timothy R.; Kusnic, Rachel L.; Zeller, Matthias; Curtin, Larry S.","1,12-Diferrocenyldodecane at 100K","Acta Crystallographica Section E","2005","61","6","m1070","m1072","10.1107/S160053680501367X","","","0.71073","MoKα","","0.0272","0.026","","","0.0738","0.0748","","","","","","1.073","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205935","5.668","0.001","11.549","0.001","13.743","0.002","91.95","0.01","101.74","0.01","100.64","0.01","863.3","0.2","293","2","","","","","","","","","","5","P -1","-P 1","2","","Tetrakis(μ-4-chlorophenoxyacetato-κ^2^O,O')dimolybdenum(II)","","- C32 H24 Cl4 Mo2 O12 -","- C32 H24 Cl4 Mo2 O12 -","- C32 H24 Cl4 Mo2 O12 -","1","0.5","FL6166","Liwporncharoenvong, Teerayuth; Luck, Rudy L.","Tetrakis(μ-4-chlorophenoxyacetato-κ^2^<i>O</i>,<i>O</i>')dimolybdenum(II)","Acta Crystallographica Section E","2005","61","6","m1191","m1193","10.1107/S1600536805015795","","","0.71069","MoKα","","","0.0259","","","","0.0632","","","","","","1.042","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205936","6.3265","0.0013","11.047","0.002","9.003","0.0018","90","","109.14","0.03","90","","594.4","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","4-Methoxy-2-methyl-N-phenylaniline","","- C14 H15 N O -","- C14 H15 N O -","- C28 H30 N2 O2 -","2","1","FL6168","Si-Qian Wang; Zhen-Feng Zhang; Xin Wang; Mei-Yu Huang; Ying-Yan Jiang","4-Methoxy-2-methyl-<i>N</i>-phenylaniline","Acta Crystallographica Section E","2005","61","6","o1872","o1874","10.1107/S1600536805015783","","","0.71073","MoKα","","0.0376","0.0337","","","0.0955","0.0973","","","","","","1.012","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205937","5.723","0.0013","3.6965","0.0009","10.244","0.002","90","","97.689","0.007","90","","214.76","0.08","158","","158","","","","","","","","","3","P 1 c 1","P -2yc","7","","1H-Imidazole-4-carbonitrile","","- C4 H3 N3 -","- C4 H3 N3 -","- C8 H6 N6 -","2","1","GH6011","Less, Gregory B.; Rasmussen, Paul G.; Kampf, Jeff W.","1<i>H</i>-Imidazole-4-carbonitrile","Acta Crystallographica Section E","2005","61","6","o1704","o1706","10.1107/S1600536805014509","","","0.71073","MoKα","","0.0326","0.0315","","","0.0786","0.0794","","","","","","1.131","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205938","3.726","0.002","7.511","0.005","29.983","0.018","90","","91.937","0.012","90","","838.6","0.9","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","4-nitrophenylpropiolic acid","4-nitrophenylpropynoic acid","","- C9 H5 N O4 -","- C9 H5 N O4 -","- C36 H20 N4 O16 -","4","1","GH6020","Dinabandhu Das; Gautam R. Desiraju; Ram K. R. Jetti; Ronald Boese","A rare <i>syn</i>‒<i>anti</i> catemer in 4-nitrophenylpropiolic acid","Acta Crystallographica Section E","2005","61","6","o1588","o1589","10.1107/S1600536805013310","","","0.71073","MoKα","","0.1127","0.0584","","","0.1405","0.1632","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205939","6.8221","0.0003","23.023","0.001","7.6719","0.0003","90","","107.176","0.002","90","","1151.25","0.09","293","1","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","8-Chloro-10,11-dihydro-4-aza-5H-dibenzo[a,d]cyclohepten-5-one","","- C14 H10 Cl N O -","- C14 H10 Cl N O -","- C56 H40 Cl4 N4 O4 -","4","1","GH6021","Wenyan Lin; Xinyue Zhang; Hongxiang Sun; Changxin Zhou; Yu Zhao","8-Chloro-10,11-dihydro-4-aza-5<i>H</i>-dibenzo[<i>a</i>,<i>d</i>]cyclohepten-5-one","Acta Crystallographica Section E","2005","61","6","o1762","o1763","10.1107/S1600536805014492","","","0.7107","MoKα","","","0.041","","","","0.142","","","","","","1.001","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205940","21.1211","0.0006","15.0486","0.0004","15.5611","0.0005","90","","97.181","0.001","90","","4907.2","0.2","150","1","150","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Bis(μ-2,6-diformyl-4-methylphenolato)bis[bis(2,6-diformyl-4- methylphenolato)neodymium(III)]","","- C54 H42 Nd2 O18 -","- C54 H42 Nd2 O18 -","- C216 H168 Nd8 O72 -","4","0.5","HB6156","Singh-Wilmot, Marvadeen A.; Kahwa, Ishenkumba A.; Lough, Alan J.","Bis(μ-2,6-diformyl-4-methylphenolato)bis[bis(2,6-diformyl-4-methylphenolato)neodymium(III)]","Acta Crystallographica Section E","2005","61","6","m1009","m1011","10.1107/S160053680500591X","","","0.71073","MoKα","","0.0625","0.0401","","","0.0839","0.094","","","","","","1.074","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205941","9.295","0.004","10.639","0.005","11.258","0.005","114.603","0.008","112.54","0.008","95.065","0.008","893.2","0.7","298","2","293","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-hydroxo-bis[aqua(1,10-phenanthroline-κ^2^N,N')copper(II)] terephthalate octahydrate","","- C32 H42 Cu2 N4 O16 -","- C32 H42 Cu2 N4 O16 -","- C32 H42 Cu2 N4 O16 -","1","0.5","HB6188","Zhang, Hong-Mei; Lu, Li-Ping; Feng, Si-Si; Qin, Shi-Dong; Zhu, Miao-Li","Di-μ-hydroxo-bis[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)] terephthalate octahydrate","Acta Crystallographica Section E","2005","61","6","m1027","m1029","10.1107/S160053680501322X","","","0.71073","MoKα","","0.1805","0.0984","","","0.1936","0.2533","","","","","","0.835","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205942","11.8707","0.0004","21.2746","0.0006","11.2385","0.0004","90","","117.639","0.008","90","","2514.3","0.2","295","3","295","3","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis(4-hydroxybenzoato-κO)(1,10-phenanthroline-κ^2^N,N')cobalt(II) monohydrate","","- C26 H24 Co N2 O9 -","- C26 H24 Co N2 O9 -","- C104 H96 Co4 N8 O36 -","4","1","HB6189","Jian-Rong Su; Jian-Ming Gu; Duan-Jun Xu","Diaquabis(4-hydroxybenzoato-κ<i>O</i>)(1,10-phenanthroline-κ^2^<i>N,N</i>')cobalt(II) monohydrate","Acta Crystallographica Section E","2005","61","6","m1033","m1035","10.1107/S1600536805013000","","","0.71069","MoKα","","0.037","0.03","","","0.073","0.076","","","","","","1.02","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2205943","10.3822","0.0006","17.6359","0.001","11.4516","0.0007","90","","105.191","0.001","90","","2023.5","0.2","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Triaqua(2,2'-bipyridine)(4-sulfonatobenzoato)manganese(II) monohydrate","","- C17 H20 Mn N2 O9 S -","- C17 H20 Mn N2 O9 S -","- C68 H80 Mn4 N8 O36 S4 -","4","1","HB6190","Zhang, Li-Ping; Zhu, Long-Guan","Triaqua(2,2'-bipyridine)(4-sulfonatobenzoato)manganese(II) monohydrate containing seven-coordinate manganese","Acta Crystallographica Section E","2005","61","6","m1036","m1038","10.1107/S1600536805013243","","","0.71073","MoKα","","0.0788","0.0765","","","0.1383","0.1394","","","","","","1.299","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205944","8.6773","0.001","11.585","0.002","12.068","0.002","77.137","0.014","79.072","0.014","79.279","0.014","1148.1","0.3","150","","150","","","","","","","","","8","P -1","-P 1","2","","μ-Oxo-bis{chloro[N-(2-methoxyethyl)-N,N-bis(pyridin-2-ylmethyl)amine- κ^4^-N,N',N'',O]iron(III)} bis(trifluoromethanesulfonate) acetonitrile disolvate","","- C36 H44 Cl2 F6 Fe2 N8 O9 S2 -","- C36 H44 Cl2 F6 Fe2 N8 O9 S2 -","- C36 H44 Cl2 F6 Fe2 N8 O9 S2 -","1","0.5","HB6191","Kooijman, Huub; Son, Martin van; Tanase, Stefania; Bouwman, Elisabeth; Reedijk, Jan; Spek, Anthony L.","μ-Oxo-bis{chloro[<i>N</i>-(2-methoxyethyl)-<i>N</i>,<i>N</i>-bis(pyridin-2-ylmethyl)amine-κ^4^-<i>N</i>,<i>N</i>',<i>N</i>'',<i>O</i>]iron(III)} bis(trifluoromethanesulfonate) acetonitrile disolvate","Acta Crystallographica Section E","2005","61","6","m1042","m1044","10.1107/S1600536805013553","","","0.71073","MoKα","","0.0876","0.0643","","","0.1669","0.1845","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205945","10.568","0.007","18.258","0.013","5.025","0.004","90","","90","","90","","969.5","1.2","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","cobalt zinc phosphate tetrahydrate","","- Co H8 O12 P2 Zn2 -","- Co H8 O12 P2 Zn2 -","- Co4 H32 O48 P8 Zn8 -","4","0.5","HB6192","Wu, Wen-Yuan; Liang, Xiao-Qiang; Li, Yi-Zhi","CoZn~2~(PO~4~)~2~.4H~2~O, a cobalt-doped modification of hopeite","Acta Crystallographica, Section E","2005","61","6","i105","i107","10.1107/S1600536805014078","","","0.71073","MoKα","","0.0398","0.0322","","","0.0761","0.0772","","","","","","1.075","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2205946","10.562","0.003","18.224","0.005","5.0133","0.0015","90","","90","","90","","965","0.5","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","nickel zinc phosphate tetrahydrate","","- H8 Ni O12 P2 Zn2 -","- H8 Ni O12 P2 Zn2 -","- H32 Ni4 O48 P8 Zn8 -","4","0.5","HB6193","Wu, Wen-Yuan; Liang, Xiao-Qiang; Li, Yi-Zhi","NiZn~2~(PO~4~)~2~.4H~2~O, a nickel-doped modification of hopeite","Acta Crystallographica, Section E","2005","61","6","i108","i110","10.1107/S160053680501408X","","","0.71073","MoKα","","0.0361","0.0273","","","0.0561","0.0571","","","","","","1.079","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2205947","7.9951","0.001","8.1835","0.0011","9.6545","0.0013","69.312","0.015","69.676","0.015","86.164","0.016","553.03","0.15","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","di-μ-chloro-bis[(η^6^-benzene)chlororuthenium(II)] chloroform disolvate","","- C14 H14 Cl10 Ru2 -","- C14 H14 Cl10 Ru2 -","- C14 H14 Cl10 Ru2 -","1","0.5","HB6194","Canivet, Jérôme; Therrien, Bruno; Süss-Fink, Georg","Di-μ-chloro-bis[(η^6^-benzene)chlororuthenium(II)] chloroform disolvate","Acta Crystallographica Section E","2005","61","6","m1090","m1091","10.1107/S1600536805014157","","","0.71073","MoKα","","0.0272","0.0229","","","0.0607","0.0794","","","","","","1.204","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205948","23.432","0.007","16.752","0.005","16.134","0.005","90","","94.372","0.005","90","","6315","3","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis{chloro[tris(1H-benzimidazol-2-ylmethyl)amine]cobalt(II)} tetrachlorocobalt(II) methanol tetrasolvate","","- C52 H58 Cl6 Co3 N14 O4 -","- C52 H58 Cl6 Co3 N14 O4 -","- C208 H232 Cl24 Co12 N56 O16 -","4","0.5","HB6195","Li, Xue-Mei; Feng, Si-Si; Zhang, Hong-Mei; Su, Ying-Lan; Qin, Shi-Dong; Lu, Li-Ping; Xue, Wan-Hua; Zhu, Miao-Li","Bis{[tris(1<i>H</i>-benzimidazol-2-ylmethyl)amine]chlorocobalt(II)} tetrachlorocobaltate(II) methanol tetrasolvate","Acta Crystallographica Section E","2005","61","6","m1067","m1069","10.1107/S1600536805014066","","","0.71073","MoKα","","0.1973","0.0917","","","0.2237","0.2593","","","","","","0.941","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205949","22.075","0.003","22.075","0.003","22.075","0.003","90","","90","","90","","10757","3","100","2","100","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","","sodium tris(acetylacetonato-κ^2^O,O')manganese(II)","","- C15 H21 Mn Na O6 -","- C15 H21 Mn Na O6 -","- C360 H504 Mn24 Na24 O144 -","24","1","HB6197","Saha, Amrita; Musie, Ghezai; Powell, Douglas R.","Sodium tris(acetylacetonato-κ^2^<i>O</i>,<i>O</i>')manganese(II)","Acta Crystallographica Section E","2005","61","6","m1144","m1146","10.1107/S1600536805015205","","","0.71073","MoKα","","0.0438","0.0386","","","0.1079","0.1129","","","","","","1.007","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205950","11.5641","0.0005","10.2592","0.0005","12.7556","0.0006","90","","90.3721","0.0012","90","","1513.27","0.12","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaqua(5-nitro-1H-benzimidazole-κN^3^)(oxydiacetato-κO,O',O'')cobalt(II) monohydrate","","- C11 H15 Co N3 O10 -","- C11 H15 Co N3 O10 -","- C44 H60 Co4 N12 O40 -","4","1","HB6199","Bing-Yu Zhang; Jia-Geng Liu; Duan-Jun Xu","Diaqua(5-nitro-1<i>H</i>-benzimidazole-κ<i>N</i>^3^)(oxydiacetato-κ<i>O</i>,<i>O</i>',<i>O</i>'')cobalt(II) monohydrate","Acta Crystallographica Section E","2005","61","6","m1128","m1130","10.1107/S1600536805014947","","","0.71073","MoKα","","0.053","0.042","","","0.106","0.11","","","","","","1.097","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2205951","8.2904","0.0006","14.2195","0.0008","16.955","0.0007","90","","90.615","0.004","90","","1998.6","0.2","295","2","295","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Chlorobis(dimethylglyoximato)(isonicotinic acid)cobalt(III) monohydrate","","- C14 H21 Cl Co N5 O7 -","- C14 H20 Cl Co N5 O7 -","- C56 H80 Cl4 Co4 N20 O28 -","4","2","HB6201","Shen, Xu-Jie; Xiao, Li-Ping; Xu, Ru-Ren","Chlorobis(dimethylglyoximato)(isonicotinic acid)cobalt(III) monohydrate","Acta Crystallographica Section E","2005","61","6","m1156","m1158","10.1107/S1600536805015424","","","0.71073","MoKα","","0.0701","0.0442","","","0.0771","0.0846","","","","","","0.896","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205952","15.8286","0.0011","21.2483","0.0016","6.7247","0.0009","90","","90","","90","","2261.7","0.4","295","2","295","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","poly[[aquatri-μ~3~-iminodiacetato-cadmium(III)] trihydrate]","","- C12 H23 Cd3 N3 O16 -","- C12 H21 Cd3 N3 O16 -","- C48 H84 Cd12 N12 O64 -","4","0.5","HB6206","Bing-Xin Liu; Duan-Jun Xu","A two-dimensional cadmium(II)‒iminodiacetate polymer","Acta Crystallographica Section E","2005","61","6","m1218","m1220","10.1107/S1600536805015801","","","0.71073","MoKα","","0.034","0.033","","","0.061","0.061","","","","","","1.266","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2205953","22.2083","0.0002","12.8446","0.0001","33.9272","0.0005","90","","107.568","0.0005","90","","9226.57","0.18","150","","150","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichlorotris(triphenylphosphine)ruthenium(II) dichloromethane hemisolvate","","- C54.5 H46 Cl3 P3 Ru -","- C54.5 H46 Cl3 P3 Ru -","- C436 H368 Cl24 P24 Ru8 -","8","1","HB6207","Cowley, Andrew R.; Dilworth, Jonathan R.; Maresca von Beckh W., Carlo A.","Dichlorotris(triphenylphosphine)ruthenium(II) dichloromethane hemisolvate","Acta Crystallographica Section E","2005","61","6","m1237","m1239","10.1107/S1600536805016272","","","0.71073","MoKα","","0.0825","0.0387","","0.0777","0.0412","0.0412","","","","","","1.113","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2205954","6.47","0.002","7.814","0.002","12.035","0.002","97.7","0.03","101.9","0.03","104.88","0.03","564.1","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis(2-cyclohexyliminomethylphenolato)zinc(II)","","- C26 H32 N2 O2 Zn -","- C26 H32 N2 O2 Zn -","- C26 H32 N2 O2 Zn -","1","0.5","HB6208","Hou, Han-Na","Bis[2-(cyclohexyliminomethyl)phenolato]zinc(II)","Acta Crystallographica Section E","2005","61","6","m1197","m1198","10.1107/S1600536805015990","","","0.71073","MoKα","","0.0396","0.0387","","","0.104","0.105","","","","","","1.14","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205955","6.1837","0.0011","15.147","0.002","17.536","0.002","90","","90","","90","","1642.5","0.4","133","2","133","2","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","","2,5,2'',5''-Tetramethyl-p-terphenyl","","- C22 H22 -","- C22 H22 -","- C88 H88 -","4","1","HB6209","Jones, Peter G.; Kuś, Piotr; Pasewicz, Anna","2,5,2'',5''-Tetramethyl-<i>p</i>-terphenyl","Acta Crystallographica Section E","2005","61","6","o1895","o1896","10.1107/S1600536805016259","","","0.71073","MoKα","","0.0545","0.045","","","0.1167","0.1222","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205956","9.016","0.002","11.1672","0.0014","13.243","0.003","78.47","0.01","80.58","0.03","84.82","0.01","1286.5","0.5","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Benzimidazolium bis(1H-benzimidazole-κN^3^)chloro(oxydiacetato-κ^3^O,O',O'')cadium(II)","","- C25 H23 Cd Cl N6 O5 -","- C25 H23 Cd Cl N6 O5 -","- C50 H46 Cd2 Cl2 N12 O10 -","2","1","HB6210","Gaduo; Jian-Rong Su; Duan-Jun Xu","Benzimidazolium bis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)chloro(oxydiacetato-κ^3^<i>O</i>,<i>O</i>',<i>O</i>'')cadmium(II)","Acta Crystallographica Section E","2005","61","6","m1231","m1233","10.1107/S1600536805016478","","","0.71073","MoKα","","0.024","0.021","","","0.052","0.053","","","","","","1.08","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205957","6.4667","0.0002","10.5817","0.0005","17.1328","0.0008","90","","96.411","0.002","90","","1165.04","0.09","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[NH3(CH2)2NH(CH2)2NH3].(AlF6).2H2O","diethylenetriamine hexafluoroaluminate dihydrate","","- C4 H20 Al F6 N3 O2 -","- C4 H20 Al F6 N3 O2 -","- C16 H80 Al4 F24 N12 O8 -","4","1","HG6160","K. Adil; J. Marrot; M. Leblanc; V. Maisonneuve","Diethylenetriaminium hexafluoroaluminate dihydrate","Acta Crystallographica Section E","2005","61","6","m1178","m1180","10.1107/S160053680501559X","","","0.71073","MoKα","","0.0755","0.0629","","","0.1949","0.207","","","","","","1.121","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205958","18.2331","0.0017","15.3467","0.0014","9.5134","0.0009","90","","90","","90","","2662","0.4","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","3,10,18,25,31,32-hexaazapentacyclo[25.3.1.1^12,16^.0^4,9^.0^19,24^]dotriconta- 1(30),4,6,8,12,14,16(32),19,21,23,27(31),28-dodecaene-2,11,17,26-tetrone dimethylformamide solvate","","- C29 H25 N7 O5 -","- C29 H25 N7 O5 -","- C116 H100 N28 O20 -","4","0.5","HG6173","Jun Lin; Hao Lin; Jing-Wen Chen; Zi-Jian Guo","Bis[<i>N</i>,<i>N</i>'-<i>o</i>-phenylenebis(pyridine-2,6-dicarboxamide)] dimethylformamide solvate","Acta Crystallographica Section E","2005","61","6","o1592","o1594","10.1107/S1600536805013322","","","0.71073","MoKα","","0.0914","0.0465","","","0.0891","0.0977","","","","","","0.963","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205959","15.5003","0.0004","6.4005","0.0001","20.1552","0.0005","90","","110.04","0.0011","90","","1878.53","0.07","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(cycloheptylaminium) hydrogenarsenate monohydrate","","- C14 H35 As N2 O5 -","- C14 H35 As N2 O5 -","- C56 H140 As4 N8 O20 -","4","1","HG6174","Todd, Malcolm J.; Harrison, William T. A.","Bis(cycloheptylaminium) hydrogenarsenate monohydrate","Acta Crystallographica Section E","2005","61","6","m1024","m1026","10.1107/S1600536805012912","","","0.71073","MoKα","","0.0394","0.0284","","","0.063","0.0681","","","","","","1.038","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205960","11.5494","0.0007","6.1399","0.0004","11.6601","0.0006","90","","92.213","0.003","90","","826.23","0.08","120","2","120","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","Propane-1,2-diaminium selenite monohydrate","","- C3 H14 N2 O4 Se -","- C3 H14 N2 O4 Se -","- C12 H56 N8 O16 Se4 -","4","1","HG6175","Todd, Malcolm J.; Harrison, William T. A.","Propane-1,2-diaminium selenite monohydrate","Acta Crystallographica Section E","2005","61","6","o1538","o1540","10.1107/S160053680501278X","","","0.71073","MoKα","","0.039","0.0299","","","0.0644","0.068","","","","","","1.068","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205961","9.4575","0.0008","21.398","0.002","7.1568","0.0006","90","","110.639","0.001","90","","1355.4","0.2","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[bis[aquacopper(I)-μ-4,4'-bipyridine-κ^2^N:N'] terephthalate dihydrate]","","- C28 H28 Cu2 N4 O8 -","- C28 H28 Cu2 N4 O8 -","- C56 H56 Cu4 N8 O16 -","2","0.5","HG6176","Zhang, Xue-Li; Lu, Yu-Juan; Li, Ji-Zhen; Ng, Seik Weng","<i>catena</i>-Poly[bis[aquacopper(I)-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] terephthalate dihydrate]","Acta Crystallographica Section E","2005","61","6","m1061","m1062","10.1107/S1600536805013929","","","0.71073","MoKα","","0.054","0.042","","","0.106","0.113","","","","","","1.03","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205962","11.568","0.001","9.78","0.001","7.6255","0.0007","90","","91.286","0.003","90","","862.49","0.14","295","2","295","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Hexaaquazinc(II) bis(6-hydroxypyridine-3-carboxylate)","","- C12 H20 N2 O12 Zn -","- C12 H20 N2 O12 Zn -","- C24 H40 N4 O24 Zn2 -","2","0.25","HG6177","Zhang, Xue-Li; Lu, Yu-Juan; Li, Ji-Zhen; Ng, Seik Weng","Hexaaquazinc(II) bis(6-hydroxypyridine-3-carboxylate)","Acta Crystallographica Section E","2005","61","6","m1063","m1064","10.1107/S1600536805013917","","","0.71073","MoKα","","0.038","0.038","","","0.106","0.107","","","","","","1.12","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205963","7.0588","0.0006","8.3638","0.0006","10.569","0.0008","112.301","0.001","94.096","0.001","104.93","0.001","547.73","0.07","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[bis(μ-1,10-phenanthrolin-2-olato- κ^3^N,N':O)dicopper(I,II)(Cu—Cu)]-μ-chloro-copper(I)-μ-chloro]","","- C24 H14 Cl2 Cu3 N4 O2 -","- C24 H14 Cl2 Cu3 N4 O2 -","- C24 H14 Cl2 Cu3 N4 O2 -","1","0.5","HG6178","Zheng, Yan-Zhen; Ng, Seik Weng","<i>catena</i>-Poly[[bis(μ-1,10-phenanthrolin-2-olato-κ^3^<i>N,N</i>':<i>O</i>)dicopper(I,II)(<i>Cu{—</i>Cu})]-μ-chlorocopper(I)-μ-chloro]","Acta Crystallographica Section E","2005","61","6","m1030","m1032","10.1107/S1600536805013632","","","0.71073","MoKα","","0.035","0.032","","","0.088","0.091","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205964","7.38","0.003","8.139","0.003","13.781","0.005","78.224","0.005","87.913","0.006","68.28","0.005","752.1","0.5","298","2","298","2","","","","","","","","3","P -1","-P 1","2","Methyl linderone","4,5-Dimethoxy-2-(1-methoxy-3-phenylallylidine)cyclcopent-4-ene-1,3-dione","","- C17 H16 O5 -","- C17 H16 O5 -","- C34 H32 O10 -","2","1","HG6179","Syah, Yana M.; Suastri, Nyoman S.; Latip, Jalifah; Yamin, Bohari M.","4,5-Dimethoxy-2-(1-methoxy-3-phenylallylidene)cyclopent-4-ene-1,3-dione (methyl linderone)","Acta Crystallographica Section E","2005","61","6","o1530","o1531","10.1107/S1600536805012833","","","0.71073","MoKα","","0.062","0.054","","","0.143","0.149","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205965","8.2148","0.0008","14.31","0.002","16.816","0.0017","90","","90","","90","","1976.8","0.4","296","1","296","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(2R,3S,4R)-1,2,4,5-Tetraacetoxy-3-methoxypentyl acetate","","- C16 H24 O11 -","- C16 H24 O11 -","- C64 H96 O44 -","4","1","HG6181","V. Valdivia, Verónica; Sosa-Rivadeneyra, Martha; Quintero, Leticia; Bernès, Sylvain","(2<i>R</i>,3<i>S</i>,4<i>R</i>)-1,2,4,5-Tetraacetoxy-3-methoxypentyl acetate","Acta Crystallographica Section E","2005","61","6","o1643","o1645","10.1107/S1600536805013036","","","0.71073","MoKα","","0.0584","0.0395","","","0.098","0.1079","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205966","5.8352","0.0011","8.0741","0.0014","34.311","0.007","90","","90","","90","","1616.5","0.5","294","2","294","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4-[3-(1,2,4-Triazol-1-yl)propionyl]phenyl 4-fluorobenzoate","","- C18 H14 F N3 O3 -","- C18 H14 F N3 O3 -","- C72 H56 F4 N12 O12 -","4","1","HG6182","Wei-Hua Li; Guo-Dong Si; Bao-Rong Hou; Zhi-Gang Yu; Fa-Qian Liu; Yong-Qi Qin","4-[3-(1,2,4-Triazol-1-yl)propionyl]phenyl 4-fluorobenzoate","Acta Crystallographica Section E","2005","61","6","o1788","o1789","10.1107/S1600536805014881","","","0.71073","MoKα","","0.0783","0.0365","","","0.0754","0.0925","","","","","","1.018","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205967","4.516","0.001","11.618","0.002","11.481","0.002","90","","91.43","0.02","90","","602.2","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1-[Bis(4,5-hydroxymethyl)-1,2,3-triazol-1-ylmethyl]thymine","","- C10 H13 N5 O4 -","- C10 H13 N5 O4 -","- C20 H26 N10 O8 -","2","1","HG6184","Stash, Adam I.; Zavodnik, Valery E.; Zavgorodny, Sergei G.; Gurskaya, Galina V.; Tsirelson, Vladimir G.","1-[4,5-Bis(hydroxymethyl)-1,2,3-triazol-1-ylmethyl]thymine","Acta Crystallographica Section E","2005","61","6","o1721","o1723","10.1107/S1600536805014650","","","0.71073","MoKα","","0.0389","0.0303","","","0.0835","0.0864","","","","","","1.036","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205968","6.572","0.0009","14.3913","0.0002","30.5468","0.0003","90","","90","","90","","2889.1","0.4","295","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl 3,5-O-bis(4-chlorobenzoyl)-2-deoxy-α-D-erythro-ribofuranoside","","- C29 H34 Cl2 O6 -","- C29 H34 Cl2 O6 -","- C116 H136 Cl8 O24 -","4","1","HG6185","Guo-Ming Yang; Zhi-Cai Shang; Yun Wang; Qin-Sen Yu","(1<i>R</i>,2<i>S</i>,5<i>R</i>)-2-Isopropyl-5-methylcyclohexyl 3,5-bis-<i>O</i>-(4-chlorobenzoyl)-2-deoxy-α-<small>D</small>-<i>erythro</i>-ribofuranoside","Acta Crystallographica Section E","2005","61","6","o1963","o1964","10.1107/S1600536805015503","","","0.71073","MoKα","","","0.0368","","","","0.0725","","","","","","0.991","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205969","9.854","0.001","12.316","0.001","12.488","0.001","79.928","0.01","77.248","0.01","66.719","0.01","1351.3","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","12-Bromo-1,2,3,4-tetrahydro-1,4-ethanoantracen-11-ol","","- C16 H15 Br O -","- C16 H15 Br O -","- C64 H60 Br4 O4 -","4","2","HG6187","Çoruh, Ufuk; Altundaş, Aliye; Menzek, Abdullah; García-Granda, Santiago","12-Bromo-1,2,3,4-tetrahydro-1,4-ethanoanthracen-11-ol","Acta Crystallographica Section E","2005","61","6","o1869","o1871","10.1107/S160053680501576X","","","0.71073","MoKα","","0.0418","0.0376","","","0.1006","0.1038","","","","","","1.098","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205970","7.336","0.004","6.607","0.004","10.092","0.006","90","","96.387","0.009","90","","486.1","0.5","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","2-chloro-4-(3,5-dimethyl-1H-pyrazol-1-yl)pyrimidine","","- C9 H9 Cl N4 -","- C9 H9 Cl N4 -","- C18 H18 Cl2 N8 -","2","0.5","HG6189","Wei-Min Liu; You-Quan Zhu; Yi-Feng Wang; Gong-Chun Li; Hua-Zheng Yang","2-Chloro-4-(3,5-dimethyl-1<i>H</i>-pyrazol-1-yl)pyrimidine","Acta Crystallographica Section E","2005","61","6","o1821","o1822","10.1107/S160053680501531X","","","0.71073","MoKα","","0.0519","0.0358","","","0.0947","0.106","","","","","","1.033","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205971","10.2654","0.0015","13.515","0.002","17.23","0.003","90","","90","","90","","2390.4","0.6","294","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,3-Dihydro-2,2-dimethylbenzofuran-7-yl N-methylcarbamate","","- C12 H15 N O3 -","- C12 H15 N O3 -","- C96 H120 N8 O24 -","8","2","HG6190","Liang-Zhong Xu; Guan-Ping Yu; Shuang-Hua Yang","2,3-Dihydro-2,2-dimethylbenzofuran-7-yl <i>N</i>-methylcarbamate","Acta Crystallographica Section E","2005","61","6","o1924","o1926","10.1107/S1600536805016387","","","0.71073","MoKα","","0.0796","0.0407","","","0.0899","0.1085","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205972","11.028","0.002","10.4955","0.0009","11.116","0.005","90","","90.37","0.03","90","","1286.6","0.6","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis[μ-N-(2,6-dimethylphenyl)acetamidato]bis[dimethylaluminium","","- C24 H36 Al2 N2 O2 -","- C24 H36 Al2 N2 O2 -","- C48 H72 Al4 N4 O4 -","2","0.5","HG6191","John Fawcett; Gregory A. Solan","Bis[μ-<i>N</i>-(2,6-dimethylphenyl)acetamidato]bis(dimethylaluminium)","Acta Crystallographica Section E","2005","61","6","m1210","m1211","10.1107/S1600536805015941","","","0.71073","MoKα","","0.1046","0.0641","","","0.1485","0.1897","","","","","","1.068","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205973","18.856","0.004","9.311","0.0019","5.183","0.001","90","","101.04","0.03","90","","893.1","0.3","120","2","120","2","","","","","","","","4","C 1 2 1","C 2y","5","(1R*,2R*)-Di-tert-butyl N,N'-(cyclohexane-1,2-diyl)dicarbamate","(1R*,2R*)-Di-tert-butyl N,N'-(cyclohexane-1,2-diyl)dicarbamate","","- C16 H30 N2 O4 -","- C16 H30 N2 O4 -","- C32 H60 N4 O8 -","2","0.5","HG6193","Light, Mark E.; Andrea Ragusa; Jeremy D. Kilburn","(1<i>R</i>*,2<i>R</i>*)-Di-<i>tert</i>-butyl <i>N</i>,<i>N</i>'-(cyclohexane-1,2-diyl)dicarbamate","Acta Crystallographica Section E","2005","61","6","o1956","o1958","10.1107/S1600536805016715","","","0.71073","MoKα","","0.0413","0.0354","","","0.0758","0.0781","","","","","","1.063","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205974","12.3563","0.0002","8.32","0.0002","11.6818","0.0003","90","","106.275","0.001","90","","1152.82","0.05","90","0.2","90","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(2,5-Dichlorophenyl)-N'-[(E)-3-thienylmethylene]hydrazine","","- C11 H8 Cl2 N2 S -","- C11 H8 Cl2 N2 S -","- C44 H32 Cl8 N8 S4 -","4","1","HG6195","Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.","<i>N</i>-(2,5-Dichlorophenyl)-<i>N</i>'-[(<i>E</i>)-3-thienylmethylene]hydrazine","Acta Crystallographica Section E","2005","61","6","o1907","o1909","10.1107/S160053680501634X","","","0.71073","MoKα","","0.0547","0.0377","","","0.1002","0.1089","","","","","","1.087","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205975","9.3172","0.0007","11.5055","0.0009","16.3424","0.0013","104.677","0.006","105.307","0.006","103.098","0.006","1551.6","0.2","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","1,3,5-Tris(2-isopropylphenoxymethyl)benzene","","- C36 H42 O3 -","- C36 H42 O3 -","- C72 H84 O6 -","2","1","HK6003","Deveci, Özlem; Işık, Şamil; Akdemir, Nesuhi; Kantar, Cihan; Ağar, Erbil","1,3,5-Tris(2-isopropylphenoxymethyl)benzene","Acta Crystallographica Section E","2005","61","6","o1724","o1725","10.1107/S1600536805014406","","","0.71073","MoKα","","0.1135","0.0463","","","0.1184","0.1406","","","","","","0.845","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205976","5.1815","0.0004","26.045","0.0019","20.5735","0.0015","90","","91.302","0.002","90","","2775.7","0.4","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","carbamazepine furfural hemisolvate","[5H-dibenz[b,f]azepine-5-carboxamide]2-furan carboxaldehyde hemisolvate","","- C17.5 H14 N2 O2 -","- C17.5 H14 N2 O2 -","- C140 H112 N16 O16 -","8","2","HK6007","Johnston, Andrea; Florence, Alastair J.; Kennedy, Alan R.","Carbamazepine furfural hemisolvate","Acta Crystallographica Section E","2005","61","6","o1777","o1779","10.1107/S1600536805014984","","","0.6902","synchrotron","","0.0947","0.0565","","","0.1315","0.1507","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205977","7.346","0.002","14.306","0.004","8.396","0.002","90","","113.447","0.004","90","","809.5","0.4","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Chloro-2,6-bis(hydroxymethyl)phenol","","- C8 H9 Cl O3 -","- C8 H9 Cl O3 -","- C32 H36 Cl4 O12 -","4","1","HK6008","Chu, Zhao-Lian; Huang, Wei; Gou, Shao-Hua","4-Chloro-2,6-bis(hydroxymethyl)phenol","Acta Crystallographica Section E","2005","61","6","o1624","o1626","10.1107/S1600536805014054","","","0.71073","MoKα","","0.055","0.0391","","","0.0831","0.0886","","","","","","0.979","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205978","10.17","0.003","14.934","0.004","29.568","0.008","90","","90","","90","","4491","2","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","bis[(+)-(1R,4R)-3-(trifluoroacetyl)camphorato- κ^2^O,O'][bis(trimethylsilyl)amido-κN](1,3,5-trimethyl-1,3,5- triazacyclohexane-κ^3^N,N',N'')cerium(III)","","- C36 H61 Ce F6 N4 O4 Si2 -","- C36 H61 Ce F6 N4 O4 Si2 -","- C144 H244 Ce4 F24 N16 O16 Si8 -","4","1","HK6011","Niemeyer, Mark; Cristoffers, Jens; Michael Rössle","An optically active heteroleptic cerium camphorate: [bis(trimethylsilyl)amido-κ<i>N</i>]bis[(+)-(1<i>R</i>,4<i>R</i>)-3-(trifluoroacetyl)camphorato-κ^2^<i>O</i>,<i>O</i>'](1,3,5-trimethyl-1,3,5-triazacyclohexane-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')cerium(III)","Acta Crystallographica Section E","2005","61","6","m1207","m1209","10.1107/S1600536805016193","","","0.71073","MoKα","","0.053","0.041","","","0.097","0.103","","","","","","1.47","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2205979","10.0617","0.0004","14.6001","0.0006","7.5491","0.0003","90","","98.045","0.001","90","","1098.06","0.08","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[dimethyltin(IV)]-μ-benzene-1,4-dicarboxylato]","","- C10 H10 O4 Sn -","- C10 H10 O4 Sn -","- C40 H40 O16 Sn4 -","4","1","HK6012","Gong, Ya-Qiong; Wang, Rui-Hu; Lou, Ben-Yong; Hong, Mao-Chun","<i>catena</i>-Poly[[dimethyltin(IV)]-μ-benzene-1,4-dicarboxylato]","Acta Crystallographica Section E","2005","61","6","m1226","m1227","10.1107/S1600536805016466","","","0.71073","MoKα","","0.0411","0.0315","","","0.0761","0.0802","","","","","","0.983","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205980","18.033","0.005","39.553","0.005","7.265","0.005","90","","90","","90","","5182","4","295","","295","","","","","","","","","6","F d d 2","F 2 -2d","43","Bis(adeninium) hexachlorostannate(IV) hydrochloride hydrate","","","- C10 H22 Cl8 N10 O4 Sn -","- C10 H22 Cl8 N10 O4 Sn -","- C80 H176 Cl64 N80 O32 Sn8 -","8","0.5","IS6062","Bouacida, Sofiane; Hocine, Merazig; Beghidja, Adel; Beghidja, Chahrazed","Bis(adeninium) hexachlorostannate(IV) dichloride tetrahydrate","Acta Crystallographica Section E","2005","61","6","m1153","m1155","10.1107/S1600536805015163","","","0.71073","MoKα","","0.0291","0.0266","","","0.0597","0.061","","","","","","1.092","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205981","13.9","0.002","13.9","0.002","16.809","0.003","90","","90","","120","","2812.6","0.8","293","2","293","2","","","","","","","","5","P 64","P 64","172","","Tris(4,4',5,5'-tetramethyl-2,2'-biimidazole)zinc(II) dinitrate","","- C30 H42 N14 O6 Zn -","- C30 H42 N14 O6 Zn -","- C90 H126 N42 O18 Zn3 -","3","0.5","IS6066","Ru-Qiang Zou; Qiang Xu","Tris(4,4',5,5'-tetramethyl-2,2'-biimidazole)zinc(II) dinitrate","Acta Crystallographica Section E","2005","61","6","m1075","m1076","10.1107/S1600536805013954","","","0.71073","MoKα","","0.0592","0.0428","","","0.1034","0.111","","","","","","0.963","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2205982","6.0329","0.0005","9.4215","0.001","33.796","0.004","90","","90","","90","","1920.9","0.3","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(6R,7aS)-1,3,5,6,7,7a-Hexahydro-3-(2-hydroxyphenyl)-1,1- diphenylpyrrolo[1,2-c][1,3]oxazol-6-ol","","- C24 H23 N O3 -","- C24 H23 N O3 -","- C96 H92 N4 O12 -","4","1","IS6069","Zongxuan Shen; Ding Yi; Yawen Zhang; De-Chun Zhang","(6<i>R</i>,7a<i>S</i>)-1,3,5,6,7,7a-Hexahydro-3-(2-hydroxyphenyl)-1,1-diphenylpyrrolo[1,2-<i>c</i>][1,3]oxazol-6-ol","Acta Crystallographica Section E","2005","61","6","o1715","o1717","10.1107/S1600536805014303","","","0.7107","MoKα","","0.0444","0.0413","","","0.0909","0.0924","","","","","","1.15","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205983","9.7934","0.001","8.4835","0.0009","20.509","0.002","90","","91.098","0.002","90","","1703.6","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4,6-Dibenzoyl-1,3-dimethylbenzene","","- C22 H18 O2 -","- C22 H18 O2 -","- C88 H72 O8 -","4","1","IS6070","Wu, Wen-Yuan; Li, Yong-Xiu; Li, Yi-Zhi","4,6-Dibenzoyl-1,3-dimethylbenzene","Acta Crystallographica Section E","2005","61","6","o1828","o1829","10.1107/S1600536805015497","","","0.71073","MoKα","","0.086","0.0547","","","0.1171","0.125","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205984","10.8281","0.0019","10.8281","0.0019","19.043","0.004","90","","90","","90","","2232.7","0.7","293","2","293","2","","","","","","","","6","P 43","P 4cw","78","","Sodium [1,2-bis(2-methyl-2-oxopropanamido)benzene](tetrahydrofuran)manganese(III) methanol solvate","","- C19 H28 Mn N2 Na O6 -","- C19 H28 Mn N2 Na O6 -","- C76 H112 Mn4 N8 Na4 O24 -","4","1","IS6072","Berggren, Gustav; Anderlund, Magnus F.; Magnuson, Ann; Åkermark, Björn; Eriksson, Lars","Sodium [1,2-bis(2-methyl-2-oxopropanamido)benzene](tetrahydrofuran)manganese(III) methanol solvate","Acta Crystallographica Section E","2005","61","6","m1169","m1171","10.1107/S1600536805015230","","","0.71073","MoKα","","0.048","0.0363","","","0.0778","0.082","","","","","","0.976","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205985","10.536","0.002","19.225","0.005","9.5","0.002","90","","97.67","0.02","90","","1907.1","0.7","298","","298","","","","","","","","","5","P 1 21 1","P 2yb","4","","(+)-(4aR,9aS)-O-(4-Bromobenzoyl)-N-(3-methylanthracen-9-ylidene)hydroxylamine","","- C22 H20 Br N O2 -","- C22 H20 Br N O2 -","- C88 H80 Br4 N4 O8 -","4","2","IS6073","Ohba, Shigeru; Ishida, Naoyuki; Kato, Dai-ichiro; Miyamoto, Kenji; Ohta, Hiromichi","(+)-(4a<i>R</i>,9a<i>S</i>)-<i>O</i>-(4-Bromobenzoyl)-<i>N</i>-(3-methylanthracen-9-ylidene)hydroxylamine","Acta Crystallographica Section E","2005","61","6","o1620","o1621","10.1107/S1600536805013966","","","0.71073","MoKα","","","0.0626","","","","0.2314","","","","","","0.983","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2205986","5.2223","0.0013","11.781","0.003","22.738","0.005","90","","90","","90","","1398.9","0.6","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(9S)-2-(3-Benzoylthioureido)-3-methylbutyric acid","","- C13 H16 N2 O3 S -","- C13 H16 N2 O3 S -","- C52 H64 N8 O12 S4 -","4","1","IS6074","Ngah, Nurziana; Shah, Nabihah M.; Kassim, Mohammad B.; Yamin, Bohari M.","(2<i>S</i>)-2-(3-Benzoylthioureido)-3-methylbutyric acid","Acta Crystallographica Section E","2005","61","6","o1767","o1768","10.1107/S1600536805014662","","","0.71073","MoKα","","0.037","0.035","","","0.088","0.09","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205987","9.429","0.002","13.055","0.003","13.51","0.003","95.995","0.004","100.673","0.004","96.272","0.004","1611.2","0.6","203.2","","","","","","","","","","","10","P -1","-P 1","2","","Carbonyl(η^5^-cyclopentadienyl)(trimethylsilyl isocyanide)(triphenylphosphine)iron(II) trifluoromethanesulfonate dichloromethane hemisolvate","","- C29.5 H30 Cl F3 Fe N O4 P S Si -","- C29.5 H30 Cl F3 Fe N O4 P S Si -","- C59 H60 Cl2 F6 Fe2 N2 O8 P2 S2 Si2 -","2","1","IS6075","Hiroshi Nakazawa; Masumi Itazaki; Mari Owaribe","Carbonyl(η^5^-cyclopentadienyl)(trimethylsilyl isocyanide)(triphenylphosphine)iron(II) trifluoromethanesulfonate dichloromethane hemisolvate","Acta Crystallographica Section E","2005","61","6","m1172","m1173","10.1107/S1600536805015308","","","0.7107","MoKα","","","0.061","","","","0.154","","","","","","1.037","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2205988","15.1206","0.0006","18.5827","0.0008","24.89","0.001","90","","90.033","0.002","90","","6993.6","0.5","203.2","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Carbonyl(η^5^-cyclopentadienyl)(isocyanotriphenylborate- κC)(triphenylphosphine-κP)iron(II)","","- C43 H35 B Fe N O P -","- C43 H35 B Fe N O P -","- C344 H280 B8 Fe8 N8 O8 P8 -","8","2","IS6076","Hiroshi Nakazawa; Masumi Itazaki; Mari Owaribe","Carbonyl(η^5^-cyclopentadienyl)(isocyanotriphenylborato-κ<i>C</i>)(triphenylphosphine-κ<i>P</i>)iron(II)","Acta Crystallographica Section E","2005","61","6","m1166","m1168","10.1107/S1600536805015369","","","0.7107","MoKα","","","0.0704","","","","0.1165","","","","","","1.161","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2205989","8.436","0.001","10.8759","0.0012","12.1904","0.0014","73.9052","0.0018","85.9455","0.0019","81.3899","0.0019","1062","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","4-TPST","2,4,6-Tris(4-pyridylmethylsulfanyl)-1,3,5-triazine monohydrate","","- C21 H20 N6 O S3 -","- C21 H20 N6 O S3 -","- C42 H40 N12 O2 S6 -","2","1","IS6077","Amoore, Jarrod J. M.; Kepert, Cameron J.","2,4,6-Tris(4-pyridylmethylsulfanyl)-1,3,5-triazine monohydrate","Acta Crystallographica Section E","2005","61","6","o1900","o1901","10.1107/S1600536805016132","","","0.71073","MoKα","","0.04","0.0325","","","0.0783","0.0856","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205990","5.549","0.002","17.097","0.007","12.606","0.005","90","","92.647","0.01","90","","1194.7","0.8","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Sulfachloropyridazine","4-amino-N-(6-chloro-3-pyridazinyl)-benzenesulfnamide","","- C10 H9 Cl N4 O2 S -","- C10 H9 Cl N4 O2 S -","- C40 H36 Cl4 N16 O8 S4 -","4","1","IS6078","Yan-Shu Tan; Zhen-Feng Chen; Hong Liang; Yong Zhang","Sulfachloropyridazine","Acta Crystallographica Section E","2005","61","6","o1842","o1844","10.1107/S1600536805015576","","","0.7107","MoKα","","0.0491","0.0433","","","0.0965","0.0997","","","","","","1.099","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205991","7.1738","0.0014","6.3367","0.0013","14.782","0.003","90","","90","","90","","672","0.2","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","3,4-Methylenedioxy-benzaldehyde","3,4-Methylenedioxybenzaldehyde","","- C8 H6 O3 -","- C8 H6 O3 -","- C32 H24 O12 -","4","0.5","IS6080","Wang, Shui; Wang, Jing-Kang; Chen, Dong-Xiu","3,4-Methylenedioxybenzaldehyde","Acta Crystallographica Section E","2005","61","6","o1888","o1889","10.1107/S160053680501593X","","","0.71073","MoKα","","0.0535","0.0433","","","0.1131","0.1187","","","","","","0.987","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205992","8.4419","0.0004","8.5266","0.0002","22.3912","0.0004","90","","90.584","0.0011","90","","1611.65","0.09","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tris(1H-imidazole-κN^3^)(D,L-malato-κ^3^O,O',O'')nickel(II)","","- C13 H16 N6 Ni O5 -","- C13 H16 N6 Ni O5 -","- C52 H64 N24 Ni4 O20 -","4","1","IS6082","Dong-Dong Lin; Duan-Jun Xu","Tris(1<i>H</i>-imidazole-κ<i>N</i>^3^)(<small>DL</small>-malato-κ^3^<i>O</i>,<i>O</i>',<i>O</i>'')nickel(II)","Acta Crystallographica Section E","2005","61","6","m1215","m1217","10.1107/S1600536805016004","","","0.71073","MoKα","","0.044","0.037","","","0.086","0.089","","","","","","1.058","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205993","8.9283","0.0012","7.4852","0.0012","20.273","0.003","90","","97.032","0.011","90","","1344.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Acetyl-3-(benzoylamino)-1-benzofuran","","- C17 H13 N O3 -","- C17 H13 N O3 -","- C68 H52 N4 O12 -","4","1","JH6004","Ocak Ískeleli, Nazan; Kazak, Canan; Kırılmış, Cumhur; Koca, Murat","2-Acetyl-3-(benzoylamino)-1-benzofuran","Acta Crystallographica Section E","2005","61","6","o1571","o1573","10.1107/S1600536805013073","","","0.71073","MoKα","","0.1803","0.0728","","","0.1572","0.1954","","","","","","0.835","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205994","5.4773","0.0015","11.326","0.003","13.726","0.004","86.366","0.004","78.985","0.004","88.921","0.004","834.1","0.4","298","2","273","2","","","","","","","","6","P -1","-P 1","2","","Diaquadiisothiocyanatobis(pyridine N-oxide)cobalt(II)","","- C12 H14 Co N4 O4 S2 -","- C12 H14 Co N4 O4 S2 -","- C24 H28 Co2 N8 O8 S4 -","2","1","JH6006","Shi, Jing Min; Liu Zhe; Lu, Jian Jun; Liu, Lian Dong","Diaquadiisothiocyanatobis(pyridine <i>N</i>-oxide)cobalt(II)","Acta Crystallographica Section E","2005","61","6","m1133","m1134","10.1107/S1600536805014832","","","0.71073","MoKα","","0.0489","0.0432","","","0.115","0.1238","","","","","","1.142","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205995","8.124","0.001","7.2832","0.0005","16.3599","0.0019","90","","101.298","0.009","90","","949.24","0.18","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Benzyl 2-(2-chloro-4,5-dicyanophenoxy)benzoate","","- C22 H13 Cl N2 O3 -","- C22 H13 Cl N2 O3 -","- C44 H26 Cl2 N4 O6 -","2","1","JH6007","Ocak Ískeleli, Nazan; Ag̃ar, Ayşen","Benzyl 2-(2-chloro-4,5-dicyanophenoxy)benzoate","Acta Crystallographica Section E","2005","61","6","o1942","o1943","10.1107/S1600536805016648","","","0.71073","MoKα","","0.0621","0.0373","","","0.0978","0.1053","","","","","","0.922","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205996","8.168","0.003","10.933","0.003","28.446","0.008","90","","90","","90","","2540.2","1.4","273","2","273","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","24-Methylenecholest-4-ene-3β,6β-diol","","- C28 H46 O2 -","- C28 H46 O2 -","- C112 H184 O8 -","4","1","JH6008","Hui Lin; Shi-Hai Xu; Xiang-Chao Zeng; Xiao-Jian Liao","24-Methylenecholest-4-ene-3β,6β-diol","Acta Crystallographica Section E","2005","61","6","o1959","o1960","10.1107/S1600536805016740","","","0.71073","MoKα","","0.1019","0.0613","","","0.1777","0.2153","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2205997","7.491","0.003","23.458","0.008","14.302","0.005","90","","104.803","0.006","90","","2429.8","1.5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis(2,2'-bipyridine-κ^2^N,N')chlorocopper(II) tetrafluoroborate dichloromethane solvate","","- C21 H18 B Cl3 Cu F4 N4 -","- C21 H18 B Cl3 Cu F4 N4 -","- C84 H72 B4 Cl12 Cu4 F16 N16 -","4","1","KP6047","Linfang Jia; Wenfu Fu; Qi Yin; Mingming Yu; Junfeng Zhang; Zhanxian Li","Bis(2,2'-bipyridine-κ^2^<i>N,N</i>')chlorocopper(II) tetrafluoroborate dichloromethane solvate","Acta Crystallographica Section E","2005","61","6","m1039","m1041","10.1107/S1600536805013760","","","0.71073","MoKα","","0.1307","0.0737","","","0.1883","0.2227","","","","","","1.017","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2205998","9.171","0.003","9.428","0.002","16.783","0.002","77.19","0.01","75.44","0.01","75.11","0.01","1338.1","0.6","294","2","294","2","","","","","","","","5","P -1","-P 1","2","Nafimidone hemihydrate hemihydrochloride","3-methyl-1-[2-(2-naphthyloxy)ethyl]-1H-pyrazol-5-ol hydrochloride monohydrate","","- C30 H27 Cl N4 O3 -","- C30 H27 Cl N4 O3 -","- C60 H54 Cl2 N8 O6 -","2","1","LH6407","Hempel, Andrew; Camerman, Norman; Camerman, Arthur; Mastropaolo, Donald","Nafimidone hemihydrate hemihydrochloride","Acta Crystallographica Section E","2005","61","6","o1532","o1533","10.1107/S160053680501158X","","","1.54178","CuKα","","0.0642","0.0525","","","0.1554","0.1623","","","","","","1.18","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205999","11.2668","0.001","16.4542","0.0012","10.8049","0.0009","90","","111.798","0.002","90","","1859.9","0.3","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","10-Cyclopropyl-9-(4-methoxyphenyl)-1,2,3,4,5,6,7,8,9,10-decahydroacridine- 1,8-dione","","- C23 H25 N O3 -","- C23 H25 N O3 -","- C92 H100 N4 O12 -","4","1","LH6409","Shu-Jiang Tu; Yan Zhang; Xiao-Jing Zhang","10-Cyclopropyl-9-(4-methoxyphenyl)-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione","Acta Crystallographica Section E","2005","61","6","o1885","o1887","10.1107/S1600536805016168","","","0.7107","MoKα","","0.0678","0.0562","","","0.1341","0.1415","","","","","","1.113","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206000","7.1306","0.0014","16.417","0.003","10.2","0.002","90","","99.74","0.03","90","","1176.8","0.4","295","3","295","3","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[triaquacadmium(II)]-μ-4-carboxylatophenoxyacetato- κ^4^O,O':O'',O''']","","- C9 H12 Cd O8 -","- C9 H12 Cd O8 -","- C36 H48 Cd4 O32 -","4","1","LH6410","Gao, Shan; Gu, Chang-Sheng; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Jing-Gui","<i>catena</i>-Poly[[triaquacadmium(II)]-μ-4-carboxylatophenoxyacetato-κ^4^<i>O,O</i>':<i>O</i>'',<i>O</i>''']","Acta Crystallographica Section E","2005","61","6","m1092","m1094","10.1107/S1600536805012572","","","0.71073","MoKα","","0.0332","0.0306","","","0.0808","0.0825","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206001","28.83","0.005","10.896","0.002","8.879","0.002","90","","90","","90","","2789.2","0.9","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","Nafazatrom","3-methyl-1-[2-(2-naphthyloxy)ethyl]-1H-pyrazol-5-ol","","- C16 H16 N2 O2 -","- C16 H16 N2 O2 -","- C128 H128 N16 O16 -","8","1","LH6412","Hempel, Andrew; Camerman, Norman; Camerman, Arthur; Mastropaolo, Donald","The enol form of nafazatrom","Acta Crystallographica Section E","2005","61","6","o1544","o1545","10.1107/S1600536805012766","","","1.54178","CuKα","","0.1502","0.0469","","","0.1135","0.1759","","","","","","1.133","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206002","10.331","0.003","11.628","0.004","11.64","0.004","90","","116.034","0.005","90","","1256.4","0.7","294","2","294","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-(2,4-Dihydroxybenzoyl)benzoic acid","","- C14 H10 O5 -","- C14 H10 O5 -","- C56 H40 O20 -","4","1","LH6413","Li, Yang; Ge, Feng-Yan; Chen, Li-Gong; Dong, Chuan-Ming; Yan, Xi-Long; Duan, Er-Hong; Zeng, Tao; Zhang, Yue-Cheng; Bai, Guo-Yi","2-(2,4-Dihydroxybenzoyl)benzoic acid","Acta Crystallographica Section E","2005","61","6","o1769","o1770","10.1107/S1600536805014844","","","0.71073","MoKα","","0.0785","0.0485","","","0.1225","0.1459","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206003","5.739","0.002","33.684","0.005","6.003","0.002","90","","106.79","0.04","90","","1111","0.6","294","2","294","2","","","","","","","","4","P 1 21 1","P 2yb","4","Pargyline","N-benzyl-N-methylprop-2-yn-1-aminium chloride","","- C11 H14 Cl N -","- C11 H14 Cl N -","- C44 H56 Cl4 N4 -","4","2","LH6414","Hempel, Andrew; Camerman, Norman; Camerman, Arthur; Mastropaolo, Donald","Pargyline hydrochloride: a monoclinic form","Acta Crystallographica Section E","2005","61","6","o1595","o1597","10.1107/S1600536805013309","","","1.54178","CuKα","","0.087","0.0718","","","0.196","0.2064","","","","","","1.522","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206004","5.958","0.002","11.039","0.003","33.596","0.005","90","","90","","90","","2209.6","1","294","2","294","2","","","","","","","","4","P b c 21","P 2c -2b","29","Pargyline","N-benzyl-N-methylprop-2-yn-1-aminium chloride","","- C11 H14 Cl N -","- C11 H14 Cl N -","- C88 H112 Cl8 N8 -","8","2","LH6415","Hempel, Andrew; Camerman, Norman; Camerman, Arthur; Mastropaolo, Donald","Pargyline hydrochloride, a monoamine oxidase inhibitor: an orthorhombic form","Acta Crystallographica Section E","2005","61","6","o1598","o1600","10.1107/S1600536805013292","","","1.54178","CuKα","","0.0789","0.0647","","","0.1609","0.1669","","","","","","0.979","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206005","19.6924","0.0004","6.2383","0.0001","23.4415","0.0007","90","","112.474","0.001","90","","2661.01","0.11","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(Anthracen-9-ylmethyl)dimethylamine","","- C17 H17 N -","- C17 H17 N -","- C136 H136 N8 -","8","2","LH6418","Howie, R. Alan; Wardell, Solange M. S. V.","(Anthracen-9-ylmethyl)dimethylamine at 120 K","Acta Crystallographica Section E","2005","61","6","o1686","o1688","10.1107/S1600536805014200","","","0.71073","MoKα","","0.0977","0.0554","","","0.1219","0.14","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206006","9.7305","0.0009","10.5319","0.001","10.4759","0.001","90","","90.475","0.011","90","","1073.54","0.18","193","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C2 H9 Cl N2 -","- C2 H9 Cl N2 -","- C16 H72 Cl8 N16 -","8","2","LH6419","Merkoulov, Alexei; Harms, Klaus; Sundermeyer, Jörg","1,1-Dimethylhydrazinium chloride","Acta Crystallographica Section E","2005","61","6","o1800","o1801","10.1107/S1600536805014856","","","0.71073","MoKα","","","0.0271","","","","0.0618","","","","","","0.945","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206007","11.4352","0.0015","6.1405","0.0005","11.5469","0.0014","90","","97.785","0.015","90","","803.33","0.16","193","2","","","","","","","","","","5","P 1 21 1","P 2yb","4","","Methyl (1R,3R)-6-tert-butoxycarbonylamino-1,5-dioxo-2,3-dihydro-5H-1,3- thiazolo[3,2-a]pyridine-3-carboxylate","","- C14 H18 N2 O6 S -","- C14 H18 N2 O6 S -","- C28 H36 N4 O12 S2 -","2","1","LH6420","Seger, Harald; Marsch, Michael; Geyer, Armin; Harms, Klaus","(1<i>R</i>,3<i>R</i>)-Methyl 6-<i>tert</i>-butoxycarbonylamino-1,5-dioxo-2,3-dihydro-5<i>H</i>-1,3-thiazolo[3,2-<i>a</i>]pyridine-3-carboxylate","Acta Crystallographica Section E","2005","61","6","o1798","o1799","10.1107/S1600536805014868","","","0.71073","MoKα","","","0.0242","","","","0.0574","","","","","","0.989","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206008","10.2706","0.0001","12.5577","0.0002","13.3708","0.0002","90","","90","","90","","1724.5","0.04","123","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","O^1^,O^2^:O^3^,O^5^-Bis(phenylboranediyl)-α-D-glucofuranose","","- C18 H18 B2 O6 -","- C18 H18 B2 O6 -","- C72 H72 B8 O24 -","4","1","LH6421","Draffin, Scott P.; Duggan, Peter J.; Fallon, Gary D.; Tyndall, Edward M.","<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^3^,<i>O</i>^5^-Bis(phenylboranediyl)-α-<small>D</small>-glucofuranose","Acta Crystallographica Section E","2005","61","6","o1733","o1735","10.1107/S1600536805014480","","","0.71073","MoKα","","","0.0318","","","","0.07","","","","","","1.067","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206009","52.275","0.003","5.3605","0.0002","14.0209","0.0008","90","","104.952","0.002","90","","3795.9","0.3","120","2","120","2","","","","","","","","4","C 1 2 1","C 2y","5","","(1R,2R)-N,N'-bis(4-nitrophenylmethylene)cyclohexane-1,2-diamine","","- C20 H20 N4 O4 -","- C20 H20 N4 O4 -","- C160 H160 N32 O32 -","8","2","LH6422","Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Wardell, James L.","(1<i>R</i>,2<i>R</i>)-<i>N,N</i>'-Bis(4-nitrophenylmethylene)cyclohexane-1,2-diamine","Acta Crystallographica Section E","2005","61","6","o1699","o1701","10.1107/S1600536805014248","","","0.71073","MoKα","","0.1205","0.0602","","","0.1051","0.1243","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206010","14.118","0.002","9.1179","0.0014","16.756","0.003","90","","98.839","0.002","90","","2131.3","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(4-aminopyridinium) tetrathiocyanatocobalt(II)","","- C14 H14 Co N8 S4 -","- C14 H14 Co N8 S4 -","- C56 H56 Co4 N32 S16 -","4","1","LH6423","Shi, Jing Min; Zhang, Feng Xia; Lu, Jian Jun; Liu, Lian Dong","Bis(4-aminopyridinium) tetrathiocyanatocobaltate(II)","Acta Crystallographica Section E","2005","61","6","m1181","m1182","10.1107/S1600536805015540","","","0.71073","MoKα","","0.0924","0.0633","","","0.1379","0.1493","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206011","7.0237","0.0003","12.8964","0.0007","13.3517","0.0007","106.63","0.003","101.423","0.003","102.274","0.003","1088.18","0.1","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","11-(4-bromophenyl)-10-methyl-8-phenyl-6,8-dihydro-5H- benzo[f]pyrazolo[3,4-b]quinoline","","- C27 H20 Br N3 -","- C27 H20 Br N3 -","- C54 H40 Br2 N6 -","2","1","LH6424","Serrano, Hugo; Quiroga, Jairo; Cobo, Justo; Low, John N.; Glidewell, Christopher","11-(4-Bromophenyl)-10-methyl-8-phenyl-6,8-dihydro-5<i>H</i>-benzo[<i>f</i>]pyrazolo[3,4-<i>b</i>]quinoline","Acta Crystallographica Section E","2005","61","6","o1702","o1703","10.1107/S1600536805014479","","","0.71073","MoKα","","0.102","0.0469","","","0.0878","0.1023","","","","","","1.025","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206012","12.4441","0.0002","12.7433","0.0002","14.5723","0.0002","73.504","0.001","81.836","0.001","85.061","0.001","2190.74","0.06","100","2","100","2","","","","","","","","7","P -1","-P 1","2","[Fe(TPP)(4-MeHIm)~2~]2(K(222)Cl)","(5-methyl-4H-imidazole)(5,10,15,20-tetraphenylporphyrinato)iron(II) bis[(222-cryptand)potassium(I)] dichloride","","- C88 H112 Cl2 Fe K2 N12 O12 -","- C88 H112 Cl2 Fe K2 N12 O12 -","- C88 H112 Cl2 Fe K2 N12 O12 -","1","0.5","LH6425","Silvernail, Nathan J.; Noll, Bruce C.; Scheidt, W. Robert","A cytochrome b model, [Fe(TPP)(4-MeHIm)~2~][K(222-cryptand)]~2~Cl~2~","Acta Crystallographica Section E","2005","61","6","m1201","m1203","10.1107/S1600536805015989","","","0.71073","MoKα","","0.0563","0.0435","","","0.1199","0.128","","","","","","1.055","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206013","6.506","0.003","9.294","0.004","18.822","0.008","90","","94.781","0.006","90","","1134.1","0.9","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","catena-Poly[[[tetraaquazinc(II)]-μ-[(2E)-N,N'-bis(pyridin-4-ylmethyl)but-2- enediamide]] dinitrate]","catena-Poly[[[tetraaquazinc(II)]-μ-[(2E)-N,N'-bis(pyridin-4-ylmethyl)but-2- enediamide]] dinitrate]","","- C16 H24 N6 O12 Zn -","- C16 H24 N6 O12 Zn -","- C32 H48 N12 O24 Zn2 -","2","0.5","LH6427","Gareth O. Lloyd","<i>catena</i>-Poly[[[tetraaquazinc(II)]-μ-[(2<i>E</i>)-<i>N,N</i>'-bis(pyridin-4-ylmethyl)but-2-enediamide]] dinitrate]","Acta Crystallographica Section E","2005","61","6","m1204","m1206","10.1107/S1600536805015291","","","0.71073","MoKα","","0.0389","0.031","","","0.0767","0.0806","","","","","","1.031","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206014","6.946","0.002","10.204","0.002","12.088","0.004","90","","90","","90","","856.8","0.4","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","5-Acetoxy-1-acetyl-3-pyrrolin-2-one","","- C8 H9 N O4 -","- C8 H9 N O4 -","- C32 H36 N4 O16 -","4","1","LH6429","Tooke, Duncan M.; Lutz, Martin; Spek, Anthony L.","5-Acetoxy-1-acetyl-3-pyrrolin-2-one","Acta Crystallographica Section E","2005","61","6","o1877","o1879","10.1107/S160053680501545X","","","0.71073","MoKα","","0.0699","0.0415","","","0.0795","0.0897","","","","","","1.057","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206015","9.4952","0.0002","13.2026","0.0003","31.5269","0.0006","90","","90","","90","","3952.25","0.14","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","cyclo-tetrakis{μ~2~-[(dimethylamino)methyl]phenyl-κ^3^C^2^:C^2^,N}copper tetrahydrofuran solvate","cyclo-tetrakis{μ~2~-[(dimethylamino)methyl]phenyl-κ^3^C^2^:C^2^,N}copper tetrahydrofuran solvate","","- C40 H56 Cu4 N4 O -","- C40 H56 Cu4 N4 O -","- C160 H224 Cu16 N16 O4 -","4","1","LH6430","Tooke, Duncan M.; Lutz, Martin; Spek, Anthony L.","A second polymorph of <i>cyclo</i>-tetrakis{μ~2~-[(dimethylamino)methyl]phenyl-κ^3^<i>C</i>^2^:<i>C</i>^2^,<i>N</i>}copper tetrahydrofuran solvate","Acta Crystallographica Section E","2005","61","6","m1245","m1247","10.1107/S1600536805016685","","","0.71073","MoKα","","0.0201","0.0187","","","0.0438","0.0448","","","","","","1.041","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206016","8.7413","0.0004","9.0199","0.0005","12.8984","0.0005","93.027","0.003","98.039","0.003","90.032","0.002","1005.55","0.08","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","2-(2,4-Dimethylphenyl)-4-isopropyl-1-methylisoquinolinium hexafluorophosphate","","- C21 H24 F6 N P -","- C21 H24 F6 N P -","- C42 H48 F12 N2 P2 -","2","1","LH6431","Tooke, Duncan M.; Lutz, Martin; Spek, Anthony L.","2-(2,4-Dimethylphenyl)-4-isopropyl-1-methylisoquinolinium hexafluorophosphate","Acta Crystallographica Section E","2005","61","6","o1875","o1876","10.1107/S1600536805015461","","","0.71073","MoKα","","0.0855","0.0481","","","0.111","0.1241","","","","","","0.992","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206017","10.707","0.006","12.103","0.008","10.8","0.006","90","","91.25","0.05","90","","1399.2","1.4","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4',5',6',7'-Tetrachlorospiro[cyclohex-2-ene-1,2'-indan]-1',3'-dione","","- C14 H8 Cl4 O2 -","- C14 H8 Cl4 O2 -","- C56 H32 Cl16 O8 -","4","1","LH6435","McSweeney, Nigel; Pratt, Albert C.; Long, Conor; Howie, R. Alan","4',5',6',7'-Tetrachlorospiro[cyclohex-2-ene-1,2'-indan]-1',3'-dione","Acta Crystallographica Section E","2005","61","6","o1904","o1906","10.1107/S1600536805015904","","","0.71073","MoKα","","0.141","0.0704","","","0.1691","0.1977","","","","","","0.987","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206018","14.6729","0.0005","17.8962","0.0006","16.2619","0.0003","90","","90","","90","","4270.2","0.2","120","2","120","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","3-(5-Chloro-3-methyl-1-phenylpyrazol-4-yl)-1,5-di-2-thienylpentane-1,5-dione","","- C23 H19 Cl N2 O2 S2 -","- C23 H19 Cl N2 O2 S2 -","- C184 H152 Cl8 N16 O16 S16 -","8","1","LH6436","Trilleras, Jorge; Quiroga, Jairo; Cobo, Justo; Low, John N.; Glidewell, Christopher","3-(5-Chloro-3-methyl-1-phenylpyrazol-4-yl)-1,5-di-2-thienylpentane-1,5-dione: centrosymmetric dimers formed by C—H···π(thiophene) hydrogen bonds","Acta Crystallographica Section E","2005","61","6","o1892","o1894","10.1107/S1600536805015886","","","0.71073","MoKα","","0.0886","0.0456","","","0.1006","0.1172","","","","","","1.034","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206019","9.4722","0.0004","6.9227","0.0002","11.7322","0.0003","90","","103.203","0.003","90","","748.98","0.04","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","saccharin","Saccharin","","- C7 H5 N O3 S -","- C7 H5 N O3 S -","- C28 H20 N4 O12 S4 -","4","1","LH6438","Wardell, James L.; Low, John N.; Glidewell, Christopher","Saccharin, redetermined at 120K: a three-dimensional hydrogen-bonded framework","Acta Crystallographica Section E","2005","61","6","o1944","o1946","10.1107/S1600536805016600","","","0.71073","MoKα","","0.0461","0.0387","","","0.089","0.092","","","","","","1.107","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206020","21.8382","0.0008","21.8382","0.0008","21.8382","0.0008","90","","90","","90","","10414.8","0.7","291","2","291","2","","","","","","","","3","F -4 3 m","F -4 2 3","216","cerium palladium indide","cerium palladium indide","","- Ce20 In67 Pd36 -","- Ce20 In67 Pd36 -","- Ce80 In268 Pd144 -","4","0.0416667","MG6031","Tursina, Anna I.; Nesterenko, Sergei N.; Noël, Henri; Seropegin, Yuri D.","A new ternary indide, Ce~20~Pd~36~In~67~","Acta Crystallographica Section E","2005","61","6","i99","i101","10.1107/S1600536805013048","","","0.71073","MoKα","","0.0395","0.0339","","","0.0724","0.0792","","","","","","1.256","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206021","11.6495","0.0006","11.6495","0.0006","4.5128","0.0008","90","","90","","90","","612.44","0.12","291","2","291","2","","","","","","","","5","I -4","I -4","82","cadmium mercury selenocyanate","cadmium mercury selenocyanate","","- C4 Cd Hg N4 Se4 -","- C4 Cd Hg N4 Se4 -","- C8 Cd2 Hg2 N8 Se8 -","2","0.25","MG6034","Sun, Hai-Qing; Yu, Wen-Tao; Yuan, Duo-Rong; Wang, Xin-Qiang; Xue, Gang","Cadmium mercury selenocyanate, CdHg(SeCN)~4~","Acta Crystallographica Section E","2005","61","6","i111","i112","10.1107/S1600536805015771","","","0.71073","MoKα","","0.0522","0.047","","","0.1144","0.1187","","","","","","1.09","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206022","6.9463","0.0008","7.2563","0.0009","15.0697","0.0018","90","","94.791","0.002","90","","756.93","0.16","293","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","cadmium polysilicate","tricadmium trisilicate","","- Cd3 O9 Si3 -","- Cd3 O9 Si3 -","- Cd12 O36 Si12 -","4","1","MG6035","Weil, Matthias","Parawollastonite-type Cd~3~[Si~3~O~9~]","Acta Crystallographica Section E","2005","61","6","i102","i104","10.1107/S1600536805015278","","","0.71073","MoKα","","0.0281","0.0235","","","0.0583","0.0639","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206023","12.2953","0.0008","5.0596","0.0003","15.9134","0.0009","90","","106.202","0.007","90","","950.64","0.11","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","lutetium oxotellurate","lutetium(III) oxotellurate(IV)","","- Lu2 O11 Te4 -","- Lu2 O11 Te4 -","- Lu8 O44 Te16 -","4","0.5","MG6036","Höss, Patrick; Starkulla, Gundula; Schleid, Thomas","Lutetium(III) oxotellurate(IV), Lu~2~Te~4~O~11~","Acta Crystallographica Section E","2005","61","6","i113","i115","10.1107/S1600536805016090","","","0.71069","MoKα","","0.0618","0.0336","","","0.0643","0.0739","","","","","","1.001","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206024","8.845","0.003","13.335","0.005","5.5203","0.001","90","","95.1","0.02","90","","648.5","0.3","295","","295","","","","","","","","","5","P 1 21 1","P 2yb","4","","N-(2-nitrobenzenesulfonyl)-L-alanine methyl ester","","- C10 H12 N2 O6 S -","- C10 H12 N2 O6 S -","- C20 H24 N4 O12 S2 -","2","1","NC6028","Laurent F. Bornaghi; Sally-Ann Poulsen; Peter C. Healy; Alan R. White","<i>N</i>-(2-Nitrobenzenesulfonyl)-<small>L</small>-alanine methyl ester","Acta Crystallographica Section E","2005","61","6","o1665","o1667","10.1107/S1600536805014315","","","0.7107","MoKα","","0.0549","0.0357","","","0.0962","0.1055","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206025","7.388","0.002","9.2652","0.0015","15.117","0.004","90","","100.37","0.03","90","","1017.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","1-Ethyl-2,3-dimethylimidazoliumbromide*H~2~O","1-Ethyl-2,3-dimethylimidazolium bromide monohydrate","","- C7 H15 Br N2 O -","- C7 H15 Br N2 O -","- C28 H60 Br4 N8 O4 -","4","1","NC6030","Babai, Arash; Mudring, Anja","1-Ethyl-2,3-dimethylimidazolium bromide monohydrate","Acta Crystallographica Section E","2005","61","6","o1534","o1535","10.1107/S1600536805012948","","","0.71073","MoKα","","0.0893","0.0541","","","0.1477","0.1681","","","","","","1.046","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206026","8.8003","0.0002","9.2012","0.0002","9.3735","0.0003","64.6999","0.0016","76.052","0.0015","83.7398","0.0018","665.95","0.03","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","10-Methoxydibenz[b,f]azepine-5-carboxamide","","- C16 H14 N2 O2 -","- C16 H14 N2 O2 -","- C32 H28 N4 O4 -","2","1","NC6031","Basavegowda Nagaraj; Hemmige S. Yathirajan; Rajenahally S. Narasegowda; Padmarajaiah Nagaraja; Daniel E. Lynch","10-Methoxydibenz[<i>b</i>,<i>f</i>]azepine-5-carboxamide","Acta Crystallographica Section E","2005","61","6","o1760","o1761","10.1107/S1600536805014601","","","0.71073","MoKα","","0.0604","0.0497","","","0.1287","0.136","","","","","","1.074","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206027","7.0452","0.0003","11.2345","0.0004","11.7627","0.0005","91.838","0.002","96.23","0.002","98.71","0.001","913.72","0.06","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","ethylenediaminium‒3,5-dinitrobenzoate‒3,5-dinitrobenzoic acid (1/2/2), C~2~H~10~N~2~^2+^.2C~7~H~3~N~2~O~6~^-^.2C~7~H~4~N~2~O~6~","","- C30 H24 N10 O24 -","- C30 H24 N10 O24 -","- C30 H24 N10 O24 -","1","0.5","NG6162","Jones, Helen P.; Gillon, Amy L.; Davey, Roger J.","A co-crystal of ethylenediammonium bis(3,5-dinitrobenzoate) and 3,5-dinitrobenzoic acid","Acta Crystallographica Section E","2005","61","6","o1823","o1825","10.1107/S1600536805015333","","","0.71073","MoKα","","0.072","0.0458","","","0.1196","0.1355","","","","","","1.011","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2206028","9.58","0.003","9.552","0.002","13.677","0.004","90","","99.489","0.004","90","","1234.4","0.6","290","2","290","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-amino-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate","","- C12 H17 N O2 S -","- C12 H17 N O2 S -","- C48 H68 N4 O8 S4 -","4","1","OB6500","K. A. Nirmala; Vasu; Deepak Chopra; S. Mohan; M. Raghu Prasad","Ethyl 2-amino-5,6,7,8-tetrahydro-4<i>H</i>-cyclohepta[<i>b</i>]thiophene-3-carboxylate","Acta Crystallographica Section E","2005","61","6","o1541","o1543","10.1107/S1600536805012808","","","0.71073","MoKα","","0.0428","0.0383","","","0.0981","0.1016","","","","","","1.098","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206029","10.618","0.003","16.224","0.004","6.9661","0.0015","90","","90","","90","","1200","0.5","296","2","296","2","","","","","","","","3","P n a 21","P 2c -2n","33","(4aS*,7aR*)-2,10-Dioxoperhydrobenzo[d]naphthalene","(4aS*,7aR*)-2,10(3H,11H)-Dioxooctahydro-1H-benzo[d]naphthalene","","- C14 H20 O2 -","- C14 H20 O2 -","- C56 H80 O8 -","4","1","OB6505","Thompson, Hugh W.; Lalancette, Roger A.","(4a<i>S</i>*,7a<i>R</i>*)-2,10-Dioxoperhydrobenzo[<i>d</i>]naphthalene","Acta Crystallographica Section E","2005","61","6","o1614","o1616","10.1107/S1600536805013759","","","0.71073","MoKα","","0.09","0.045","","","0.074","0.086","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206030","13.973","0.003","11.203","0.002","12.83","0.003","90","","102.367","0.004","90","","1961.8","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[[diaqua(6-carboxypyridine-2-carboxylato- κ^3^N,O,O')samarium(III)]-μ-pyridine-2,6-dicarboxylato-κ^4^N,O,O':O''] tetrahydrate]","","- C14 H19 N2 O14 Sm -","- C14 H19 N2 O14 Sm -","- C56 H76 N8 O56 Sm4 -","4","1","OB6508","Liu, San-Hui; Li, Yi-Zhi; Meng, Qing-Jin","<i>catena</i>-Poly[[[diaqua(6-carboxypyridine-2-carboxylato-κ^3^<i>N,O,O</i>')samarium(III)]-μ-pyridine-2,6-dicarboxylato-κ^4^<i>N,O,O</i>':<i>O</i>''] tetrahydrate]","Acta Crystallographica Section E","2005","61","6","m1111","m1113","10.1107/S1600536805012894","","","0.71073","MoKα","","0.0842","0.0622","","","0.149","0.156","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206031","8.762","0.001","6.7707","0.0008","19.841","0.002","90","","96.515","0.002","90","","1169.5","0.2","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Triaqua(2-carboxylatophenoxyactetato)cobalt(II)","","- C9 H12 Co O8 -","- C9 H12 Co O8 -","- C36 H48 Co4 O32 -","4","1","OB6510","Meng, Fa-Yan; Zhu, Li-Hong; Zeng, Ming-Hua; Ng, Seik Weng","<i>mer</i>-Triaqua(2-carboxylatophenoxyacetato)cobalt(II)","Acta Crystallographica Section E","2005","61","6","m1126","m1127","10.1107/S1600536805012961","","","0.71073","MoKα","","0.037","0.028","","","0.074","0.078","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206032","5.1003","0.0013","9.244","0.003","15.274","0.004","102.2","0.5","90.64","0.02","99.87","0.02","692.6","1.4","298","","298","","","","","","","","","4","P -1","-P 1","2","","","","- C16 H14 N2 O4 -","- C16 H14 N2 O4 -","- C32 H28 N4 O8 -","2","1","OB6511","Shunsuke Ueda; Takeo Fukunaga; Hiroyuki Ishida","Benzimidazolium hydrogen phenylmalonate","Acta Crystallographica Section E","2005","61","6","o1845","o1847","10.1107/S1600536805013656","","","0.71073","MoKα","","0.13","0.059","","0.214","","0.214","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206033","33.257","0.004","4.2682","0.0006","21.589","0.003","90","","123.872","0.007","90","","2544.4","0.6","93.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","2,9-Dichloroquino[2,3-b]acridine-7,14(5H,12H)-dithione dimethylformamide disolvate","","- C26 H24 Cl2 N4 O2 S2 -","- C26 H24 Cl2 N4 O2 S2 -","- C104 H96 Cl8 N16 O8 S8 -","4","0.5","OB6512","Senju, Takatoshi; Hoki, Tomonori; Mizuguchi, Jin","2,9-Dichloroquino[2,3-<i>b</i>]acridine-7,14(5<i>H</i>,12<i>H</i>)-dithione dimethylformamide disolvate","Acta Crystallographica Section E","2005","61","6","o1617","o1619","10.1107/S1600536805013334","","","1.5418","CuKα","","","0.034","","","","0.096","","","","","","1.098","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206034","12.454","0.005","7.807","0.002","12.825","0.005","90","","105.269","0.005","90","","1202.9","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[bis(μ-3-pyridinecarboxylato-κ^3^N,O:O')cadmium(II)]","","- C12 H8 Cd N2 O4 -","- C12 H8 Cd N2 O4 -","- C48 H32 Cd4 N8 O16 -","4","1","OB6513","Liang, Yong; Li, Wei","Poly[bis(μ-3-pyridinecarboxylato-κ^3^<i>N</i>,<i>O</i>:<i>O</i>')cadmium(II)]","Acta Crystallographica Section E","2005","61","6","m1135","m1137","10.1107/S1600536805014698","","","0.71073","MoKα","","0.0408","0.0367","","","0.1239","0.1297","","","","","","1.211","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206035","11.609","0.001","9.754","0.001","7.6157","0.0008","90","","91.448","0.002","90","","862.08","0.15","295","2","295","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Hexaaquacobalt(II) bis(6-hydroxypyridine-3-carboxylate)","","- C12 H20 Co N2 O12 -","- C12 H20 Co N2 O12 -","- C24 H40 Co2 N4 O24 -","2","0.25","OB6516","Zhang, Xue-Li; Ng, Seik Weng","Hexaaquacobalt(II) bis(6-hydroxypyridine-3-carboxylate)","Acta Crystallographica Section E","2005","61","6","m1140","m1141","10.1107/S1600536805014911","","","0.71073","MoKα","","0.055","0.054","","","0.159","0.159","","","","","","1.19","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2206036","11.556","0.001","9.767","0.001","7.5422","0.0008","90","","91.32","0.002","90","","851.04","0.15","295","2","295","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Hexaaquanickel(II) bis(6-hydroxypyridine-3-carboxylate)","","- C12 H20 N2 Ni O12 -","- C12 H20 N2 Ni O12 -","- C24 H40 N4 Ni2 O24 -","2","0.25","OB6517","Zhang, Xue-Li; Ng, Seik Weng","Hexaaquanickel(II) bis(6-hydroxypyridine-3-carboxylate)","Acta Crystallographica Section E","2005","61","6","m1142","m1143","10.1107/S1600536805014923","","","0.71073","MoKα","","0.043","0.041","","","0.11","0.111","","","","","","1.12","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2206037","13.3063","0.0007","9.8112","0.0003","13.9186","0.0007","90","","91.702","0.004","90","","1816.28","0.14","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(3-Mesityl-3-methylcyclobutyl)-2-(piperidin-1-yl)ethanone","","- C21 H31 N O -","- C21 H31 N O -","- C84 H124 N4 O4 -","4","1","OB6518","Dinçer, Muharrem; Özdemir, Namık; Çukurovalı, Alaaddin; Yılmaz, İbrahim","1-(3-Mesityl-3-methylcyclobutyl)-2-(piperidin-1-yl)ethanone","Acta Crystallographica Section E","2005","61","6","o1754","o1756","10.1107/S160053680501487X","","","0.71073","MoKα","","0.0545","0.0427","","","0.1064","0.1123","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206038","14.0463","0.0012","7.7507","0.0007","25.092","0.002","90","","90.446","0.006","90","","2731.6","0.4","93.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2,9-dichloro-5,12-dihydroquino[2,3-b]acridine- 7,14-dithione dimethylacetamide disolvate","","- C28 H28 Cl2 N4 O2 S2 -","- C28 H28 Cl2 N4 O2 S2 -","- C112 H112 Cl8 N16 O8 S8 -","4","1","OB6519","Hoki, Tomonori; Senju, Takatoshi; Mizuguchi, Jin","The monoclinic form of 2,9-dichloro-5,12-dihydroquino[2,3-<i>b</i>]acridine-7,14-dithione dimethylacetamide disolvate","Acta Crystallographica Section E","2005","61","6","o1927","o1929","10.1107/S1600536805016624","","","1.5418","CuKα","","","0.0444","","","","0.1365","","","","","","1.088","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206039","7.156","0.002","8.941","0.003","11.487","0.004","104.32","0.02","96.91","0.02","107.369","0.018","664.5","0.4","93.1","","","","","","","","","","","6","P -1","-P 1","2","","2,9-dichloro-5,12-dihydroquino[2,3-b]acridine- 7,14-dithione dimethylacetamide disolvate","","- C28 H28 Cl2 N4 O2 S2 -","- C28 H28 Cl2 N4 O2 S2 -","- C28 H28 Cl2 N4 O2 S2 -","1","0.5","OB6520","Senju, Takatoshi; Hoki, Tomonori; Mizuguchi, Jin","The triclinic form of 2,9-dichloro-5,12-dihydroquino[2,3-<i>b</i>]acridine-7,14-dithione dimethylacetamide disolvate","Acta Crystallographica Section E","2005","61","6","o1930","o1932","10.1107/S1600536805016636","","","1.5418","CuKα","","","0.0608","","","","0.2165","","","","","","1.181","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2206040","8.9387","0.0007","9.1043","0.0007","10.6069","0.0008","88.509","0.006","85.498","0.006","80.661","0.006","849.05","0.11","296","","296","","","","","","","","","5","P -1","-P 1","2","","4-Allyl-2-(morpholin-4-ylmethyl)-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4- triazole-3-thione","","- C15 H19 N5 O S -","- C15 H19 N5 O S -","- C30 H38 N10 O2 S2 -","2","1","OB6523","Dinçer, Muharrem; Özdemir, Namık; Dege, Necmi; Çetin, Ahmet; Cansız, Ahmet; Şekerci, Memet","4-Allyl-2-(morpholin-4-ylmethyl)-5-(pyridin-4-yl)-2,4-dihydro-3<i>H</i>-1,2,4-triazole-3-thione","Acta Crystallographica Section E","2005","61","6","o1953","o1955","10.1107/S1600536805015953","","","0.71073","MoKα","","0.0485","0.0403","","","0.1095","0.1147","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206041","7.3576","0.0003","10.4263","0.0005","11.9471","0.0005","90","","102.908","0.001","90","","893.33","0.07","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Creatininium dihydrogenarsenate","","- C4 H10 As N3 O5 -","- C4 H10 As N3 O5 -","- C16 H40 As4 N12 O20 -","4","1","OB6525","Wilkinson, Hazel S.; Harrison, William T. A.","Creatininium dihydrogenarsenate","Acta Crystallographica Section E","2005","61","6","m1228","m1230","10.1107/S1600536805016144","","","0.71073","MoKα","","0.044","0.027","","","0.065","0.0686","","","","","","0.999","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206042","20.797","0.004","5.068","0.001","16.253","0.003","90","","116.42","0.01","90","","1534.1","0.5","123.1","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Bis(4-chloromethyl-2,5-dimethyl-3-thienyl)methane","","- C15 H18 Cl2 S2 -","- C15 H18 Cl2 S2 -","- C60 H72 Cl8 S8 -","4","0.5","OB6526","Masataka Watanabe; Asami Miura; Taisuke Matsumoto; Shuntaro Mataka; Thies Thiemann","Bis(4-chloromethyl-2,5-dimethyl-3-thienyl)methane","Acta Crystallographica Section E","2005","61","6","o1936","o1938","10.1107/S1600536805016533","","","1.5419","CuKα","","","0.03","","","","0.102","","","","","","1.001","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206043","8.5226","0.001","12.2353","0.0015","13.2586","0.0016","90","","105.095","0.002","90","","1334.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methanol(2-methyl-1H-imidazole-κ^3^)(pyridine-2,6-dicarboxylato- κ^3^N,O,O')copper(II)","","- C12 H13 Cu N3 O5 -","- C12 H13 Cu N3 O5 -","- C48 H52 Cu4 N12 O20 -","4","1","OM6237","Liu, San-Hui; Li, Yi-Zhi; Meng, Qing-Jin","Methanol(2-methyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)(pyridine-2,6-dicarboxylato-κ^3^<i>N</i>,<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section E","2005","61","6","m1183","m1184","10.1107/S1600536805015564","","","0.71073","MoKα","","0.039","0.0332","","","0.0855","0.0877","","","","","","0.99","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206044","10.1699","0.0018","16.883","0.003","12.49","0.002","90","","100.126","0.003","90","","2111.1","0.6","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Fe(phen)~2~Cl~2~","Dichlorobis(1,10-phenanthroline)iron(II)","","- C24 H16 Cl2 Fe N4 -","- C24 H16 Cl2 Fe N4 -","- C96 H64 Cl8 Fe4 N16 -","4","1","OM6242","Xu-Cheng Fu; Ming-Tian Li; Cheng-Gang Wang","<i>cis</i>-Dichlorobis(1,10-phenanthroline)iron(II)","Acta Crystallographica Section E","2005","61","6","m1221","m1222","10.1107/S1600536805016156","","","0.71073","MoKα","","0.1036","0.0665","","","0.1346","0.1492","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206045","14.043","0.002","12.4625","0.0017","15.147","0.002","90","","107.328","0.002","90","","2530.6","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,2'-{2,11-Bis[(3H-1,3-benzimidazol-1-ium-2-yl)methyl]-5,8-dioxa- 2,11-diazadodecane-1,12-diyl}bis(3H-1,3-benzimidazol-1-ium) dichloride diperchlorate methanol disolvate","","- C40 H52 Cl4 N10 O12 -","- C40 H52 Cl4 N10 O12 -","- C80 H104 Cl8 N20 O24 -","2","0.5","RN6046","Qin, Shi-Dong; Feng, Si-Si; Zhang Hong-Mei; Yang, Pin; Zhu, Miao-Li","2,2'-{2,11-Bis[(3<i>H</i>-1,3-benzimidazol-1-ium-2-yl)methyl]-5,8-dioxa-2,11-diazadodecane-1,12-diyl}bis(3<i>H</i>-1,3-benzimidazol-1-ium) dichloride diperchlorate methanol disolvate","Acta Crystallographica Section E","2005","61","6","o1574","o1576","10.1107/S1600536805013723","","","0.71073","MoKα","","0.1218","0.0879","","","0.2489","0.2667","","","","","","0.956","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206046","5.6995","0.0013","17.916","0.004","7.0525","0.0017","90","","99.424","0.005","90","","710.4","0.3","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","(9S)-2-(3-Benzoylthioureido)-3-(1H-imidazol-4-yl)propionic acid","(9S)-2-(3-benzoylthioureido)-3-(1H-imidazolium-4-yl)propionate","","- C14 H14 N4 O3 S -","- C14 H14 N4 O3 S -","- C28 H28 N8 O6 S2 -","2","1","RN6047","Ngah, Nurziana; Shah, Nabihah M.; Yusof, Rusila; Yamin, Bohari M","(2<i>S</i>)-2-(3-Benzoylthioureido)-3-(1<i>H</i>-imidazol-4-yl)propionic acid","Acta Crystallographica Section E","2005","61","6","o1689","o1691","10.1107/S160053680501442X","","","0.71073","MoKα","","0.039","0.039","","","0.096","0.097","","","","","","1.14","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206047","11.3184","0.001","7.6823","0.0007","16.8656","0.0012","90","","90","","90","","1466.5","0.2","298","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-aminophenylacetic acid","","- C8 H9 N O2 -","- C8 H9 N O2 -","- C64 H72 N8 O16 -","8","1","RZ6070","Sandra Gracin; Michael Svärd; Andreas Fischer","4-Aminophenylacetic acid","Acta Crystallographica Section E","2005","61","6","o1536","o1537","10.1107/S1600536805012754","","","0.71073","MoKα","","0.0865","0.0589","","","0.1147","0.1332","","","","","","1.159","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206048","14.4453","0.0012","6.3267","0.0005","24.4965","0.0019","90","","104.517","0.006","90","","2167.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,5-Diphenyl-4-(3,4,5-trimethoxybenzylamino)-4H-1,2,4-triazole","","- C24 H24 N4 O3 -","- C24 H24 N4 O3 -","- C96 H96 N16 O12 -","4","1","RZ6071","Ocak Ískeleli, Nazan; Çoruh, Ufuk; Bekircan, Olcay; Ağar, Ayşen; Şaşmaz, Selami; Erdönmez, Ahmet","3,5-Diphenyl-4-(3,4,5-trimethoxybenzylamino)-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2005","61","6","o1659","o1661","10.1107/S1600536805014443","","","0.71073","MoKα","","0.0744","0.0488","","","0.1378","0.151","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206049","21","0.004","13.343","0.002","3.6863","0.0006","90","","90","","90","","1032.9","0.3","298","2","298","2","","","","","","","","3","P n a 21","P 2c -2n","33","","Trimesic acid dihydrate","","- C9 H10 O8 -","- C9 H10 O8 -","- C36 H40 O32 -","4","1","RZ6072","Zhen-Zhong Fan; Xin-Hua Li; Guo-Ping Wang","Trimesic acid dihydrate","Acta Crystallographica Section E","2005","61","6","o1607","o1608","10.1107/S1600536805014194","","","0.71073","MoKα","","0.092","0.0788","","","0.1507","0.1563","","","","","","1.196","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206050","7.5535","0.0005","18.3764","0.0009","12.9216","0.0009","90","","91.979","0.006","90","","1792.53","0.19","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Benzyl 2-(3,4-dicyanophenoxy)benzoate","","- C22 H14 N2 O3 -","- C22 H14 N2 O3 -","- C88 H56 N8 O12 -","4","1","RZ6073","Atalay,Şehriman; Ağar, Ayşen","Benzyl 2-(3,4-dicyanophenoxy)benzoate","Acta Crystallographica Section E","2005","61","6","o1815","o1817","10.1107/S1600536805014546","","","0.71073","MoKα","","0.0843","0.0445","","","0.1108","0.1202","","","","","","1.022","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206051","7.824","0.004","8.153","0.004","9.227","0.004","102.202","0.008","97.123","0.008","108.95","0.008","532.2","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-[(4-Bromo-1-methyl-1H-pyrrol-2-ylcarbonyl)amino]propanoic acid","","- C9 H11 Br N2 O3 -","- C9 H11 Br N2 O3 -","- C18 H22 Br2 N4 O6 -","2","1","RZ6074","Xiang-Chao Zeng; Jian Gu; Shi-Hai Xu; Yu-Xia Li; Po-Run Liu","3-[(4-Bromo-1-methyl-1<i>H</i>-pyrrol-2-ylcarbonyl)amino]propanoic acid","Acta Crystallographica Section E","2005","61","6","o1805","o1806","10.1107/S1600536805015047","","","0.71073","MoKα","","0.039","0.0357","","","0.0976","0.0998","","","","","","1.101","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206052","4.9893","0.0008","6.3013","0.001","26.79","0.004","90","","90","","90","","842.3","0.2","292","2","292","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2,4-Dichlorobenzohydroxamic acid","","- C7 H5 Cl2 N O2 -","- C7 H5 Cl2 N O2 -","- C28 H20 Cl8 N4 O8 -","4","1","RZ6078","Shang, Xian-Mei; Meng, Xiang-Gao; Wu, Ji-Zhou; Li, Qing-Shan","2,4-Dichlorobenzohydroxamic acid","Acta Crystallographica Section E","2005","61","6","o1961","o1962","10.1107/S1600536805016557","","","0.71073","MoKα","","0.0549","0.0434","","","0.0938","0.1001","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206053","9.562","0.003","9.83","0.003","31.393","0.005","90","","90","","90","","2950.8","1.4","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C29 H35 N O11 S -","- C29 H35 N O11 S -","- C116 H140 N4 O44 S4 -","4","1","RZ6082","Jian-Rong Su; Duan-Jun Xu","(<i>R</i>)-Methioninium‒(<i>R</i>)-mandelate‒(<i>R</i>)-mandelic acid (1/1/2)","Acta Crystallographica Section E","2005","61","6","o1933","o1935","10.1107/S160053680501620X","","","0.71073","MoKα","","0.167","0.086","","","0.208","0.25","","","","","","0.983","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206054","9.717","0.002","27.863","0.003","14.902","0.005","90","","93.06","0.02","90","","4028.9","1.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[3,6,14,21-Tetraaza-3,6-difuryl-10,25-dimethyl-27,28- dioxotetracyclo[18.4.3.3^8,12^.0^15,20^]octacosa- 8,10,12(28),13,17,19,21,23,25,27(1)-decaene-κ^4^N,N',O,O'](perchlorato- κO)copper(II) perchlorate dimethylformamide solvate","","- C39 H43 Cl2 Cu N5 O13 -","- C39 H43 Cl2 Cu N5 O13 -","- C156 H172 Cl8 Cu4 N20 O52 -","4","1","SG6003","Sun, Gang-Chun; Li, Yi-Zhi; Chen, Nai-Sheng; Wang, Liu-Fang","(Perchlorato-κ<i>O</i>)[3,6,14,21-tetraaza-3,6-difuryl-27,28-dihydroxy-10,25-dimethyltetracyclo[18.4.3.3^8,12^.0^15,20^]octacosa-8,10,12(28),13,17,19,21,23,25,27(1)-decaene-κ^4^<i>N</i>,<i>N</i>',<i>O</i>,<i>O</i>']copper(II) perchlorate dimethylformamide solvate","Acta Crystallographica Section E","2005","61","6","m1065","m1066","10.1107/S1600536805011451","","","0.71073","MoKα","","0.0859","0.0608","","","0.1342","0.1401","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206055","11.616","0.001","8.663","0.001","12.046","0.001","90","","111.52","0.01","90","","1127.7","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethylaminium picrate","","- C8 H10 N4 O7 -","- C8 H10 N4 O7 -","- C32 H40 N16 O28 -","4","1","SG6006","Chellamuthu Muthamizhchelvan; Kolandaivelu Saminathan; Krishnan SethuSankar; Jan Fraanje; Rene Peschar; Kandasamy Sivakumar","Ethylaminium picrate","Acta Crystallographica Section E","2005","61","6","o1546","o1548","10.1107/S1600536805013644","","","1.5418","CuKα","","0.0873","0.0793","","","0.2135","0.2262","","","","","","1.082","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206056","10.175","0.002","9.219","0.002","16.814","0.004","90","","90","","90","","1577.2","0.6","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","Ethyl 3,6-diphenyl-1,4-dihydro-1,2,4,5-tetrazine-1-carbonate","","- C17 H16 N4 O2 -","- C17 H16 N4 O2 -","- C68 H64 N16 O8 -","4","1","SG6007","Guo-Wu Rao; Jie Yan; Wei-Xiao Hu","Ethyl 3,6-diphenyl-1,4-dihydro-1,2,4,5-tetrazine-1-carboxylate","Acta Crystallographica Section E","2005","61","6","o1637","o1638","10.1107/S1600536805013620","","","0.71073","MoKα","","0.0536","0.0336","","","0.0887","0.0984","","","","","","1.041","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206057","7.423","0.001","7.034","0.001","10.998","0.001","90","","99.67","0.01","90","","566.08","0.12","296.1","0.2","","","","","","","","","","4","P 1 21 1","P 2yb","4","","(10aS)-7-methoxy-1,10a-dihydropyrrolo[1,2-b]isoquinoline-3,10(2H,5H)-dione","","- C13 H13 N O3 -","- C13 H13 N O3 -","- C26 H26 N2 O6 -","2","1","SG6009","Vrábel, Viktor; Kožíšek, Jozef; Marchalín, Štefan; Kadlečíková, Katarína","(10a<i>S</i>)-7-Methoxy-1,10a-dihydropyrrolo[1,2-<i>b</i>]isoquinoline-3,10(2<i>H</i>,5<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","6","o1749","o1751","10.1107/S1600536805014996","","","0.71069","MoKα","","0.0767","0.0433","","","0.0987","0.1109","","","","","","1.002","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206058","12.726","0.004","11.629","0.004","13.705","0.005","90","","90","","90","","2028.2","1.2","295","2","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4-(4-bromo-5-methylthiophen-2-yl)pyridine","","- C10 H8 Br N S -","- C10 H8 Br N S -","- C80 H64 Br8 N8 S8 -","8","1","SJ6067","Xu, Fengying; Chen, Zihui; Zhang, Fushi; Wang, Ru-Ji; Zhao, Fuqun","4-(4-Bromo-5-methylthiophen-2-yl)pyridine","Acta Crystallographica Section E","2005","61","6","o1672","o1673","10.1107/S160053680501425X","","","0.71073","MoKα","","0.0976","0.0486","","","0.0831","0.0979","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206059","7.35","0.0015","7.49","0.0015","8.81","0.0018","97.05","0.03","95.86","0.03","115.34","0.03","428.5","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","Salicylideneacetone","(E)-4-(2-hydroxyphenyl)but-3-en-2-one","","- C10 H10 O2 -","- C10 H10 O2 -","- C20 H20 O4 -","2","1","SJ6073","Wang, Shi-Fan; Shi, Da-Hua; Zhu, Yan; Zhu, Hai-Liang","Salicylideneacetone","Acta Crystallographica Section E","2005","61","6","o1697","o1698","10.1107/S1600536805012778","","","0.71073","MoKα","","0.0701","0.0598","","","0.1372","0.1451","","","","","","1.089","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206060","7.618","0.001","10.28","0.002","10.936","0.001","90","","99.55","0.01","90","","844.6","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","H-2,4-Dimethyl-6-phenyl-8,9-dihydropyrido[3',2':5,6][1,2]thiazino[3,2-c]- [1,4]oxazin-5-one-11,11-dioxide","","- C18 H16 N2 O4 S -","- C18 H16 N2 O4 S -","- C36 H32 N4 O8 S2 -","2","1","SJ6075","Karczmarzyk, Zbigniew; Malinka, Wiesław","5<i>H</i>-2,4-Dimethyl-6-phenyl-8,9-dihydropyrido[3',2':5,6][1,2]thiazino[3,2-<i>c</i>][1,4]oxazin-5-one 11,11-dioxide","Acta Crystallographica Section E","2005","61","6","o1649","o1651","10.1107/S1600536805013140","","","0.71073","MoKα","","0.0408","0.0351","","","0.0869","0.0906","","","","","","0.962","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206061","9.878","0.002","14.978","0.004","17.764","0.005","90","","104.691","0.003","90","","2542.3","1.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","cis-Bis(dicyanamido)bis(1,10-phenanthroline)cadmium(II)","","- C28 H16 Cd N10 -","- C28 H16 Cd N10 -","- C112 H64 Cd4 N40 -","4","1","SJ6076","Guo-Zheng Lan; A-Qing Wu; Guo-Cong Guo; Fa-Kun Zheng","<i>cis</i>-Bis(dicyanamido)bis(1,10-phenanthroline)cadmium(II)","Acta Crystallographica Section E","2005","61","6","m1018","m1020","10.1107/S1600536805012924","","","0.71073","MoKα","","0.0742","0.0602","","","0.1224","0.1325","","","","","","1.065","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206062","11.7463","0.0006","11.7463","0.0006","18.2841","0.001","90","","90","","120","","2184.8","0.2","173","2","173","2","","","","","","","","4","P 61 2 2","P 61 2 (0 0 5)","178","","dimethyldiphenylphosphonium iodide","","- C14 H16 I P -","- C14 H16 I P -","- C84 H96 I6 P6 -","6","0.5","SJ6077","Dornhaus, Franz; Lerner, Hans-Wolfram; Bolte, Michael","The `absolute structure' of dimethyldiphenylphosphonium iodide","Acta Crystallographica Section E","2005","61","6","o1657","o1658","10.1107/S1600536805013012","","","0.71073","MoKα","","0.0207","0.0198","","","0.0469","0.0473","","","","","","1.195","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206063","10.816","0.006","13.615","0.008","12.321","0.007","90","","99.583","0.009","90","","1789.1","1.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","6-(2,4-Dichlorophenoxy)dibenzo[d,f][1,3,2]dioxaphosphepine-6-sulfide","","- C18 H11 Cl2 O3 P S -","- C18 H11 Cl2 O3 P S -","- C72 H44 Cl8 O12 P4 S4 -","4","1","SJ6078","Krishnaiah, M.; Surendra Babu, V. H. H.; Radha Krishna, J.; Ananda Kumar, K.; Suresh Reddy, C.; Puranik, Vedavathi G.","6-(2,4-Dichlorophenoxy)dibenzo[<i>d</i>,<i>f</i>][1,3,2]dioxaphosphepine-6-sulfide","Acta Crystallographica Section E","2005","61","6","o1646","o1648","10.1107/S1600536805013991","","","0.71073","MoKα","","0.0457","0.0428","","","0.1086","0.1115","","","","","","1.127","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206064","9.3302","0.0003","10.9224","0.0004","16.5491","0.0007","90","","93.641","0.002","90","","1683.08","0.11","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","7,8,15,16-tetraazadibenzo[b,n]perylene monohydrate","","- C24 H14 N4 O -","- C24 H14 N4 O -","- C96 H56 N16 O4 -","4","1","SJ6079","Zafra Stein; Israel Goldberg","π‒π stacking in 7,8,15,16-tetraazadibenzo[<i>b</i>,<i>n</i>]perylene monohydrate at 110K","Acta Crystallographica Section E","2005","61","6","o1554","o1556","10.1107/S1600536805013504","","","0.71073","MoKα","","0.1084","0.062","","","0.1415","0.1664","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206065","17.37","0.005","13.131","0.004","8.011","0.002","90","","91.803","0.007","90","","1826.3","0.9","153.2","","","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","Dicarbonyl(η^5^-cyclopentadienyl)(trimethylsilylisocyanide)iron(II) trifluoromethanesulfonate","","- C12 H14 F3 Fe N O5 S Si -","- C12 H14 F3 Fe N O5 S Si -","- C48 H56 F12 Fe4 N4 O20 S4 Si4 -","4","1","SJ6080","Hiroshi Nakazawa; Masumi Itazaki; Mari Owaribe","Dicarbonyl(η^5^-cyclopentadienyl)(trimethylsilyl isocyanide)iron(II) trifluoromethanesulfonate","Acta Crystallographica Section E","2005","61","6","m1073","m1074","10.1107/S1600536805013516","","","0.7107","MoKα","","","0.0675","","","","0.1709","","","","","","1.164","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206066","7.1501","0.0006","8.064","0.0008","9.685","0.001","80.247","0.013","69.517","0.01","72.896","0.011","498.6","0.09","193","2","193","2","","","","","","","","3","P -1","-P 1","2","3-acetyl-7-methoxycoumarin","3-acetyl-7-methoxy-2H-1-benzopyran-2-one","","- C12 H10 O4 -","- C12 H10 O4 -","- C24 H20 O8 -","2","1","SJ6081","Hong-Mei Han; Cheng-Rong Lu; Yong Zhang; De-Chun Zhang","3-Acetyl-7-methoxycoumarin","Acta Crystallographica Section E","2005","61","6","o1864","o1866","10.1107/S1600536805014091","","","0.7107","MoKα","","0.0535","0.0429","","","0.1107","0.118","","","","","","1.069","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206067","12.4473","0.0005","17.4957","0.0007","12.8805","0.0005","90","","90","","90","","2805.04","0.19","93","2","93","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Oxotris(quinolin-8-olato-κ^2^O,N)tantalum(V) dichloromethane disolvate","","- C29 H22 Cl4 N3 O4 Ta -","- C29 H22 Cl4 N3 O4 Ta -","- C116 H88 Cl16 N12 O16 Ta4 -","4","0.5","SJ6082","Amini, Mostafa M.; Tamizkar, Tayebeh; Mirzaee, Mehdi; Ng, Seik Weng","Oxotris(quinolin-8-olato-κ^2^<i>O,N</i>)tantalum(V) dichloromethane disolvate","Acta Crystallographica Section E","2005","61","6","m1053","m1054","10.1107/S1600536805013747","","","0.71073","MoKα","","0.028","0.024","","","0.061","0.064","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206068","9.172","0.003","11.032","0.003","11.106","0.003","60.825","0.002","67.219","0.002","89.136","0.003","883.4","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Bis(trans-(E)-2-{[4-(4-acetylphenylsulfanyl)phenylimino-κN]methyl}phenolato- κO)copper(II)","","","- C42 H32 Cu N2 O4 S2 -","- C42 H32 Cu N2 O4 S2 -","- C42 H32 Cu N2 O4 S2 -","1","0.5","SJ6083","Hebbachi, Rabihe; Benali-Cherif, Nourredine","Bis(<i>trans</i>-(<i>E</i>)-2-{[4-(4-acetylphenylsulfanyl)phenylimino-κ<i>N</i>]methyl}phenolato-κ<i>O</i>)copper(II)","Acta Crystallographica Section E","2005","61","6","m1188","m1190","10.1107/S1600536805015539","","","0.71073","MoKα","","0.0407","0.034","","","0.101","0.1194","","","","","","1.213","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2206069","9.8596","0.001","23.584","0.002","8.4499","0.0008","90","","90","","90","","1964.8","0.3","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","1-(Benzoylmethyl)-4-(3,5-dimethyl-4H-1,2,4-triazol-4-yl)-3-(2-thienylmethyl)- 1H-1,2,4-triazol-5(4H)-one","","- C19 H18 N6 O2 S -","- C19 H18 N6 O2 S -","- C76 H72 N24 O8 S4 -","4","1","SJ6084","Sancak, Kemal; Çoruh, Ufuk; Ünver, Yasemin; Vázquez-López, Ezequiel M.","1-(Benzoylmethyl)-4-(3,5-dimethyl-4<i>H</i>-1,2,4-triazol-4-yl)-3-(2-thienylmethyl)-1<i>H</i>-1,2,4-triazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2005","61","6","o1785","o1787","10.1107/S1600536805015084","","","0.71073","MoKα","","0.1332","0.0851","","","0.2296","0.249","","","","","","1.076","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206070","6.405","0.002","25.82","0.009","7.197","0.002","90","","114.14","0.006","90","","1086.1","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-4-[(4-Hydroxyphenyl)diazenyl]benzaldehyde","","- C13 H10 N2 O2 -","- C13 H10 N2 O2 -","- C52 H40 N8 O8 -","4","1","SJ6085","Liu, Xin-Gang; Feng, Ya-Qing; Meng, Xiang-Qi; Liang, Zu-Pei; Yang, Guang","(<i>E</i>)-4-[(4-Hydroxyphenyl)diazenyl]benzaldehyde","Acta Crystallographica Section E","2005","61","6","o1694","o1696","10.1107/S1600536805014510","","","0.71073","MoKα","","0.119","0.0461","","","","0.1286","","","","","","0.996","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206071","3.957","0.001","15.798","0.003","11.461","0.002","90","","94.14","0.01","90","","714.6","0.3","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Melaminium formate","","- C4 H8 N6 O2 -","- C4 H8 N6 O2 -","- C16 H32 N24 O8 -","4","1","SJ6086","Genivaldo Julio Perpétuo; Marcos Antônio Ribeiro; Jan Janczak","Melaminium formate","Acta Crystallographica Section E","2005","61","6","o1818","o1820","10.1107/S1600536805015151","","","0.71073","MoKα","","0.0538","0.0357","","","0.0875","0.0956","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206072","12.413","0.0014","13.1265","0.0015","15.159","0.0018","87.559","0.002","74.392","0.002","77.313","0.002","2320.5","0.5","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","7""-Benzyl-9""-benzylidene-4'-[4-(dimethylamino)phenyl]-1'-methyl-5""-phenyl- 2"",3"",6"",7"",8"",9""-hexahydro-1H-indole-3(2H)-spiro-2'-pyrrolidine-3'-spiro-2''- pyrido[4,3-d]thiazolo[3,2-a]pyrimidine-2,2''-dione acetonitrile disolvate","","- C52 H50 N8 O2 S -","- C52 H50 N8 O2 S -","- C104 H100 N16 O4 S2 -","2","1","SJ6088","Hu, Xiao-Fen; Feng, Ya-Qing; Su, Qi; Qiao, Kang-Jian","7''-Benzyl-9''-benzylidene-4'-[4-(dimethylamino)phenyl]-1'-methyl-5''-phenyl- 2'',3'',6'',7'',8'',9''-hexahydro-1<i>H</i>-indole-3(2<i>H</i>)-spiro-2'-pyrrolidine-3'-spiro-2''-pyrido[4,3-<i>d</i>]thiazolo[3,2-<i>a</i>]pyrimidine-2,2''-dione acetonitrile disolvate","Acta Crystallographica Section E","2005","61","6","o1830","o1832","10.1107/S1600536805015485","","","0.71073","MoKα","","0.0978","0.0534","","","","0.1573","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206073","17.489","0.001","6.816","0.001","16.528","0.001","90","","100.68","0.01","90","","1936.1","0.3","100","0.1","100","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","N-Methyl-3-methylsulfonyl-N-nitroaniline","N-Methyl-3-methylsulfonyl-N-nitroaniline","","- C8 H10 N2 O4 S -","- C8 H10 N2 O4 S -","- C64 H80 N16 O32 S8 -","8","1","SJ6090","Zarychta, Bartosz; Daszkiewicz, Zdzisław; Zaleski, Jacek","<i>N</i>-Methyl-3-methylsulfonyl-<i>N</i>-nitroaniline","Acta Crystallographica Section E","2005","61","6","o1897","o1899","10.1107/S1600536805015965","","","0.71073","MoKα","","0.0351","0.0312","","","0.0818","0.0847","","","","","","1.059","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206074","10.539","0.002","15.986","0.002","10.905","0.002","90","","113.48","0.002","90","","1685.1","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Methanol[4-nitro-2-(pyridin-2- ylmethyliminomethyl)phenolato](thiocyanato)copper(II)","","- C15 H14 Cu N4 O4 S -","- C15 H14 Cu N4 O4 S -","- C60 H56 Cu4 N16 O16 S4 -","4","1","SJ6092","Wang, Nong; Li, Jing-Ping","Methanol[4-nitro-2-(pyridin-2-ylmethyliminomethyl)phenolato](thiocyanato)copper(II)","Acta Crystallographica Section E","2005","61","6","m1223","m1225","10.1107/S1600536805016363","","","0.71073","MoKα","","0.0664","0.0428","","","0.1077","0.1204","","","","","","1.034","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206075","40.0008","0.0012","40.0008","0.0012","12.093","","90","","90","","120","","16757.2","0.7","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","Hexacarbonylhexakis(μ-3,4-dimethylbenzenethiolato)triiron(II)","","- C54 H54 Fe3 O6 S6 -","- C54 H54 Fe3 O6 S6 -","- C648 H648 Fe36 O72 S72 -","12","0.666667","SU6189","Hu, Mingqiang; Ma, Chengbing; Chen, Changneng","Hexacarbonylhexakis(μ-3,4-dimethylbenzenethiolato)triiron(II)","Acta Crystallographica Section E","2005","61","6","m1045","m1047","10.1107/S1600536805013024","","","0.71073","MoKα","","0.0584","0.049","","","0.1018","0.1064","","","","","","1.087","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206076","10.735","0.002","9.4311","0.0019","16.61","0.003","90","","106.81","0.03","90","","1609.8","0.6","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Methyl 3,3,7,7,9-pentamethyl-1,5-dioxaspiro[5.5]undec-8-ene-8-carboxylate","","- C16 H26 O4 -","- C16 H26 O4 -","- C64 H104 O16 -","4","1","SU6192","Koskinen, Ari M. P.; Laitinen, Risto S.; Oilunkaniemi, Raija; Savilampi, Satu K.; Toivola, Reijo J.","Methyl 3,3,7,7,9-pentamethyl-1,5-dioxaspiro[5.5]undec-8-ene-8-carboxylate","Acta Crystallographica Section E","2005","61","6","o1627","o1628","10.1107/S1600536805013127","","","0.71073","MoKα","","0.0429","0.0379","","","0.1081","0.1197","","","","","","1.083","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206077","7.207","0.003","19.112","0.004","12.686","0.003","90","","95.67","0.03","90","","1738.8","0.9","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[4-Bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato]methanolperchloratozinc(II)","","- C14 H14 Br Cl N2 O6 Zn -","- C14 H14 Br Cl N2 O6 Zn -","- C56 H56 Br4 Cl4 N8 O24 Zn4 -","4","1","SU6193","Wei, Yi-Jun","[4-Bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato]methanolperchloratozinc(II)","Acta Crystallographica Section E","2005","61","6","m1085","m1087","10.1107/S1600536805012882","","","0.71073","MoKα","","0.0699","0.0479","","","0.1165","0.1288","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206078","13.7823","0.0013","17.5908","0.0017","18.1368","0.0018","90","","90","","90","","4397.1","0.7","223","2","223","2","","","","","","","","4","I b c a","-I 2b 2c","73","","Diazidobis(1,7-phenanthroline)zinc(II)","","- C24 H16 N10 Zn -","- C24 H16 N10 Zn -","- C192 H128 N80 Zn8 -","8","0.5","SU6194","Sun, Bai-Wang; Du Lin","Diazidobis(1,7-phenanthroline)zinc(II)","Acta Crystallographica Section E","2005","61","6","m1099","m1100","10.1107/S1600536805014108","","","0.71073","MoKα","","0.0656","0.0446","","","0.1103","0.1227","","","","","","1.018","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206079","21.578","0.005","4.674","0.005","11.709","0.005","90","0.005","95.829","0.005","90","0.005","1174.8","1.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","5-[(4-methylphenyl)diazenyl]salicylaldehyde","5-[(4-methylphenyl)diazenyl]salicylaldehyde","","- C14 H12 N2 O2 -","- C14 H12 N2 O2 -","- C56 H48 N8 O8 -","4","1","SU6195","Bakir, Mohammed; Harewood, Gabriel R.; Holder, Alvin; Hassan, Ishmael; Dasgupta, Tara; Maragh, Paul; Singh-Wilmot, Marvadeen","5-[(4-Methylphenyl)diazenyl]salicylaldehyde","Acta Crystallographica Section E","2005","61","6","o1611","o1613","10.1107/S1600536805013413","","","0.71069","MoKα","","0.0928","0.0459","","","0.0871","0.1025","","","","","","1.289","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206080","9.248","0.002","10.272","0.002","11.399","0.002","79.155","0.002","67.425","0.002","81.923","0.002","979.2","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis{1-[3-(cyclohexylamino)propyliminomethyl]naphth-2-olato}nickel(II)","","- C40 H50 N4 Ni O2 -","- C40 H50 N4 Ni O2 -","- C40 H50 N4 Ni O2 -","1","0.5","SU6196","Wei, Yi-Jun","Bis{1-[3-(cyclohexylamino)propyliminomethyl]naphth-2-olato}nickel(II)","Acta Crystallographica Section E","2005","61","6","m1088","m1089","10.1107/S1600536805012286","","","0.71073","MoKα","","0.0784","0.0705","","","0.1775","0.1862","","","","","","1.068","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206081","7.9131","0.0005","13.572","0.0008","25.0065","0.0014","90","","90","","90","","2685.6","0.3","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","catena-Poly[[[4-bromo-2-(2-pyridylmethyliminomethyl)phenolato]copper(II)]- μ-chloro]","","- C13 H10 Br Cl Cu N2 O -","- C13 H10 Br Cl Cu N2 O -","- C104 H80 Br8 Cl8 Cu8 N16 O8 -","8","1","SU6197","Sun, Yu-Xi; Gao, Yi-Zhen; Zhang, Hong-Lin; Kong, De-Sheng; Yu, You","<i>catena</i>-Poly[[[4-bromo-2-(2-pyridylmethyliminomethyl)phenolato]copper(II)]-μ-chloro]","Acta Crystallographica Section E","2005","61","6","m1055","m1057","10.1107/S1600536805013401","","","0.71073","MoKα","","0.0696","0.0372","","","0.0784","0.0847","","","","","","0.854","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206082","12.3075","0.0014","7.4751","0.0009","13.6676","0.0017","90","","94.046","0.003","90","","1254.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Amino-4-(2-naphthalyl)thiophene-3-carbonitrile","","- C15 H10 N2 S -","- C15 H10 N2 S -","- C60 H40 N8 S4 -","4","1","SU6198","Çoruh, Ufuk; Tümer, Ferhan; Vázquez-López, Ezequiel M.; Demir, Ümit","2-Amino-4-(2-naphthyl)thiophene-3-carbonitrile","Acta Crystallographica Section E","2005","61","6","o1680","o1682","10.1107/S1600536805013425","","","0.71073","MoKα","","0.1969","0.0416","","","0.0525","0.0697","","","","","","0.716","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206083","7.4846","0.0014","8.1059","0.0015","27.139","0.005","90","","97.867","0.004","90","","1631","0.5","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ethyl 3-methyl-6-oxo-5-[3-(trifluoromethyl)phenyl]-1,6-dihydro-1-pyridazineacetate","","- C16 H15 F3 N2 O3 -","- C16 H15 F3 N2 O3 -","- C64 H60 F12 N8 O12 -","4","1","SU6199","Han Xu; Hai-Bin Song; Chang-Sheng Yao; You-Quan Zhu; Fang-Zhong Hu; Xiao-Mao Zou; Hua-Zheng Yang","Ethyl 3-methyl-6-oxo-5-[3-(trifluoromethyl)phenyl]-1,6-dihydro-1-pyridazineacetate","Acta Crystallographica Section E","2005","61","6","o1561","o1563","10.1107/S1600536805013498","","","0.71073","MoKα","","0.1429","0.059","","","0.1431","0.1852","","","","","","1.003","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206084","12.706","0.003","11.141","0.002","11.552","0.002","90","","90","","90","","1635.3","0.6","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","4-{[1-(1-Adamantyl)ethyl]iminomethyl}phenol","","- C19 H25 N O -","- C19 H25 N O -","- C76 H100 N4 O4 -","4","1","SU6200","Feng, Yun-Long; Zhao, Guo-Liang; Wen, Yi-Hang","4-{[1-(1-Adamantyl)ethyl]iminomethyl}phenol","Acta Crystallographica Section E","2005","61","6","o1771","o1773","10.1107/S1600536805014935","","","0.71073","MoKα","","0.0756","0.0421","","","0.0822","0.0855","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206085","7.8","0.002","5.845","0.002","21.61","0.003","90","","97.599","0.002","90","","976.6","0.4","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(Cyclopropyliminomethyl)-4-nitrophenol","","- C10 H10 N2 O3 -","- C10 H10 N2 O3 -","- C40 H40 N8 O12 -","4","1","SU6201","Zhao, Li-Fang","2-(Cyclopropyliminomethyl)-4-nitrophenol","Acta Crystallographica Section E","2005","61","6","o1670","o1671","10.1107/S1600536805014145","","","0.71073","MoKα","","0.0662","0.0549","","","0.1293","0.1361","","","","","","1.125","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206086","9.2293","0.0017","16.506","0.003","12.354","0.002","90","","107.286","0.004","90","","1797","0.5","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl 2,7,7-trimethyl-5-oxo-4-(3-chlorophenyl)-1,4,5,6,7,8- hexahydroquinoline-3-carboxylate","","- C20 H22 Cl N O3 -","- C20 H22 Cl N O3 -","- C80 H88 Cl4 N4 O12 -","4","1","TK6221","Yu-Ling Li; Bai-Xiang Du; Xiang-Shan Wang; Mei-Mei Zhang; Zhao-Sen Zeng","Methyl 4-(3-chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate","Acta Crystallographica Section E","2005","61","6","o1634","o1636","10.1107/S1600536805012821","","","0.7107","MoKα","","0.067","0.055","","","0.124","0.13","","","","","","1.13","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206087","10.305","0.001","12.088","0.001","20.341","0.002","90","","90","","90","","2533.8","0.4","295","2","295","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","L-(-)-dichloro(N,N-diethyldithiocarbamato)(β-menthoxycarbonylethyl)tin(IV)","","- C18 H33 Cl2 N O2 S2 Sn -","- C18 H33 Cl2 N O2 S2 Sn -","- C72 H132 Cl8 N4 O8 S8 Sn4 -","4","1","TK6223","Ng, Seik Weng","Redetermination of <small>L</small>-(‒)-dichloro(<i>N,N</i>-diethyldithiocarbamato)(β-menthoxycarbonylethyl)tin(IV)","Acta Crystallographica Section E","2005","61","6","m1051","m1052","10.1107/S160053680501281X","","","0.71073","MoKα","","0.041","0.035","","","0.075","0.079","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206088","10.9217","0.0007","21.5274","0.0017","16.4036","0.0011","90","","91.037","0.001","90","","3856.1","0.5","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4,4'-Bipyridinium bis(3,5-dicarboxybenzoate) benzene-1,3,5-tricarboxylic acid hexahydrate","","- C37 H38 N2 O24 -","- C37 H38 N2 O24 -","- C148 H152 N8 O96 -","4","0.5","WK6046","Xin-Hua Li; Xin-Xiang Lei; Shun Wang","4,4'-Bipyridinium bis(3,5-dicarboxybenzoate) benzene-1,3,5-tricarboxylic acid hexahydrate","Acta Crystallographica Section E","2005","61","6","o1802","o1804","10.1107/S1600536805015035","","","0.71073","MoKα","","0.0759","0.0715","","","0.1544","0.1571","","","","","","1.215","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2206089","7.8401","0.0009","12.5177","0.0014","7.6177","0.0008","90","","103.049","0.002","90","","728.3","0.14","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(4-pyridylmethyl)ammonium chloride","(4-Pyridylmethyl)aminium chloride","","- C6 H9 Cl N2 -","- C6 H9 Cl N2 -","- C24 H36 Cl4 N8 -","4","1","WK6048","Elise J. C. de Vries; Clive L. Oliver; Gareth O. Lloyd","(4-Pyridylmethyl)aminium chloride","Acta Crystallographica Section E","2005","61","6","o1577","o1578","10.1107/S1600536805013255","","","0.71073","MoKα","","0.0402","0.0356","","","0.087","0.0898","","","","","","1.075","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2206090","11.72","0.002","8.0163","0.0015","8.952","0.002","90","","90","","90","","841","0.3","298","2","298","2","","","","","","","","4","P m m n :2","-P 2ab 2a","59","praseodymium triiodide nona-hydrate","praseodymium triiodide nonahydrate","","- H18 I3 O9 Pr -","- I3 O9 Pr -","- I6 O18 Pr2 -","2","0.25","WM6064","Timofte, Tudor; Babai, Arash; Meyer, Gerd; Mudring, Anja-Verena","Praseodymium triiodide nonahydrate","Acta Crystallographica Section E","2005","61","6","i94","i95","10.1107/S1600536805012857","","","0.71073","MoKα","","0.0574","0.0501","","","0.13","0.1362","","","","","","1.087","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206091","7.7592","0.0008","7.7592","0.0008","11.3079","0.0013","90","","90","","90","","680.79","0.13","296","","295","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Dicaesium dibromoaurate(I) tetrabromoaurate(III)","","- Au2 Br6 Cs2 -","- Au2 Br6 Cs2 -","- Au4 Br12 Cs4 -","2","0.0625","WM6065","Matsushita, Nobuyuki; Fukuhara, Fumiya; Kojima, Norimichi","A three-dimensional bromo-bridged mixed-valence gold(I,III) compound, Cs~2~Au^I^Au^III^Br~6~","Acta Crystallographica Section E","2005","61","6","i123","i125","10.1107/S1600536805016594","","","0.71069","MoKα","","0.0975","0.064","","","0.154","0.1701","","","","","","1.044","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206092","4.0757","0.0002","4.0757","0.0002","14.1965","0.0011","90","","90","","90","","235.82","0.02","293","2","293","2","","","","","","","","3","I 41/a m d :2","-I 4bd 2","141","Ag.28(1) Si1.72(1) Yb","ytterbium silver silicide","","- Ag0.28 Si1.72 Yb -","- Ag0.284 Si1.716 Yb -","- Ag1.136 Si6.864 Yb4 -","4","0.125","WM6066","Bobev, Svilen; Bauer, Eric D.","YbAg~<i>x~</i>Si~2{-~<i>x</i>} [<i>x</i> = 0.28(1)] with the tetragonal α-ThSi~2~ structure type","Acta Crystallographica Section E","2005","61","6","i96","i98","10.1107/S1600536805013103","","","0.71073","MoKα","","0.0113","0.0091","","","0.0196","0.0203","","","","","","1.233","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206093","4.3051","0.0003","19.0324","0.0015","20.7335","0.0019","90","","90","","90","","1698.8","0.2","173","2","173","2","","","","","","","","4","C m c m","-C 2c 2","63","Potassium trichloro decafluoropentastannates(II)","pentapotassium trichlorodecafluoropentastannate(II)","","- Cl3 F10 K3 Sn5 -","- Cl3 F10 K3 Sn5 -","- Cl12 F40 K12 Sn20 -","4","0.25","WM6068","Hocine Merazig; Fatima Setifi; Zouaoui Setifi; Peter H. Bird; George Dénès; Korzior Tam","K~3~Sn~5~Cl~3~F~10~ with a corrugated layered structure","Acta Crystallographica Section E","2005","61","6","i120","i122","10.1107/S1600536805016351","","","0.71073","MoKα","","0.0253","0.025","","","0.0576","0.0578","","","","","","1.207","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206094","8.236","0.002","15.237","0.003","22.724","0.005","90","","90","","90","","2851.7","1.1","193","2","193","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","europium antimony sulfide","europium antimony sulfide","","- Eu6 S17 Sb6 -","- Eu6 S17 Sb6 -","- Eu24 S68 Sb24 -","4","1","WM6069","Jin, Gengbang; Wells, Daniel M.; Crerar, Shane J.; Shehee, Thomas C.; Mar, Arthur; Albrecht-Schmitt, Thomas E.","Europium antimony sulfide, Eu~6~Sb~6~S~17~","Acta Crystallographica Section E","2005","61","6","i116","i119","10.1107/S1600536805016211","","","0.71073","MoKα","","0.0381","0.0311","","","0.0602","0.0615","","","","","","0.999","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206095","7.347","0.0015","9.501","0.0019","13.568","0.003","90","","97.81","0.03","90","","938.3","0.3","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Methyl ent-15β-hydroxy-16α-kauran-19-oate","","- C21 H34 O3 -","- C21 H34 O3 -","- C42 H68 O6 -","2","1","WN6340","Batista, Ronan; García, Pablo A.; Castro, María A.; del Corral, José M. Miguel; Speziali, Nivaldo L.; Oliveira, Alaide B. de","Methyl <i>ent</i>-15β-hydroxy-16α-kauran-19-oate","Acta Crystallographica Section E","2005","61","6","o1525","o1527","10.1107/S1600536805009554","","","1.5418","CuKα","","0.0333","0.0323","","","0.0884","0.0895","","","","","","1.025","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206096","15.8942","0.0013","6.9666","0.0003","20.2673","0.0017","90","","102.634","0.006","90","","2189.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(2-Thienylmethyl)-4,4'-bi-1H-1,2,4-triazol-5(4H)-one","","- C9 H8 N6 O S -","- C9 H8 N6 O S -","- C72 H64 N48 O8 S8 -","8","2","WN6349","Sancak, Kemal; Ustabaş, Reşat; Çoruh, Ufuk; Er, Mustafa; Ünver, Yasemin; Yavuz, Metin","3-(2-Thienylmethyl)-4,4'-bi-1<i>H</i>-1,2,4-triazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2005","61","6","o1764","o1766","10.1107/S1600536805013942","","","0.71073","MoKα","","0.1179","0.0872","","","0.262","0.2844","","","","","","1.019","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206097","7.931","0.0005","11.9091","0.001","21.3948","0.0015","90","","90","","90","","2020.8","0.3","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","4',4',6',6'-Tetrachloro-3-(4,6-dimethylpyridin-2-yl)-3,4-dihydrospiro[1,3,2- benzoxazaphosphinine-2,2'-(2λ^5^,4λ^5^,6λ^5^-cyclotriphosphazene)]","","- C14 H14 Cl4 N5 O P3 -","- C14 H14 Cl4 N5 O P3 -","- C56 H56 Cl16 N20 O4 P12 -","4","1","WN6350","Çaylak, Nagihan; Hökelek, Tuncer; Büyükgüngör, Orhan; Dal, Hakan; Süzen, Yasemin; Kılıç, Zeynel","4',4',6',6'-Tetrachloro-3-(4,6-dimethylpyridin-2-yl)-3,4-dihydrospiro[1,3,2-benzoxazaphosphinine-2,2'-(2λ^5^,4λ^5^,6λ^5^-cyclotriphosphazene)]","Acta Crystallographica Section E","2005","61","6","o1557","o1560","10.1107/S1600536805013383","","","0.71073","MoKα","","0.0321","0.0298","","","0.0738","0.0744","","","","","","0.984","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206098","11.857","0.002","7.1867","0.0014","32.253","0.007","90","","90","","90","","2748.4","0.9","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-(4-Methoxystyryl)-2H-1,4-benzoxazin-2-one","","- C17 H13 N O3 -","- C17 H13 N O3 -","- C136 H104 N8 O24 -","8","1","WN6351","Yan-Chao Wu; Hai-Bin Song; Li Liu; Dong Wang; Yong-Jun Chen","3-(4-Methoxystyryl)-2<i>H</i>-1,4-benzoxazin-2-one","Acta Crystallographica Section E","2005","61","6","o1590","o1591","10.1107/S1600536805013772","","","0.71073","MoKα","","0.1039","0.0483","","","0.126","0.1401","","","","","","0.83","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206099","7.2873","0.0015","18.657","0.004","30.047","0.006","90","","90","","90","","4085.2","1.5","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2,2'-bis(1-phenyl-1H-tetrazole-5-ylsulfanyl) ether","","- C18 H18 N8 O S2 -","- C18 H18 N8 O S2 -","- C144 H144 N64 O8 S16 -","8","1","WN6352","Wei Wang; Bing Zhao; Wen-Qin Zhang","2,2'-Bis(1-phenyl-1<i>H</i>-tetrazol-5-ylsulfanyl) ether","Acta Crystallographica Section E","2005","61","6","o1639","o1640","10.1107/S1600536805013784","","","0.71073","MoKα","","0.1139","0.0585","","","0.0973","0.1187","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206100","11.735","0.002","12.964","0.003","11.82","0.002","90","","90","","90","","1798.2","0.6","292","2","292","2","","","","","","","","2","P b c n","-P 2n 2ab","60","","1,2-Dimethyl-4,5-bis(phenylethynyl)benzene","","- C24 H18 -","- C24 H18 -","- C96 H72 -","4","0.5","WN6353","Nengfang She; Huizhen Guo; Yitao Li; Anxin Wu","1,2-Dimethyl-4,5-bis(phenylethynyl)benzene","Acta Crystallographica Section E","2005","61","6","o1790","o1792","10.1107/S1600536805014820","","","0.71073","MoKα","","0.0972","0.0582","","","0.1374","0.1593","","","","","","1.03","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206101","10.7701","0.0005","10.7701","0.0005","6.3526","0.0002","90","","90","","120","","638.15","0.05","150","","150","","","","","","","","","5","P 31 2 1","P 31 2""","152","","Sodium 3,5-dinitrobenzoate","","- C7 H3 N2 Na O6 -","- C7 H3 N2 Na O6 -","- C21 H9 N6 Na3 O18 -","3","0.5","WW6381","Jones, Helen P.; Gillon, Amy L.; Davey, Roger J.","Sodium 3,5-dinitrobenzoate","Acta Crystallographica Section E","2005","61","6","m1131","m1132","10.1107/S1600536805014893","","","0.71073","MoKα","","0.0274","0.0255","","","0.0655","0.0662","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206102","7.623","0.003","19.92","0.006","11.558","0.004","90","","92.304","0.006","90","","1753.7","1.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,10-Phenanthrolin-1-ium 2-carboxy-6-nitrobenzoate","","- C20 H13 N3 O6 -","- C20 H13 N3 O6 -","- C80 H52 N12 O24 -","4","1","WW6383","Guo, Ming-Lin","1,10-Phenanthrolin-1-ium 2-carboxy-6-nitrobenzoate","Acta Crystallographica Section E","2005","61","6","o1728","o1730","10.1107/S1600536805014753","","","0.71073","MoKα","","0.092","0.0451","","","0.0934","0.1084","","","","","","1.007","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206103","16.4728","0.0016","13.815","0.0014","7.6914","0.0008","90","","93.829","0.002","90","","1746.4","0.3","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-(4-Methylbenzoyl)-3-{5-[4-(trifluoromethyl)phenyl]-1,3,4-thiadiazol-2-yl)urea","","- C18 H13 F3 N4 O2 S -","- C18 H13 F3 N4 O2 S -","- C72 H52 F12 N16 O8 S4 -","4","1","WW6384","Song, Xinjian; Tan, Xiaohong; Wang, Yangang; Meng, Xianggao; Shi, Bo-An","1-(4-Methylbenzoyl)-3-{5-[4-(trifluoromethyl)phenyl]-1,3,4-thiadiazol-2-yl}urea","Acta Crystallographica Section E","2005","61","6","o1731","o1732","10.1107/S1600536805014765","","","0.71073","MoKα","","0.0777","0.0543","","","0.1546","0.177","","","","","","1.055","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206104","13.457","0.003","19.807","0.003","14.08","0.003","90","","97.15","0.02","90","","3723.7","1.3","287","2","287","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[N,N-diisopropyl-2,2'-(2,3-naphthalenedioxy)diacetamide]trinitratoneodymium(III) acetone solvate","","- C29 H44 N5 Nd O14 -","- C29 H44 N5 Nd O14 -","- C116 H176 N20 Nd4 O56 -","4","1","XU6004","Lei, Ke-Wei; Liu, Wei-Sheng; Yu, Kai-Bei","[<i>N,N</i>-Diisopropyl-2,2'-(2,3-naphthalenedioxy)diacetamide]trinitratoneodymium(III) acetone solvate","Acta Crystallographica Section E","2005","61","6","m1159","m1160","10.1107/S1600536805015321","","","0.71073","MoKα","","0.035","0.025","","","0.054","0.056","","","","","","0.972","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206105","8.457","0.007","13.732","0.011","15.621","0.013","115.53","0.01","90.89","0.01","102.366","0.011","1587","2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Aqua[2,2'-(naphthylene-2,3-dioxy)bis(N,N- diethylacetamide)]trinitratocerium(III) acetonitrile solvate","","- C24 H35 Ce N6 O14 -","- C24 H35 Ce N6 O14 -","- C48 H70 Ce2 N12 O28 -","2","1","XU6005","Lei, Ke-Wei; Liu, Wei-Sheng; Wang, Da-Qi","Aqua[2,2'-(naphthalene-2,3-dioxy)bis(<i>N</i>,<i>N</i>-diethylacetamide)]trinitratocerium(III) acetonitrile solvate","Acta Crystallographica Section E","2005","61","6","m1243","m1244","10.1107/S1600536805016612","","","0.71073","MoKα","","0.04","0.034","","","0.083","0.091","","","","","","1.078","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206106","12.01","0.002","7.029","0.0014","16.382","0.003","90","","94.84","0.03","90","","1378","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","sodium hydrogen diglycolate nitrate","disodium trihydrogen bis(2,2'-oxydiacetate) nitrate","","- C8 H11 N Na2 O13 -","- C8 H11 N Na2 O13 -","- C32 H44 N4 Na8 O52 -","4","0.5","XU6006","Price, Daniel J.; Fritsch, Stefan; Wood, Paul T.; Powell, Annie K.","Possible strong symmetric hydrogen bonding in disodium trihydrogen bis(2,2'-oxydiacetate) nitrate","Acta Crystallographica Section E","2005","61","6","m1174","m1177","10.1107/S1600536805014819","","","0.71073","MoKα","","0.038","0.033","","","0.1","0.103","","","","","","1.167","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206107","6.898","0.0014","7.755","0.0016","30.339","0.006","90","","93.44","0.03","90","","1620","0.6","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-poly[[[triaquazinc(II)]-μ-N,N'-(benzene-1,4-dicarboxamido)diacetato- κ^2^O:O'] dihydrate]","","- C12 H20 N2 O11 Zn -","- C12 H20 N2 O11 Zn -","- C48 H80 N8 O44 Zn4 -","4","0.5","XU6010","Zhang, Hong-Tao; You, Xiao-Zeng","The one-dimensional zigzag coordination polymer <i>catena</i>-poly[[[triaquazinc(II)]-μ-<i>N</i>,<i>N</i>'-(benzene-1,4-dicarboxamido)diacetato-κ^2^<i>O</i>:<i>O</i>'] dihydrate]","Acta Crystallographica Section E","2005","61","6","m1163","m1165","10.1107/S1600536805015345","","","0.71073","MoKα","","0.052","0.042","","","0.113","0.12","","","","","","1.122","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206108","7.5743","0.0015","9.4265","0.0019","23.07","0.005","90","","99.17","0.03","90","","1626.1","0.6","283","2","283","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[[(1,10-phenanthroline-κ^2^N,N')cadmium(II)]-μ~3~-pyridine-3,4- dicarboxylato-κ^5^N:O,O':O'',O''']","","- C19 H11 Cd N3 O4 -","- C19 H11 Cd N3 O4 -","- C76 H44 Cd4 N12 O16 -","4","1","XU6011","Xin-Long Wang; Chao Qin; En-Bo Wang","Poly[[(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]-μ~3~-pyridine-3,4-dicarboxylato-κ^5^<i>N</i>:<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>''']","Acta Crystallographica Section E","2005","61","6","m1234","m1236","10.1107/S1600536805016016","","","0.71073","MoKα","","0.037","0.031","","","0.0845","0.094","","","","","","1.008","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206109","9.3371","0.0003","17.5155","0.0005","11.6735","0.0003","90","","96.964","0.001","90","","1895.05","0.09","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[2,6-Bis(2-pyridylamino)pyridine]dinitratocadmium monohydrate","","- C15 H15 Cd N7 O7 -","- C15 H15 Cd N7 O7 -","- C60 H60 Cd4 N28 O28 -","4","1","YA6239","Fang, Xiao-Niu; Li, Xin-Fa; Zeng, Xi-Rui","[2,6-Bis(2-pyridylamino)pyridine]dinitratocadmium monohydrate","Acta Crystallographica Section E","2005","61","6","m1123","m1125","10.1107/S1600536805014649","","","0.71073","MoKα","","0.047","0.026","","","0.056","0.06","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206110","13.9144","0.0013","5.5055","0.0004","17.8016","0.0017","90","","107.858","0.008","90","","1298","0.2","150","","150","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(2-exo,7-exo,9-exo,10-exo)-11-oxatricyclo[6.2.1.0^2,7^]undec-4-ene-9,10-diyl diacetate","","- C14 H18 O5 -","- C14 H18 O5 -","- C56 H72 O20 -","4","1","YA6244","Sema Öztürk Yıldırım; Mehmet Akkurt; Arif Baran; Hasan Seçen; Orhan Büyükgüngör","The 2-<i>exo</i>,7-<i>exo</i>,9-<i>exo</i>,10-<i>exo</i> isomer of 11-oxatricyclo[6.2.1.0^2,7^]undec-4-ene-9,10-diyl diacetate","Acta Crystallographica Section E","2005","61","6","o1677","o1679","10.1107/S160053680501398X","","","0.71073","MoKα","","0.049","0.045","","","0.124","0.127","","","","","","1.05","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206111","10.4499","0.0018","6.0036","0.001","13.688","0.002","90","","103.995","0.002","90","","833.3","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis[2-(2-pyridyl)ethyl]dithiooxamide","","- C16 H18 N4 S2 -","- C16 H18 N4 S2 -","- C32 H36 N8 S4 -","2","0.5","YA6245","Cui, Jian-Zhong; Zhang, Dan; Pan, Shuo-Wen; Cheng, Peng; Liao, Dai-Zheng; Wang, Geng-Lin","<i>N</i>,<i>N</i>'-Bis[2-(2-pyridyl)ethyl]dithiooxamide","Acta Crystallographica Section E","2005","61","6","o1913","o1915","10.1107/S1600536805016338","","","0.71073","MoKα","","0.046","0.033","","","0.093","0.097","","","","","","1.11","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206112","5.31","0.0003","9.0392","0.0004","15.3871","0.0008","90","","90","","90","","738.55","0.07","299","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","4-Hydroxyphenylacetic acid","","- C8 H8 O3 -","- C8 H8 O3 -","- C32 H32 O12 -","4","1","YA6248","Sandra Gracin; Andreas Fischer","4-Hydroxyphenylacetic acid","Acta Crystallographica Section E","2005","61","6","o1919","o1920","10.1107/S1600536805016405","","","0.71073","MoKα","","0.063","0.044","","","0.099","0.111","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206113","27.871","0.002","4.6083","0.0003","17.3806","0.0015","90","","90.949","0.007","90","","2232","0.3","296","","296","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(2-Cyanomethoxy-6-methoxyphenoxy)acetonitrile","","- C11 H10 N2 O3 -","- C11 H10 N2 O3 -","- C88 H80 N16 O24 -","8","1","AT6011","Sancak, Kemal","(2-Cyanomethoxy-6-methoxyphenoxy)acetonitrile","Acta Crystallographica Section E","2005","61","7","o2015","o2017","10.1107/S1600536805015837","","","0.71073","MoKα","","0.073","0.043","","","0.103","0.113","","","","","","0.92","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206114","8.1578","0.0008","10.8246","0.0012","12.1665","0.0011","75.445","0.008","89.69","0.008","74.082","0.008","997.68","0.18","297","2","297","2","","","","","","","","5","P -1","-P 1","2","","Poly[[[diaquabis(pyridine-4-carboxamide-κN^1^)cobalt(II)]-μ~2~- squarato-κO:O'] dihydrate]","","- C16 H20 Co N4 O10 -","- C16 H20 Co N4 O10 -","- C32 H40 Co2 N8 O20 -","2","1","AT6015","Uçar, İbrahim; Bulut, Ahmet","Poly[[[diaquabis(pyridine-4-carboxamide-κ<i>N</i>^1^)cobalt(II)]-μ~2~-squarato-κ<i>O</i>:<i>O</i>'] dihydrate]","Acta Crystallographica Section E","2005","61","7","m1320","m1323","10.1107/S1600536805018295","","","0.71073","MoKα","","0.084","0.056","","","0.148","0.164","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206115","10.6294","0.0019","13.299","0.002","13.702","0.002","104.778","0.003","95.84","0.003","91.828","0.003","1859.8","0.5","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","10''-(4-Methoxybenzylidene)-5''-(4-methoxyphenyl)-4'-(4-methoxyphenyl)-1'- methyl-2,3,2'',3'',7'',8'',9'',10''-octahydro-1H,5''H,6''H-indole-3-spiro-2'- pyrrolidine-3'-spiro-2''-cyclohepteno[1,2-d]thiazolo[3,2-a]pyrimidine-2,3''- dione","","- C44 H42 N4 O5 S -","- C44 H42 N4 O5 S -","- C88 H84 N8 O10 S2 -","2","1","AT6016","Chen, Hong-Liang; Feng, Ya-Qing; Hu, Xiao-Fen; Liu, Xin-Gang","10''-(4-Methoxybenzylidene)-5'',4'-bis(4-methoxyphenyl)-1'-methyl-2,3,2'',3'',7'',8'',9'',10''-octahydro-1<i>H</i>,5''<i>H</i>,6''<i>H</i>-indole-3-spiro-2'-pyrrolidine-3'-spiro-2''-cyclohepteno[1,2-<i>d</i>]thiazolo[3,2-<i>a</i>]pyrimidine-2,3''-dione","Acta Crystallographica Section E","2005","61","7","o2086","o2088","10.1107/S1600536805017939","","","0.71073","MoKα","","0.126","0.055","","","","0.14","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206116","15.1169","0.0018","10.7393","0.0013","10.2017","0.0013","90","","95.839","0.003","90","","1647.6","0.3","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(5,7-Dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yloxy)benzoic acid isopropyl ester","","- C17 H18 N4 O3 -","- C17 H18 N4 O3 -","- C68 H72 N16 O12 -","4","1","AT6017","Qiong Chen; Qiong-You wu; Xiao-Wei Hu; Guang-Fu Yang","Isopropyl 2-(5,7-dimethyl-1,2,4-triazolo[1,5-<i>a</i>]pyrimidin-2-yloxy)benzoate","Acta Crystallographica Section E","2005","61","7","o2079","o2080","10.1107/S1600536805017885","","","0.71073","MoKα","","0.104","0.059","","","0.135","0.159","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206117","8.7619","0.0005","9.8234","0.0007","18.5527","0.001","90","","92.27","0.004","90","","1595.61","0.17","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(2-Bromo-4,5-dimethoxybenzyloxy)phthalonitrile","","- C17 H13 Br N2 O3 -","- C17 H13 Br N2 O3 -","- C68 H52 Br4 N8 O12 -","4","1","AT6018","Ocak Ískeleli, Nazan; Atalay, Şehriman; Ağar, Erbil; Akdemir, Nesuhi","4-(2-Bromo-4,5-dimethoxybenzyloxy)phthalonitrile","Acta Crystallographica Section E","2005","61","7","o2294","o2295","10.1107/S1600536805020076","","","0.71073","MoKα","","0.066","0.043","","","0.109","0.127","","","","","","1.11","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206118","14.66","0.03","12.62","0.03","15.14","0.03","90","","96.62","0.03","90","","2782","10","293","2","293","2","","","","","","","","3","P 1 2/n 1","-P 2yac","13","p-cumylcalix[4]arene‒para-xylene (1/1)","4-(2-Phenylisopropyl)calix[4]arene‒1,4-dimethylbenzene (1/1)","","- C72 H74 O4 -","- C72 H70 O4 -","- C144 H140 O8 -","2","0.5","BD6001","Abdelhak, Ettahiri; Merle, Daphne; Perrin, Monique; Thozet, Alain","<i>p</i>-Cumylcalix[4]arene‒<i>para</i>-xylene (1/1)","Acta Crystallographica Section E","2005","61","7","o2001","o2002","10.1107/S1600536805016442","","","0.71073","MoKα","","0.0993","0.0549","","","0.1333","0.1547","","","","","","1.016","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206119","13.151","0.003","7.166","0.0014","14.7","0.003","90","","97.53","0.03","90","","1373.4","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-(4-Methoxyphenyl)-1-phenylpyrazolidin-3-one","","- C16 H16 N2 O2 -","- C16 H16 N2 O2 -","- C64 H64 N8 O8 -","4","1","BD6003","Shi, Hong; Zhu, Hong-Jun; Yin, Peng-Wei; Wang, Jin-Tang; Shi, Xiao-Lan","5-(4-Methoxyphenyl)-1-phenylpyrazolidin-3-one","Acta Crystallographica Section E","2005","61","7","o2246","o2247","10.1107/S1600536805019227","","","0.71073","MoKα","","0.0772","0.048","","","0.143","0.1621","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206120","4.8966","0.0008","7.2049","0.0012","14.719","0.002","90","","90","","90","","519.28","0.14","168","2","168","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-Methylimidazolidinetrione","","- C4 H4 N2 O3 -","- C4 H4 N2 O3 -","- C16 H16 N8 O12 -","4","1","BD6004","Rodriguez, Mark A.; Andrews, Nicholas L.; Boyle, Timothy J.; Frazer, Colleen S.","<i>N</i>-Methylimidazolidinetrione","Acta Crystallographica Section E","2005","61","7","o2288","o2290","10.1107/S1600536805019690","","","0.71073","MoKα","","0.0401","0.0313","","","0.0761","0.0812","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206121","3.823","0.0014","15.99","0.005","13.1","0.004","90","","99.768","0.009","90","","789.2","0.5","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[(3-acetylpyridine)copper(I)]-μ~3~-chloro]","","- C14 H14 Cl2 Cu2 N2 O2 -","- C14 H14 Cl2 Cu2 N2 O2 -","- C28 H28 Cl4 Cu4 N4 O4 -","2","0.5","BH6008","Lennartson, Anders; Salo, Kent; Håkansson, Mikael","<i>catena</i>-Poly[[(3-acetylpyridine)copper(I)]-μ~3~-chloro]","Acta Crystallographica Section E","2005","61","7","m1261","m1263","10.1107/S1600536805017150","","","0.71073","MoKα","","0.0779","0.0529","","","0.131","0.1424","","","","","","0.908","","","","has coordinates,has Fobs","249787","2020-10-21","18:00:00",""
"2206122","12.066","0.0005","18.2275","0.0008","15.1284","0.0006","90","","93.774","0.001","90","","3320","0.2","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tris(2-methyl-2-phenylpropyl)(pyridine-3-carboxylato)tin(IV)","","- C36 H43 N O2 Sn -","- C36 H43 N O2 Sn -","- C144 H172 N4 O8 Sn4 -","4","1","BH6011","Tian, Lai-Jin; Sun, Yu-Xi; Yang, Min; Yang, Guo-Ming","Tris(2-methyl-2-phenylpropyl)(pyridine-3-carboxylato)tin(IV)","Acta Crystallographica Section E","2005","61","7","m1346","m1347","10.1107/S1600536805018635","","","0.71073","MoKα","","0.0384","0.0299","","","0.0745","0.0795","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206123","10.6177","0.0008","17.6052","0.0013","14.1076","0.001","90","","105.897","0.002","90","","2536.2","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Z)-Ethyl 3-(4-methylphenyl)-2-[(triphenylphosphoranylidene)amino]prop-2-enoate","","- C30 H28 N O2 P -","- C30 H28 N O2 P -","- C120 H112 N4 O8 P4 -","4","1","BH6012","Huang, Xiao-Bo; Xu, Rong; Ding, Jin-Chang; Wu, Hua-Yue; Zhang, Xi-Chang; Liu, Miao-Chang; Xiao, Hong-Ping","(<i>Z</i>)-Ethyl 3-(4-methylphenyl)-2-[(triphenylphosphoranylidene)amino]prop-2-enoate","Acta Crystallographica Section E","2005","61","7","o2196","o2197","10.1107/S1600536805018647","","","0.71073","MoKα","","0.0899","0.0668","","","0.139","0.1495","","","","","","1.095","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206124","10.4162","0.0014","16.693","0.002","15.536","0.002","90","","97.474","0.002","90","","2678.4","0.6","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[μ-pyruvic acid benzoylhydrazonato(2-)]bis[bis(4-chlorobenzyl)ethanoltin(IV)]","","- C52 H52 Cl4 N4 O8 Sn2 -","- C52 H52 Cl4 N4 O8 Sn2 -","- C104 H104 Cl8 N8 O16 Sn4 -","2","0.5","BR6193","Min Hong; Handong Yin; Daqi Wang; Haolong Xu","Bis[μ-pyruvic acid benzoylhydrazonato(2‒)]bis[bis(4-chlorobenzyl)ethanoltin(IV)]","Acta Crystallographica Section E","2005","61","7","m1248","m1250","10.1107/S1600536805016910","","","0.71073","MoKα","","0.0542","0.0336","","","0.0865","0.1059","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206125","18.1814","0.0008","18.1814","0.0008","8.546","0.0007","90","","90","","90","","2825","0.3","298","2","298","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","cyclo-Tetrakis{μ-1-[2-(2-oxidoethylamino)ethyliminomethyl]naphthalen-2- olato}tetranickel(II)","","- C60 H64 N8 Ni4 O8 -","- C60 H64 N8 Ni4 O8 -","- C120 H128 N16 Ni8 O16 -","2","0.25","BR6196","Ma, Ji-Long; You, Zhong-Lu; Zhu, Hai-Liang","<i>cyclo</i>-Tetrakis{μ-1-[2-(2-oxidoethylamino)ethyliminomethyl]naphthalen-2-olato}tetranickel(II)","Acta Crystallographica Section E","2005","61","7","m1258","m1260","10.1107/S1600536805017058","","","0.71073","MoKα","","0.0621","0.0486","","","0.1156","0.1233","","","","","","1.056","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206126","14.4166","0.0009","7.7234","0.0005","18.6868","0.0011","90","","107.421","0.001","90","","1985.2","0.2","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H16 Mn N2 O8 S -","- C19 H16 Mn N2 O8 S -","- C76 H64 Mn4 N8 O32 S4 -","4","1","BR6197","Fan, Sai-Rong; Zhu, Long-Guan","<i>catena</i>-Poly[[<i>cis</i>-diaqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II)]-μ~2~-5-sulfonatosalicylato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","7","m1298","m1300","10.1107/S1600536805017861","","","0.71073","MoKα","","0.0333","0.0303","","","0.0819","0.0839","","","","","","1.069","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206127","8.2289","0.0009","15.2809","0.0017","23.793","0.003","90","","95.946","0.002","90","","2975.8","0.6","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Pyridine{4,4',6,6'-tetrabromo-2,2'-[1,2- phenylenebis(nitrilomethylidyne)]diphenolato}zinc(II) dimethylformamide solvate","","- C28 H22 Br4 N4 O3 Zn -","- C28 H22 Br4 N4 O3 Zn -","- C112 H88 Br16 N16 O12 Zn4 -","4","1","BR6198","Yu Wu; Zongqiu Hu; Mingtian Li; Xucheng Fu","Pyridine{4,4',6,6'-tetrabromo-2,2'-[1,2-phenylenebis(nitrilomethylidyne)]diphenolato}zinc(II) dimethylformamide solvate","Acta Crystallographica Section E","2005","61","7","m1352","m1353","10.1107/S1600536805018787","","","0.71073","MoKα","","0.0777","0.0445","","","0.119","0.1616","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206128","13.6402","0.0009","10.4097","0.0006","18.443","0.0011","90","","99.756","0.001","90","","2580.9","0.3","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-[α-(4-Methoxyphenyl)-β-(4-chlorophenyl)vinyl]-2-methyl-1-phenylsulfonyl- 1H-indole","","- C30 H24 Cl N O3 S -","- C30 H24 Cl N O3 S -","- C120 H96 Cl4 N4 O12 S4 -","4","1","BT6662","G. Usha; S. Selvanayagam; D. Velmurugan; K. Ravikumar; P. Jaisankar; P. C. Srinivasan","3-[β-(4-Chlorophenyl)-α-(4-methoxyphenyl)vinyl]-2-methyl-1-phenylsulfonyl-1<i>H</i>-indole","Acta Crystallographica Section E","2005","61","7","o2227","o2229","10.1107/S1600536805017472","","","0.71073","MoKα","","0.1045","0.0851","","","0.2563","0.277","","","","","","1.052","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206129","8.2023","0.0005","11.7111","0.0007","25.465","0.0015","102.102","0.001","90.014","0.001","103.949","0.001","2317.9","0.2","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","2'-Benzoyl-1'-(4-chlorophenyl)-5',6',7',7a'-tetrahydrospiro[indan- 2,3'(2'H)-1H-pyrrolizidine]-1,3-dione","","- C28 H22 Cl N O3 -","- C28 H22 Cl N O3 -","- C112 H88 Cl4 N4 O12 -","4","2","BT6673","S. Kalyanasundaram; S. Selvanayagam; D. Velmurugan; K. Ravikumar; M. Poornachandran; R. Raghunathan","2'-Benzoyl-1'-(4-chlorophenyl)-5',6',7',7a'-tetrahydrospiro[indan-2,3'(2'<i>H</i>)-1<i>H</i>-pyrrolizine]-1,3-dione","Acta Crystallographica Section E","2005","61","7","o2158","o2160","10.1107/S1600536805015928","","","0.71073","MoKα","","0.056","0.0462","","","0.1338","0.1429","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206130","5.357","0.002","8.232","0.003","10.172","0.004","96.88","0.03","104.47","0.03","102.11","0.03","417.6","0.3","293","2","293","2","","","","","","","","4","P 1","P 1","1","L-Asparaginium Nitrate","L-Asparaginium nitrate","","- C4 H9 N3 O6 -","- C4 H9 N3 O6 -","- C8 H18 N6 O12 -","2","2","BT6674","A. Aarthy; K. Anitha; S. Athimoolam; S. Asath Bahadur; R.K. Rajaram","<small>L</small>-Asparaginium nitrate","Acta Crystallographica Section E","2005","61","7","o2042","o2044","10.1107/S1600536805017496","","","0.71073","MoKα","","0.0638","0.0577","","","0.1678","0.1891","","","","","","1.134","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206131","8.9769","0.0009","14.3789","0.0013","10.0589","0.001","90","","101.755","0.008","90","","1271.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(E)-4-Methoxy-2-[(4-nitrophenyl)iminomethyl]phenol","","- C14 H12 N2 O4 -","- C14 H12 N2 O4 -","- C56 H48 N8 O16 -","4","1","BT6675","Kos̨ar, Bas̨ak; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","(<i>E</i>)-4-Methoxy-2-[(4-nitrophenyl)iminomethyl]phenol","Acta Crystallographica Section E","2005","61","7","o2106","o2108","10.1107/S1600536805018155","","","0.71073","MoKα","","0.1155","0.0418","","","0.0901","0.1044","","","","","","0.817","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206132","27.883","0.002","7.1237","0.0007","14.7975","0.001","90","","111.524","0.004","90","","2734.3","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(E)-2-Ethoxy-6-[(4-nitrophenyl)iminomethyl]phenol","","- C15 H14 N2 O4 -","- C15 H14 N2 O4 -","- C120 H112 N16 O32 -","8","1","BT6676","Koşar, Başak; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","(<i>E</i>)-2-Ethoxy-6-[(4-nitrophenyl)iminomethyl]phenol","Acta Crystallographica Section E","2005","61","7","o2109","o2111","10.1107/S1600536805018167","","","0.71073","MoKα","","0.085","0.0349","","","0.0625","0.0685","","","","","","0.809","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206133","14.8973","0.0011","8.9581","0.0007","18.9941","0.0014","90","","97.658","0.001","90","","2512.2","0.3","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-[α-(4-Methoxyphenyl)-β-phenylvinyl]-2-methyl-1-phenylsulfonyl-1H-indole","","- C30 H25 N O3 S -","- C30 H25 N O3 S -","- C120 H100 N4 O12 S4 -","4","1","BT6677","G. Usha; S. Selvanayagam; D. Velmurugan; K. Ravikumar; P. Jaisankar; P. C. Srinivasan","3-[α-(4-Methoxyphenyl)-β-phenylvinyl]-2-methyl-1-phenylsulfonyl-1<i>H</i>-indole","Acta Crystallographica Section E","2005","61","7","o2221","o2223","10.1107/S1600536805018921","","","0.71073","MoKα","","0.0665","0.0483","","","0.1292","0.1425","","","","","","1.014","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206134","10.8372","0.0006","17.2384","0.001","12.722","0.0007","90","","90.269","0.001","90","","2376.6","0.2","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(2,5-Dimethylbenzyl)-3-phenylsulfanyl-1-phenylsulfonyl-1H-indole","","- C29 H25 N O2 S2 -","- C29 H25 N O2 S2 -","- C116 H100 N4 O8 S8 -","4","1","BT6678","G. Usha; S. Selvanayagam; D. Velmurugan; K. Ravikumar; N. Sureshbabu; P. C. Srinivasan","2-(2,5-Dimethylbenzyl)-3-phenylsulfanyl-1-phenylsulfonyl-1<i>H</i>-indole","Acta Crystallographica Section E","2005","61","7","o2224","o2226","10.1107/S1600536805018933","","","0.71073","MoKα","","0.0609","0.0493","","","0.1334","0.1431","","","","","","1.012","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206135","10.485","0.004","33.972","0.008","12.544","0.004","90","","102.12","0.03","90","","4369","2","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","syn-exo-4,7-Bis(trimethylsilyl)-4,7-dihydro[2.2]paracyclophane","","- C22 H34 Si2 -","- C22 H34 Si2 -","- C176 H272 Si16 -","8","2","BT6679","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Savinsky, Rainer","<i>syn</i>-<i>exo</i>-4,7-Bis(trimethylsilyl)-4,7-dihydro[2.2]paracyclophane","Acta Crystallographica Section E","2005","61","7","o2175","o2176","10.1107/S1600536805018349","","","0.71073","MoKα","","0.1304","0.0549","","","0.1225","0.1642","","","","","","0.993","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206136","13.906","0.004","13.906","0.004","16.263","0.005","90","","90","","90","","3144.9","1.6","143","2","143","2","","","","","","","","3","I 41 2 2","I 4bw 2bw","98","","syn-exo-4,7,12,15-Tetrakis(trimethylsilyl)-4,7,12,15- tetrahydro[2.2]paracyclophane","","- C28 H52 Si4 -","- C28 H52 Si4 -","- C112 H208 Si16 -","4","0.25","BT6680","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Savinsky, Rainer","<i>syn</i>-<i>exo</i>-4,7,12,15-Tetrakis(trimethylsilyl)-4,7,12,15-tetrahydro[2.2]paracyclophane","Acta Crystallographica Section E","2005","61","7","o2177","o2178","10.1107/S1600536805018350","","","0.71073","MoKα","","0.0489","0.0404","","","0.1065","0.1142","","","","","","1.068","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206137","6.6033","0.001","12.3957","0.0018","6.7152","0.001","90","","102.783","0.012","90","","536.03","0.14","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,4-Bis(dibromomethylidene)cyclohexane","","- C8 H8 Br4 -","- C8 H8 Br4 -","- C16 H16 Br8 -","2","0.5","BT6681","Jones, Peter G.; Kämpen, Jan; Bubenitschek, Peter; Hopf, Henning","1,4-Bis(dibromomethylidene)cyclohexane: crystal packing with Br···Br and Br···π contacts","Acta Crystallographica Section E","2005","61","7","o2179","o2180","10.1107/S1600536805018374","","","0.71073","MoKα","","0.0652","0.0415","","","0.0976","0.1051","","","","","","1.126","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206138","5.8205","0.0005","18.0795","0.0015","10.6725","0.001","90","","94.324","0.006","90","","1119.89","0.17","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(E)-2,2,6,6-Tetramethyl-4-hepten-3-one","","- C11 H20 O -","- C11 H20 O -","- C44 H80 O4 -","4","1","BT6682","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Mlynek, Cornelia","(<i>E</i>)-2,2,6,6-Tetramethylhept-4-en-3-one","Acta Crystallographica Section E","2005","61","7","o2181","o2182","10.1107/S1600536805018386","","","0.71073","MoKα","","0.0714","0.0401","","","0.0886","0.0981","","","","","","0.928","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206139","8.8352","0.0004","10.0584","0.0007","11.4944","0.0008","71.2","0.03","88.61","0.04","69.86","0.04","903.5","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Tricarbonyl[η^4^-2-phenyl-4-(3-phenylallylidene)-4H-oxazol-5-onato]iron","","- C21 H13 Fe N O5 -","- C21 H13 Fe N O5 -","- C42 H26 Fe2 N2 O10 -","2","1","BT6683","Imhof, Wolfgang; Garms, Stefan","Tricarbonyl[η^4^-2-phenyl-4-(3-phenylallylidene)-4<i>H</i>-oxazol-5-one]iron(0)","Acta Crystallographica Section E","2005","61","7","m1413","m1415","10.1107/S1600536805019483","","","0.71073","MoKα","","0.0533","0.0393","","","0.0911","0.0974","","","","","","1.041","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206140","7.073","0.003","7.423","0.003","7.711","0.003","83.87","0.03","81.98","0.03","62.24","0.03","354.3","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","5-Chloro-2-nitroaniline","","- C6 H5 Cl N2 O2 -","- C6 H5 Cl N2 O2 -","- C12 H10 Cl2 N4 O4 -","2","1","BT6685","Ng, Seik Weng","5-Chloro-2-nitroaniline","Acta Crystallographica Section E","2005","61","7","o2299","o2300","10.1107/S1600536805019707","","","0.71073","MoKα","","0.048","0.041","","","0.118","0.122","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206141","12.409","0.003","3.768","0.002","13.349","0.003","90","","104.42","0.03","90","","604.5","0.4","295","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,3-Dihydroxybenzaldehyde","","- C7 H6 O3 -","- C7 H6 O3 -","- C28 H24 O12 -","4","1","BT6686","Ng, Seik Weng","2,3-Dihydroxybenzaldehyde","Acta Crystallographica Section E","2005","61","7","o2301","o2302","10.1107/S1600536805019719","","","0.71073","MoKα","","0.04","0.036","","","0.108","0.111","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206142","6.9774","0.0002","10.1668","0.0003","27.6762","0.0007","90","","96.495","0.002","90","","1950.69","0.09","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3,4-dichloronitrobenzene‒aniline (2/1)","","- C18 H13 Cl4 N3 O4 -","- C18 H13 Cl4 N3 O4 -","- C72 H52 Cl16 N12 O16 -","4","1","BT6687","Sarah A. Barnett; Johnston, Andrea; Florence, Alastair J.; Kennedy, Alan R.","3,4-Dichloro-1-nitrobenzene‒aniline (2/1)","Acta Crystallographica Section E","2005","61","7","o2318","o2319","10.1107/S1600536805019999","","","0.71073","MoKα","","0.0695","0.0382","","","0.0713","0.0805","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206143","9.624","0.006","12.811","0.007","13.392","0.009","112.231","0.005","96.527","0.006","90.078","0.006","1516.7","1.6","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","[2-Carboxy-2,2',2''-nitrilotris(ethanethiolato)- κ^4^N,S,S',S''](triphenylphosphine-κP)rhenium(III) acetone solvate","","- C28 H33 N O3 P Re S3 -","- C28 H33 N O3 P Re S3 -","- C56 H66 N2 O6 P2 Re2 S6 -","2","1","CF6427","Eik Schiller; Werner Kraus; Günter Reck; Hartmut Spies; Hans-Jürgen Pietzsch","[2-Carboxy-2,2',2''-nitrilotris(ethanethiolato)-κ^4^<i>N</i>,<i>S</i>,<i>S</i>',<i>S</i>''](triphenylphosphine-κ<i>P</i>)rhenium(III) acetone solvate","Acta Crystallographica Section E","2005","61","7","m1373","m1375","10.1107/S1600536805018660","","","0.71073","MoKα","","0.09","0.0737","","","0.2027","0.214","","","","","","0.986","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206144","5.2736","0.0005","7.7366","0.0006","13.6863","0.001","89.184","0.006","83.433","0.006","74.64","0.006","534.84","0.08","293","","293","","","","","","","","","3","P -1","-P 1","2","","2-Phenoxybenzoic acid","","- C13 H10 O3 -","- C13 H10 O3 -","- C26 H20 O6 -","2","1","CF6429","Andrew Parkin; Suzanne M. Harte; Donnie Carmichael; Scott Currie; Lorna Drummond; Adam Haahr; Kevin Haggerty; Tracey Hunter; André Lamarque; Loretta Lawton; Craig Martin; Jennifer E. Mathieson; Thomas McGlone; Julie McGregor; Liam McMillan; Louise Robertson; Robert Thatcher; Steven Vance; Chick C. Wilson","2-Phenoxybenzoic acid at room temperature","Acta Crystallographica Section E","2005","61","7","o2280","o2282","10.1107/S1600536805019495","","","0.71073","MoKα","","0.0811","0.0538","","0.1637","0.1561","0.1637","","","","","","0.9314","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206145","9.2618","0.0004","23.6323","0.0008","15.1606","0.0007","90","","103.023","0.004","90","","3233","0.2","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","7,11-[Butane-1,4-diyldioxydi-o-phenylenedimethylene]-6,6-dichloro- 4,4-bis(pyrrolidin-1-yl)-2λ^5^,4λ^5^,6λ^5^-triphosphaza-1,3,5,7,11- pentaazaspiro[5.5]undeca-1,3,5-triene","","- C29 H42 Cl2 N7 O2 P3 -","- C29 H42 Cl2 N7 O2 P3 -","- C116 H168 Cl8 N28 O8 P12 -","4","1","CF6432","Tercan, Barış; Hökelek, Tuncer; Büyükgüngör, Orhan; Asmafiliz, Nuran; İlter, Elif Ece; Kılıç, Zeynel","7,11-(Butane-1,4-diyldioxydi-<i>o</i>-phenylenedimethylene)-6,6-dichloro-4,4-bis(pyrrolidin-1-yl)-2λ^5^,4λ^5^,6λ^5^-triphosphaza-1,3,5,7,11-pentaazaspiro[5.5]undeca-1,3,5-triene","Acta Crystallographica Section E","2005","61","7","o2145","o2147","10.1107/S1600536805018362","","","0.71073","MoKα","","0.0425","0.0335","","","0.0851","0.089","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206146","11.768","0.004","8.164","0.003","20.428","0.007","90","","105.474","0.006","90","","1891.5","1.1","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[2-Oxido-1-naphthaldehyde (2-hydroxybenzoyl)hydrazonato]pyridinenickel(II)","","- C23 H17 N3 Ni O3 -","- C23 H17 N3 Ni O3 -","- C92 H68 N12 Ni4 O12 -","4","1","CF6433","Ming-Li Liu; Jian-Min Dou; Da-Qi Wang; Da-Cheng Li","[2-Oxido-1-naphthaldehyde (2-hydroxybenzoyl)hydrazonato]pyridinenickel(II)","Acta Crystallographica Section E","2005","61","7","m1366","m1367","10.1107/S1600536805018672","","","0.71073","MoKα","","0.0562","0.0377","","","0.0821","0.0921","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206147","15.005","0.003","10.2992","0.0019","19.602","0.004","90","","97.984","0.003","90","","2999.9","1","173","2","173","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Cholesteryl isobutylcarbonate","","- C32 H54 O3 -","- C32 H54 O3 -","- C128 H216 O12 -","4","2","CF6437","Park, Young Ja; Bae, Jinmi; Lah, Myoung Soo","Cholesteryl isobutylcarbonate","Acta Crystallographica Section E","2005","61","7","o2312","o2314","10.1107/S1600536805020118","","","0.71073","MoKα","","0.0752","0.0578","","","0.1543","0.1689","","","","","","1.037","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206148","8.4402","0.0007","22.1502","0.0019","14.5043","0.0012","90","","95.835","0.002","90","","2697.6","0.4","292","2","292","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Diethyl 2,5-bis(3,4,5-trimethoxyphenyl)furan-3,4-dicarboxylate 0.16-hydrate","","- C28 H32.32 O11.16 -","- C28 H32.32 O11.16 -","- C112 H129.28 O44.64 -","4","1","CI6584","Hu, Sheng-Li; Wu, An-Xin","Diethyl 2,5-bis(3,4,5-trimethoxyphenyl)furan-3,4-dicarboxylate 0.16-hydrate","Acta Crystallographica Section E","2005","61","7","o2030","o2032","10.1107/S1600536805016430","","","0.71073","MoKα","","0.0996","0.0638","","","0.1579","0.1803","","","","","","1.063","","","","has coordinates,has disorder,has Fobs","194389","2020-10-21","18:00:00",""
"2206149","7.846","0.005","16.758","0.014","12.94","0.015","90","","98.374","0.012","90","","1683","3","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-methyl-4-(4-nitrophenyl)‒6-oxo-1-phenyl-4,5-dihydropyrazolo[3,4-b]pyridine","","- C19 H16 N4 O3 -","- C19 H16 N4 O3 -","- C76 H64 N16 O12 -","4","1","CI6587","Jiang, Hong; Tu, Shu-Jiang; Zhu, Song-Lei","3-Methyl-4-(4-nitrophenyl)-6-oxo-1-phenyl-4,5-dihydropyrazolo[3,4-<i>b</i>]pyridine","Acta Crystallographica Section E","2005","61","7","o2074","o2075","10.1107/S1600536805017800","","","0.7107","MoKα","","0.0739","0.0616","","","0.1458","0.1539","","","","","","1.131","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206150","7.078","0.001","11.597","0.002","13.924","0.002","77.89","0.01","75.41","0.01","79.35","0.01","1070.9","0.3","289","2","289","2","","","","","","","","6","P -1","-P 1","2","","Bis(trimethylaminium) hexaaquazinc(II) bis(naphthalene-1,6-disulfonate)","","- C32 H56 N2 O18 S4 Zn -","- C32 H56 N2 O18 S4 Zn -","- C32 H56 N2 O18 S4 Zn -","1","0.5","CI6590","Wei-Guang San; Hai Feng; Li Li; Zhi-Min Jin; Mao-Lin Hu","Bis(triethylaminium) hexaaquazinc(II) bis(naphthalene-1,6-disulfonate)","Acta Crystallographica Section E","2005","61","7","m1363","m1365","10.1107/S160053680501888X","","","0.71073","MoKα","","0.0476","0.0366","","","0.1022","0.1061","","","","","","1.098","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2206151","5.2029","0.0014","7.79","0.002","13.496","0.004","99.166","0.004","90.369","0.004","106.993","0.004","515.6","0.2","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","5-butyl-6-methyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one","","- C9 H14 N2 O S -","- C9 H14 N2 O S -","- C18 H28 N4 O2 S2 -","2","1","CI6591","Long, Tao; Zhou, Hong-Bin; Wu, An-Xin","5-Butyl-6-methyl-2-thioxo-2,3-dihydropyrimidin-4(1<i>H</i>)-one","Acta Crystallographica Section E","2005","61","7","o2169","o2171","10.1107/S1600536805018465","","","0.71073","MoKα","","0.0726","0.0567","","","0.1516","0.1645","","","","","","1.061","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2206152","27.942","0.009","14.203","0.006","8.353","0.003","90","","90.291","0.006","90","","3315","2","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","5,6,6a,7,8,8a-Hexahydro-6a,7-dihydroxy-13bH-indeno[2,1-c]phenanthren- 9(13cH)-one hemihydrate","","- C21 H21 O3.5 -","- C21 H21 O3.5 -","- C168 H168 O28 -","8","1","CI6592","Hong-Tao Mu; Lin Liu; Hai-Bin Song; He-Yang Li; Wen-Bin Chen","5,6,6a,7,8,8a-Hexahydro-6a,7-dihydroxy-13b<i>H</i>-indeno[2,1-<i>c</i>]phenanthren-9(13c<i>H</i>)-one hemihydrate","Acta Crystallographica Section E","2005","61","7","o2216","o2218","10.1107/S1600536805018891","","","0.71073","MoKα","","0.08","0.0432","","","0.0882","0.1017","","","","","","1.017","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206153","23.458","0.007","13.923","0.004","8.228","0.002","90","","101.163","0.005","90","","2636.5","1.3","292","2","292","2","","","","","","","","7","C 1 c 1","C -2yc","9","(MB)[PbI~3~].DMF","catena-Poly[[[3,7-bis(dimethylamino)phenazathionium] lead(II)-tri-μ-iodo] N,N'-dimethylformamide]","","- C19 H25 I3 N4 O Pb S -","- C19 H25 I3 N4 O Pb S -","- C76 H100 I12 N16 O4 Pb4 S4 -","4","1","CI6594","Ming-Tian Li; Qin-Ling Liao; Xu-Cheng Fu; Cheng-Gang Wang","<i>catena</i>-Poly[[[3,7-bis(dimethylamino)phenothiazonium] lead(II)-tri-μ-iodo] <i>N</i>,<i>N</i>'-dimethylformamide]","Acta Crystallographica Section E","2005","61","7","m1396","m1397","10.1107/S1600536805019331","","","0.71073","MoKα","","0.049","0.037","","","0.0682","0.0721","","","","","","0.926","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206154","7.8763","0.0003","25.0242","0.0007","12.7232","0.0003","90","","101.275","0.001","90","","2459.32","0.13","297","1","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaqua(cyclohexane-1,1-diacetato-κ^2^O,O')(phenanthroline- κ^2^N,N')manganese(II) trihydrate","","- C22 H32 Mn N2 O9 -","- C22 H32 Mn N2 O9 -","- C88 H128 Mn4 N8 O36 -","4","1","CI6595","Liang Shen; Li-Cheng Yan; Zhi-Min Jin; Yi-Jian Zhang","Diaqua(cyclohexane-1,1-diacetato-κ^2^<i>O,O</i>')(phenanthroline-κ^2^<i>N,N</i>')manganese(II) trihydrate","Acta Crystallographica Section E","2005","61","7","m1419","m1421","10.1107/S1600536805019665","","","0.7107","MoKα","","","0.035","","","","0.075","","","","","","1.018","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206155","11.995","0.004","11.002","0.004","19.965","0.007","90","","101.419","0.006","90","","2582.6","1.6","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-(2,6-Dihydroxyphenyl)-3,3,6,6-tetramethyl-N-(4-methylphenyl)- 1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridine","","- C30 H33 N O4 -","- C30 H33 N O4 -","- C120 H132 N4 O16 -","4","1","CI6596","Hong Jang; Tuanjie Li; Shujiang Tu; Xiang Zou","9-(2,6-Dihydroxyphenyl)-3,3,6,6-tetramethyl-<i>N</i>-(4-methylphenyl)-1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridine","Acta Crystallographica Section E","2005","61","7","o2296","o2298","10.1107/S1600536805019720","","","0.71073","MoKα","","0.2283","0.0733","","","0.1689","0.2191","","","","","","1.009","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206156","29.409","0.004","5.8286","0.0014","11.73","0.003","90","","101.22","0.008","90","","1972.2","0.7","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Benzyloxy-6-fluoropyridazine","","- C11 H9 F N2 O -","- C11 H9 F N2 O -","- C88 H72 F8 N16 O8 -","8","2","CI6597","Fang-Zhong Hu; Min Zhang; Hai-Bin Song; Xiao-Mao Zou; Hua-Zheng Yang","3-Benzyloxy-6-fluoropyridazine","Acta Crystallographica Section E","2005","61","7","o2241","o2242","10.1107/S1600536805019161","","","0.71073","MoKα","","0.1669","0.0532","","","0.1221","0.1623","","","","","","0.984","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206157","10.9285","0.0006","21.3431","0.0007","16.8988","0.0008","90","","98.804","0.004","90","","3895.2","0.3","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tris(1,10-phenanthroline-κ^2^N,N')iron(II) squarate octahydrate","","- C40 H40 Fe N6 O12 -","- C40 H40 Fe N6 O12 -","- C160 H160 Fe4 N24 O48 -","4","1","CI6598","Uçar, İbrahim; Paşaoĝlu, Hümeyra; Büyükgüngör, Orhan; Bulut, Ahmet","Tris(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')iron(II) squarate octahydrate","Acta Crystallographica Section E","2005","61","7","m1405","m1407","10.1107/S1600536805019550","","","0.71073","MoKα","","0.0651","0.0405","","","0.1043","0.1128","","","","","","0.961","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206158","10.949","0.004","9.344","0.003","18.961","0.005","90","","109.154","0.016","90","","1832.5","1","293","2","293","2","","","","","","","","3","P 1 c 1","P -2yc","7","exo spiroalcohol","2-Hydroxy-2'-oxo-1,2,3,3a,8,8a,1',2',3',4'-decahydrospiro[cyclopenta[a]indene- 3,1'-naphthalen]-8-yl acetate","","- C23 H22 O4 -","- C23 H22 O4 -","- C92 H88 O16 -","4","2","CI6600","Hong-Tao Mu; He-Yang Li; Hai-Bin Song; Wen-Bin Chen","2-Hydroxy-2'-oxo-1,2,3,3a,8,8a,1',2',3',4'-decahydrospiro[cyclopenta[<i>a</i>]indene-3,1'-naphthalen]-8-yl acetate","Acta Crystallographica Section E","2005","61","7","o2305","o2307","10.1107/S1600536805019835","","","0.71073","MoKα","","0.0454","0.0338","","","0.0792","0.0873","","","","","","1.058","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206159","16.547","0.004","6.053","0.002","16.924","0.004","90","","111.93","0.02","90","","1572.4","0.8","295","2","295","3","","","","","","","","5","P 1 2/a 1","-P 2ya","13","","5-Bromo-1H-indole-3-carbaldehyde 2-nitrophenylhydrazone hemihydrate","","- C16 H12 Br N4 O3.5 -","- C16 H12 Br N4 O3.5 -","- C64 H48 Br4 N16 O14 -","4","1","CI6605","Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Ng, Seik Weng","5-Bromo-1<i>H</i>-indole-3-carbaldehyde 2-nitrophenylhydrazone hemihydrate","Acta Crystallographica Section E","2005","61","7","o2308","o2309","10.1107/S1600536805020064","","","0.71073","MoKα","","0.0598","0.0382","","","0.0994","0.1101","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206160","11.8342","0.001","26.0933","0.0019","12.4701","0.0011","90","","116.845","0.006","90","","3435.7","0.5","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[N,N'-Diphenylureato(2-)][phthalocyaninato(2-)]titanium(IV)","","- C45 H26 N10 O Ti -","- C45 H26 N10 O Ti -","- C180 H104 N40 O4 Ti4 -","4","1","CV6506","Darwish, Wael; Harms, Klaus; Sundermeyer, Jörg","[<i>N</i>,<i>N</i>'-Diphenylureato(2{-})][phthalocyaninato(2{-})]titanium(IV)","Acta Crystallographica Section E","2005","61","7","m1280","m1282","10.1107/S1600536805015850","","","0.71073","MoKα","","","0.042","","","","0.0914","","","","","","0.804","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206161","7.507","0.005","20.018","0.014","9.6","0.007","90","","103.33","0.011","90","","1403.8","1.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Amino-4-(ferrocenyl)-5-(1H-1,2,4-triazol-1-yl)-1,3-thiazole","","- C15 H13 Fe N5 S -","- C15 H13 Fe N5 S -","- C60 H52 Fe4 N20 S4 -","4","1","CV6515","Shao, Ling; Hu, Yan; Zhou, Xin; Zhang, Qing; Jin, Zhong; Liu, Jian-Bing; Fang, Jian-Xin","2-Amino-4-(ferrocenyl)-5-(1<i>H</i>-1,2,4-triazol-1-yl)-1,3-thiazole","Acta Crystallographica Section E","2005","61","7","m1269","m1271","10.1107/S1600536805017186","","","0.71073","MoKα","","0.0474","0.0308","","","0.0736","0.0917","","","","","","1.092","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206162","10.8522","0.0012","11.4576","0.0002","20.2987","0.0002","93.58","0.001","95.311","0.001","94.243","0.001","2500.1","0.3","295","2","295","2","","","","","","","","3","P -1","-P 1","2","","1,2-Dibenzoyl-3,4-bis(4-methoxyphenyl)cyclobutane","","- C32 H28 O4 -","- C32 H28 O4 -","- C128 H112 O16 -","4","2","CV6516","Steyl, Gideon; Hill, Tania; Roodt, Andreas","1,2-Dibenzoyl-3,4-bis(4-methoxyphenyl)cyclobutane","Acta Crystallographica Section E","2005","61","7","o1978","o1980","10.1107/S1600536805016806","","","0.71073","MoKα","","0.0761","0.046","","","0.1027","0.1162","","","","","","1.037","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206163","7.5001","0.0008","11.992","0.0013","14.111","0.0014","90.867","0.01","93.531","0.007","107.084","0.008","1210.1","0.2","100","2","100","","","","","","","","","4","P -1","-P 1","2","","N-[(1E)-(2,4-Dinitrophenyl)methylene]aniline","","- C13 H9 N3 O4 -","- C13 H9 N3 O4 -","- C52 H36 N12 O16 -","4","2","CV6518","Barys, Maciej; Ciunik, Zbigniew","<i>N</i>-[(<i>E</i>)-(2,4-Dinitrophenyl)methylene]aniline","Acta Crystallographica Section E","2005","61","7","o1967","o1969","10.1107/S1600536805016922","","","0.71073","MoKα","","0.0821","0.0429","","","0.0789","0.0859","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206164","7.8","0.0018","9.366","0.002","8.474","0.002","90","","96.114","0.004","90","","615.5","0.2","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Diaquadibromobis(1H-imidazole)nickel(II)","","- C6 H12 Br2 N4 Ni O2 -","- C6 H12 Br2 N4 Ni O2 -","- C12 H24 Br4 N8 Ni2 O4 -","2","0.5","CV6519","Zhang, Hui; Fang, Liang; Yuan, Runzhang","Diaquadibromobis(1<i>H</i>-imidazole)nickel(II)","Acta Crystallographica Section E","2005","61","7","m1391","m1392","10.1107/S1600536805019069","","","0.71073","MoKα","","0.0237","0.0203","","","0.0496","0.051","","","","","","1.054","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206165","9.071","0.002","9.546","0.002","11.506","0.003","66.45","0.004","71.709","0.004","74.49","0.004","855.6","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N'-(2-Fluorobenzylidene)-2-(quinolin-8-yloxy)acetohydrazide methanol solvate","","- C19 H18 F N3 O3 -","- C19 H18 F N3 O3 -","- C38 H36 F2 N6 O6 -","2","1","CV6520","Yong-Hong Wen; Shu-Sheng Zhang; Mao-Jie Li; Xue-Mei Li","<i>N</i>'-(2-Fluorobenzylidene)-2-(quinolin-8-yloxy)acetohydrazide methanol solvate","Acta Crystallographica Section E","2005","61","7","o2045","o2046","10.1107/S1600536805017575","","","0.71073","MoKα","","0.0503","0.0424","","","0.1135","0.1223","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206166","11.5192","0.0018","7.3222","0.0011","20.048","0.003","90","","90","","90","","1691","0.4","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-N-Methyl-1H-1,2,4-triazole-4-amino-5-mercapto-1,2,4-triazole","","- C5 H7 N7 S -","- C5 H7 N7 S -","- C40 H56 N56 S8 -","8","1","CV6521","Xu, Liang-Zhong; Yu, Guan-Ping; Xu, Feng-Ling; Li, Wei-Hua","4-Amino-3-(1,2,4-triazol-1-yl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","7","o2061","o2062","10.1107/S1600536805017587","","","0.71073","MoKα","","0.0478","0.0312","","","0.074","0.0832","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206167","18.476","0.004","11.494","0.002","8.4632","0.0017","90","","90","","90","","1797.3","0.6","292","2","292","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","1,2-Dimethyl-4,5-bis(phenoxymethyl)benzene","","- C22 H22 O2 -","- C22 H22 O2 -","- C88 H88 O8 -","4","0.5","CV6522","Guo-Dong Yin; Zhi-Guo Wang; An-Xin Wu","1,2-Dimethyl-4,5-bis(phenoxymethyl)benzene","Acta Crystallographica Section E","2005","61","7","o2148","o2149","10.1107/S1600536805018076","","","0.71073","MoKα","","0.0729","0.0447","","","0.1101","0.1201","","","","","","0.893","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206168","9.3444","0.0009","10.1558","0.001","11.6007","0.0011","99.651","0.002","100.645","0.002","102.014","0.002","1033.65","0.17","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-(4-methoxyphenyylsulfonamido)- 1H-pyrazole-3-carbonitrile","","- C18 H11 Cl2 F3 N4 O3 S -","- C18 H11 Cl2 F3 N4 O3 S -","- C36 H22 Cl4 F6 N8 O6 S2 -","2","1","CV6524","Zhang, Xiao-Hong; Zhong, Ping; Xiao, Hong-Ping; Hu, Mao-Lin","1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-(4-methoxyphenylsulfonamido)-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2005","61","7","o2134","o2135","10.1107/S160053680501812X","","","0.71073","MoKα","","0.0989","0.078","","","0.181","0.196","","","","","","1.077","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206169","7.7987","0.0013","11.324","0.002","17.75","0.003","90","","100.625","0.003","90","","1540.7","0.5","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(3,4-Dichlorobenzoylmethyl)-1,2-benzisothiazol-3(2H)-one 1,1-dioxide","","- C15 H9 Cl2 N O4 S -","- C15 H9 Cl2 N O4 S -","- C60 H36 Cl8 N4 O16 S4 -","4","1","CV6525","Liang-Zhong Xu; Yong-Wei Huang; Guan-Ping Yu; Pu-Yong Zhang; Ya-Xun Yang","2-(3,4-Dichlorobenzoylmethyl)-1,2-benzisothiazol-3(2<i>H</i>)-one 1,1-dioxide","Acta Crystallographica Section E","2005","61","7","o2123","o2124","10.1107/S1600536805018301","","","0.71073","MoKα","","0.075","0.0401","","","0.0902","0.1066","","","","","","1.015","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206170","19.9786","0.0017","5.355","0.0004","13.5855","0.0012","90","","107.507","0.002","90","","1386.1","0.2","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H21 N S2 -","- C13 H21 N S2 -","- C52 H84 N4 S8 -","4","1","CV6526","Muller, Alfred; Otto, Stefanus","Methyl 2-(cyclohexylamino)cyclopent-1-ene-1-dithiocarboxylate","Acta Crystallographica Section E","2005","61","7","o2198","o2199","10.1107/S1600536805018180","","","0.71073","MoKα","","","0.044","","","","0.1116","","","","","","0.833","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206171","6.287","0.0005","13.248","0.0009","22.25","0.0009","90","","90","","90","","1853.2","0.2","293","2","293","2","","","","","","","","5","P b c 21","P 2c -2b","29","","2-(Biphenyl-4-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one","","- C22 H19 N O2 S -","- C22 H19 N O2 S -","- C88 H76 N4 O8 S4 -","4","1","CV6528","Mahendra, M; Jayalakshmi, K.; Basappa; Rangappa, K. S.; Sridhar, M. A.; Shashidhara Prasad, J.","2-(Biphenyl-4-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one","Acta Crystallographica Section E","2005","61","7","o2315","o2317","10.1107/S1600536805019732","","","0.71073","MoKα","","0.067","0.045","","","0.0961","0.1097","","","","","","1.092","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206172","8.6418","0.0004","11.8765","0.0006","18.2755","0.0012","90","","90","","90","","1875.69","0.18","193","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(3R,6S,7R,8R,9S,9aS)-Methyl 6,9-diacetoxy-7,8-diazidoperhydro- 5-oxothiazolo[3,2-a]azepine-3-carboxylate","","- C14 H17 N7 O7 S -","- C14 H17 N7 O7 S -","- C56 H68 N28 O28 S4 -","4","1","CV6529","Hörger, Rolf; Marsch, Michael; Geyer, Armin; Harms, Klaus","(3<i>R</i>,6<i>S</i>,7<i>R</i>,8<i>R</i>,9<i>S</i>,9a<i>S</i>)-Methyl 6,9-diacetoxy-7,8-diazidoperhydro-5-oxothiazolo[3,2-<i>a</i>]azepine-3-carboxylate","Acta Crystallographica Section E","2005","61","7","o2191","o2192","10.1107/S160053680501843X","","","0.71073","MoKα","","","0.0229","","","","0.0574","","","","","","1.029","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206173","5.925","0.0012","10.514","0.002","11.567","0.002","103.54","0.03","91.1","0.03","90.19","0.03","700.4","0.2","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","4-phenyl-1-(1-phenylethylidene)thiosemicarbazide","","- C15 H15 N3 S -","- C15 H15 N3 S -","- C30 H30 N6 S2 -","2","1","CV6531","Fangfang Jian; Ying Li; Hailian Xiao","4-Phenyl-1-(1-phenylethylidene)thiosemicarbazide","Acta Crystallographica Section E","2005","61","7","o2219","o2220","10.1107/S1600536805019070","","","0.71073","MoKα","","0.1717","0.0544","","","0.1323","0.1693","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206174","14.1805","0.0008","10.1822","0.0005","18.3636","0.001","90","","91.08","0.001","90","","2651","0.2","273","2","273","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","N-{3-(4-methylphenyl)-6-[(Z)-(4-methylphenyl)methylidene]-2-phenyl- 2-azabicyclo[2.2.2]oct-5-ylidene}aniline","","- C34 H32 N2 -","- C34 H32 N2 -","- C136 H128 N8 -","4","1","CV6534","K. Ravikumar; B. Sridhar; M. Mahesh; V. V. Narayana Reddy","<i>N</i>-{3-(4-Methylphenyl)-6-[(<i>Z</i>)-(4-methylphenyl)methylidene]-2-phenyl-2-azabicyclo[2.2.2]oct-5-ylidene}aniline","Acta Crystallographica Section E","2005","61","7","o2277","o2279","10.1107/S1600536805019471","","","0.71073","MoKα","","0.0558","0.0427","","","0.1158","0.1274","","","","","","1.032","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206175","9.407","0.004","10.776","0.004","18.174","0.007","84.279","0.005","86.952","0.005","84.89","0.005","1824","1.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(Acetonitrile-κN)[2-(3,5-dimethylpyrazol-1-yl)benzothiazole-κ^2^N,N'] (dinitrato-κ^2^O,O')cobalt(II)","","- C14 H14 Co N6 O6 S -","- C14 H14 Co N6 O6 S -","- C56 H56 Co4 N24 O24 S4 -","4","2","DN6222","Zhi-Gang Zhang; Yuan-Yuan Sun; Xiao-Ming Jiang","Acetonitrile[2-(3,5-dimethylpyrazol-1-yl)-1,3-benzothiazole]dinitratocobalt(II)","Acta Crystallographica Section E","2005","61","7","m1307","m1309","10.1107/S1600536805017794","","","0.71073","MoKα","","0.1012","0.0976","","","0.2061","0.2084","","","","","","1.198","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206176","6.6382","0.0006","11.4258","0.0006","18.2702","0.0016","90","","107.039","0.007","90","","1324.91","0.19","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-Nitro-1-(2-phenylethyl)-1H-benzimidazole","","- C15 H13 N3 O2 -","- C15 H13 N3 O2 -","- C60 H52 N12 O8 -","4","1","DN6224","Sema Öztürk Yıldırım; Mehmet Akkurt; Hasan Küçükbay; Ersin Orhan; Orhan Büyükgüngör","6-Nitro-1-(2-phenylethyl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2005","61","7","o2038","o2039","10.1107/S1600536805017502","","","0.71073","MoKα","","0.0669","0.0419","","","0.1036","0.1131","","","","","","0.926","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206177","26.334","0.008","4.5962","0.0013","9.57","0.003","90","","90","","90","","1158.3","0.6","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","1-(3-Nitrophenyl)-3-(1H-1,2,4-triazol-1-yl)propan-1-one","","- C11 H10 N4 O3 -","- C11 H10 N4 O3 -","- C44 H40 N16 O12 -","4","1","DN6226","Jun Wan; Chun-Li Li; Xue-Mei Li; Ying Li; Shu-Sheng Zhang; Hong Xu; Ping-Kai Ouyang","1-(3-Nitrophenyl)-3-(1<i>H</i>-1,2,4-triazol-1-yl)propan-1-one","Acta Crystallographica Section E","2005","61","7","o1997","o1998","10.1107/S1600536805017198","","","0.71073","MoKα","","0.044","0.0384","","","0.0885","0.092","","","","","","1.139","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206178","7.02","0.003","8.121","0.004","16.888","0.007","90","","100.74","0.04","90","","945.9","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Bipyridine bis[5-amino-1,3,4-thiadiazole-2(3H)-thione]","","- C14 H14 N8 S4 -","- C14 H14 N8 S4 -","- C28 H28 N16 S8 -","2","0.5","DN6230","Deng, Qian-Jun; Yao, Min-Xia; Zeng, Ming-Hua","4,4'-Bipyridine‒5-amino-1,3,4-thiadiazole-2(3<i>H</i>)-thione (1/2)","Acta Crystallographica Section E","2005","61","7","o2239","o2240","10.1107/S1600536805019136","","","0.71073","MoKα","","0.0723","0.0443","","","0.0962","0.109","","","","","","1.013","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206179","7.1407","0.0008","8.7188","0.001","16.8945","0.0019","90","","90","","90","","1051.8","0.2","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","triethylenediaminium dichloride dihydrate","1,4-diazaoniabicyclo[2.2.2]octane dichloride dihydrate","","- C6 H18 Cl2 N2 O2 -","- C6 H18 Cl2 N2 O2 -","- C24 H72 Cl8 N8 O8 -","4","1","DN6231","Thomas C. Lewis; Derek A. Tocher","A low-temperature determination of triethylenediaminium dichloride dihydrate","Acta Crystallographica Section E","2005","61","7","o2202","o2204","10.1107/S1600536805019124","","","0.71073","MoKα","","0.0208","0.0205","","","0.0523","0.0525","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206180","11.3798","0.0004","8.7584","0.0003","13.39","0.0006","90","","99.178","0.001","90","","1317.48","0.09","295","1","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl 2-amino-4-methyl-6-phenyl-6H-1,3-thiazine-5-carboxylate","","- C13 H14 N2 O2 S -","- C13 H14 N2 O2 S -","- C52 H56 N8 O8 S4 -","4","1","DN6232","Lin, Xu-Feng","Methyl 2-amino-4-methyl-6-phenyl-6<i>H</i>-1,3-thiazine-5-carboxylate","Acta Crystallographica Section E","2005","61","7","o2207","o2208","10.1107/S1600536805019045","","","0.7107","MoKα","","","0.039","","","","0.106","","","","","","1.005","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206181","4.9836","0.001","7.6562","0.0015","25.698","0.005","90","","90","","90","","980.5","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","guaiphenesin","3-(2-Methoxyphenoxy)propane-1,2-diol","","- C10 H14 O4 -","- C10 H14 O4 -","- C40 H56 O16 -","4","1","FL6165","Yongli Wang; Ming Li; Lijun Liu; Lina Zhou; Jingkang Wang","3-(2-Methoxyphenoxy)propane-1,2-diol","Acta Crystallographica Section E","2005","61","7","o1999","o2000","10.1107/S1600536805016909","","","0.71073","MoKα","","0.0616","0.0482","","","0.14","0.1482","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206182","5.4122","0.0016","8.447","0.002","12.083","0.004","89.454","0.005","85.718","0.005","77.096","0.004","536.9","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","4-Amino-5-fluoropyrimidin-2(1H)-one‒2-amino-5-fluoropyrimidin-4(3H)-one‒water (1/1/1)","","- C8 H10 F2 N6 O3 -","- C8 H10 F2 N6 O3 -","- C16 H20 F4 N12 O6 -","2","1","FL6169","Hulme, Ashley T.; Tocher, Derek A.","4-Amino-5-fluoropyrimidin-2(1H)-one‒2-amino-5-fluoropyrimidin-4(3H)-one‒water (1/1/1)","Acta Crystallographica Section E","2005","61","7","o2112","o2113","10.1107/S1600536805018179","","","0.71073","MoKα","","0.057","0.0444","","","0.1152","0.1232","","","","","","1.052","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206183","6.9395","0.0005","16.2519","0.0013","19.1287","0.0015","67.382","0.001","86.524","0.001","81.535","0.001","1969.7","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Heptaaqua[tetrachlorophthalato(2-)]praseodymium(III) tetrachlorophthalate(-) tetrachlorophthalic acid monohydrate","","- C24 H19 Cl12 O20 Pr -","- C24 H19 Cl12 O20 Pr -","- C48 H38 Cl24 O40 Pr2 -","2","1","HB6175","Na, Xu; Yan, Ouyang; Dai-Zheng, Liao; Zong-Hui, Jiang","Heptaaqua[tetrachlorophthalato(2‒)]praseodymium(III) tetrachlorophthalate(‒) tetrachlorophthalic acid monohydrate","Acta Crystallographica Section E","2005","61","7","m1272","m1274","10.1107/S1600536805017071","","","0.71073","MoKα","","0.0276","0.023","","","0.0558","0.0569","","","","","","1.067","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206184","12.34","0.003","12.836","0.003","14.121","0.003","81.7","0.03","86.2","0.03","71.78","0.03","2101.8","0.9","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","cis-Di-tert-butylamidotetra-μ-tert-butylimido-di-μ-oxo-tetratellurium diiodide acetonitrile solvate","","- C26 H59 I2 N7 O2 Te4 -","- C26 H59 I2 N7 O2 Te4 -","- C52 H118 I4 N14 O4 Te8 -","2","1","HB6185","Jari Konu; Tristram Chivers; Risto S. Laitinen; Gabriele Schatte","<i>cis</i>-Di-<i>tert</i>-butylamidotetra-μ-<i>tert</i>-butylimido-di-μ-oxo-tetratellurium diiodide acetonitrile solvate","Acta Crystallographica Section E","2005","61","7","o2251","o2253","10.1107/S1600536805018714","","","0.71073","MoKα","","0.0357","0.0255","","","0.0504","0.055","","","","","","1.1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206185","16.5483","0.0015","12.3987","0.0011","14.744","0.0013","90","","105.512","0.001","90","","2914.9","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(aqua)bis(diperchlorato)(3,7,15,19-tetraaza-25,26-dihydroxy-11,23- dimethyltricyclo[19,3,1,1^9,13^]hexacosa-1(25),2,7,9,11,13(26),14,19,21,23- decaene-1κ^2^N,N';2κ^2^N'',N''';1:2κ^2^O:O')dicadmium(II) bis(aqua)(3,7,15,19-tetraaza-25,26-dihydroxy-11,23- dimethyltricyclo[19,3,1,1^9,13^]hexacosa-1(25),2,7,9,11,13(26),14,19,21,23- decaene-1κ^2^N,N';2κ^2^N'',N''';1:2κ^2^O:O')dicadmium(II) diperchlorate","","- C48 H60 Cd4 Cl4 N8 O24 -","- C48 H60 Cd4 Cl4 N8 O24 -","- C96 H120 Cd8 Cl8 N16 O48 -","2","0.5","HB6198","Liu, Bo; Zhou, Hong; Pan, Zhi-Quan; Hu, Xue-Lei; Chen, Lei","Diaquadiperchlorato[μ-11,23-dimethyl-3,7,15,19-tetraazatricyclo[19.3.1.1^9,13^]hexacosa-1(25),2,7,9,11,13(26),14,19,21,23-decaene-25,26-diolato-1κ^2^<i>N</i>,<i>N</i>';2κ^2^<i>N</i>'',<i>N</i>''';1:2κ^2^<i>O</i>:<i>O</i>']dicadmium(II) diaqua[μ-11,23-dimethyl-3,7,15,19-tetraazatricyclo[19.3.1.1^9,13^]hexacosa-1(25),2,7,9,11,13(26),14,19,21,23-decaene-25,26-diolato-1κ^2^<i>N</i>,<i>N</i>';2κ^2^<i>N</i>'',<i>N</i>''';1:2κ^2^<i>O</i>:<i>O</i>']dicadmium(II) diperchlorate","Acta Crystallographica Section E","2005","61","7","m1295","m1297","10.1107/S1600536805017599","","","0.71073","MoKα","","0.0648","0.0501","","","0.1141","0.1185","","","","","","1.082","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206186","9.485","0.002","6.8022","0.0016","9.681","0.002","90","","118.263","0.003","90","","550.1","0.2","298","2","298","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C11 H9 N3 O -","- C11 H9 N3 O -","- C22 H18 N6 O2 -","2","0.5","HB6200","Li, Su-Yue; Song, Yin-Yin; You, Zhong-Lu; Wen, Yan-Wei; Qin, Jin-Gui","2-Dicyanomethylene-4,5,5-trimethyl-2,5-dihydrofuran-3-carbonitrile","Acta Crystallographica Section E","2005","61","7","o2093","o2095","10.1107/S1600536805017976","","","0.71073","MoKα","","0.0826","0.0648","","","0.1966","0.2129","","","","","","0.973","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206187","11.2645","0.0019","11.4907","0.0019","13.665","0.002","95.865","0.003","104.109","0.003","100.969","0.003","1663.4","0.5","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","catena-Poly[[[tetrakis(dimethylformamide-κO)magnesium(II)]-μ- diphenylphosphato-κ^2^O:O'] trifluoromethanesulfonate]","","- C25 H38 F3 Mg N4 O11 P S -","- C25 H38 F3 Mg N4 O11 P S -","- C50 H76 F6 Mg2 N8 O22 P2 S2 -","2","1","HB6205","Adams, Harry; Rolfe, Alan; Jones, Simon","<i>catena</i>-Poly[[[tetrakis(dimethylformamide-κ<i>O</i>)magnesium(II)]-μ-diphenylphosphato-κ^2^<i>O</i>:<i>O</i>'] trifluoromethanesulfonate]","Acta Crystallographica Section E","2005","61","7","m1251","m1252","10.1107/S1600536805016880","","","0.71073","MoKα","","0.0699","0.0452","","","0.1055","0.1186","","","","","","1.008","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206188","7.97","0.0002","14.374","0.0003","9.575","0.0002","90","","100.335","0.0015","90","","1079.12","0.04","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Difluoro(η^5^,η^5^-propane-2,2-diyldicyclopentadienyl)titanium(IV)","","- C13 H14 F2 Ti -","- C13 H14 F2 Ti -","- C52 H56 F8 Ti4 -","4","1","HB6211","Picka, Michal; Císařová, Ivana; Vinklárek, Jaromír; Erben, Milan","Difluoro(η^5^,η^5^-propane-2,2-diyldicyclopentadienyl)titanium(IV)","Acta Crystallographica Section E","2005","61","7","m1266","m1268","10.1107/S1600536805017095","","","0.71073","MoKα","","0.0375","0.0304","","","0.0815","0.0872","","","","","","0.993","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206189","11.892","0.0002","5.1318","0.0001","12.3063","0.0002","90","","98.125","0.001","90","","743.48","0.02","295","2","293","2","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C4 H17 N2 O12 P3 Zn2 -","- C4 H17 N2 O12 P3 Zn2 -","- C8 H34 N4 O24 P6 Zn4 -","2","1","HB6212","Zabukovec Logar, Nataša; Rajić, Nevenka; Stojaković, Djordje; Šajić, Sanja; Golobič, Amalija; Kaučič, Venčeslav","(C~4~H~12~N~2~)[Zn~2~(PO~4~)(HPO~4~)(H~2~PO~4~)], a layered zinc phosphate with intercalated <i>N</i>-methylpropane-1,3-diaminium cations","Acta Crystallographica Section E","2005","61","7","m1354","m1356","10.1107/S1600536805018908","","","0.71073","MoKα","","0.029","0.0281","","","0.0859","0.0865","","","","","","1.187","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206190","8.193","0.003","5.518","0.002","9.233","0.004","90","","107.33","0.03","90","","398.5","0.3","296","","296","","","","","","","","","7","P 1 2/m 1","-P 2y","10","","catena-poly[[[bis(ethylenediamine)platinum(II)]-μ-chloro- [bis(ethylenediamine)platinum(IV)]-μ-chloro] tetrakis(hexafluorophosphate)]","","- C4 H16 Cl F12 N4 P2 Pt -","- C4 H16 Cl F12 N4 P2 Pt -","- C4 H16 Cl F12 N4 P2 Pt -","1","0.25","HB6213","Matsushita, Nobuyuki","Redetermination of <i>catena</i>-poly[[[bis(ethylenediamine)platinum(II)]-μ-chloro-[bis(ethylenediamine)platinum(IV)]-μ-chloro] tetrakis(hexafluorophosphate)]","Acta Crystallographica Section E","2005","61","7","m1301","m1303","10.1107/S1600536805017873","","","0.7107","MoKα","","0.0297","0.0297","","","0.0872","0.0872","","","","","","1.194","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206191","18.8369","0.0005","13.4729","0.0003","8.9472","0.0002","90","","101.639","0.008","90","","2224","0.11","295","3","295","2","","","","","","","","5","C 1 c 1","C -2yc","9","","Hexaaquanickel(II) bis(thiodiacetato-κ^3^O,S,O')nickel(II) tetrahydrate","","- C8 H28 Ni2 O18 S2 -","- C8 H28 Ni2 O18 S2 -","- C32 H112 Ni8 O72 S8 -","4","1","HB6214","Tian-Tian Pan; Jian-Rong Su; Duan-Jun Xu","Hexaaquanickelate(II) bis(thiodiacetato-κ^3^<i>O,S,O</i>')nickel(II) tetrahydrate","Acta Crystallographica Section E","2005","61","7","m1376","m1378","10.1107/S1600536805018982","","","0.71073","MoKα","","0.022","0.021","","","0.061","0.061","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206192","16.5125","0.0005","17.8156","0.0006","25.5801","0.0008","90","","99.913","0.002","90","","7412.8","0.4","173","2","173","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C34 H39.5 Cl Fe N3.5 Ni O4 P2 S3 -","- C34 H38 Cl Fe N3.5 Ni O4 P2 S3 -","- C272 H304 Cl8 Fe8 N28 Ni8 O32 P16 S24 -","8","2","HB6219","Duff, S. E.; Hitchcock, P. B.; Davies, S. C.; Barclay, J. E.; Evans, D. J.","1,3-Bis(diphenylphosphino)propane-2κ^2^<i>P</i>,<i>P</i>'-{μ-2-[bis(2-mercaptoethyl)amino]ethanesulfinato(3‒)-1κ^4^<i>N</i>,<i>S</i>,<i>S</i>',<i>S</i>'':2κ^2^<i>S</i>,<i>S</i>'}chloro-2κ<i>Cl</i>-dinitroso-1κ^2^<i>N</i>-iron(II)nickel(II) acetonitrile hemisolvate","Acta Crystallographica Section E","2005","61","7","m1313","m1315","10.1107/S1600536805018027","","","0.71073","MoKα","","0.2251","0.1079","","","0.2066","0.2559","","","","","","0.994","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206193","19.69","0.004","8.862","0.002","26.828","0.005","90","","100.721","0.002","90","","4599.6","1.6","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(μ~2~-Bicarbonato-κ^2^O,O')[μ~2~-1,4,8,11,14,18,23,27-octaaza-6,16,25(1,3)- tribenzenabicyclo[9.9.9]nonacosaphane]dicopper(II) triperchlorate acetonitrile solvate","","- C39 H58 Cl3 Cu2 N9 O15 -","- C39 H58 Cl3 Cu2 N9 O15 -","- C156 H232 Cl12 Cu8 N36 O60 -","4","1","HB6220","Derossi, Sofia; Bond, Andrew D.; McKenzie, Christine J.; Nelson, Jane","(μ~2~-Bicarbonato-κ^2^<i>O</i>,<i>O</i>')[μ~2~-1,4,8,11,14,18,23,27-octaaza-6,16,25(1,3)-tribenzenabicyclo[9.9.9]nonacosaphane]dicopper(II) triperchlorate acetonitrile solvate","Acta Crystallographica Section E","2005","61","7","m1379","m1382","10.1107/S1600536805018581","","","0.71073","MoKα","","0.0956","0.0515","","","0.1197","0.1373","","","","","","0.985","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206194","9.667","0.002","12.096","0.002","14.185","0.003","66.41","0.03","85.1","0.03","74.07","0.03","1461.1","0.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Bis[4,4'-dimethyl-2,2'-bipyridinium(+)] tetraoxorhenium triiodide","","- C24 H26 I3 N4 O4 Re -","- C24 H26 I3 N4 O4 Re -","- C48 H52 I6 N8 O8 Re2 -","2","1","HB6221","Andrzej Kochel","Bis[4,4'-dimethyl-2,2'-bipyridinium(+)] tetraoxorhenate(VII) triiodide","Acta Crystallographica Section E","2005","61","7","m1368","m1369","10.1107/S1600536805018726","","","0.71073","MoKα","","0.0335","0.0261","","","0.0572","0.059","","","","","","1.007","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206195","7.6177","0.0006","12.2882","0.0009","14.9197","0.0011","95.008","0.001","101.415","0.001","92.755","0.001","1360.69","0.18","292","2","292","2","","","","","","","","4","P -1","-P 1","2","","2,6-Dibenzyl-4,8-dioxo-tetrahydro-2,3a,4a,6,7a,8a-hexaaza-cyclopenta[def] fluorene-8b,8c-dicarboxylic acid diethyl ester","","- C28 H32 N6 O6 -","- C28 H32 N6 O6 -","- C56 H64 N12 O12 -","2","1","HB6223","Li, Yi-Tao; Wang, Zhiguo; Yin, Guodong; Wu, An-Xin","Diethyl 2,6-dibenzyl-4,8-dioxotetrahydro-2,3a,4a,6,7a,8a-hexaazacyclopenta[<i>def</i>]fluorene-8b,8c-dicarboxylate","Acta Crystallographica Section E","2005","61","7","o2187","o2188","10.1107/S1600536805018775","","","0.71073","MoKα","","0.0861","0.0724","","","0.1903","0.2041","","","","","","1.037","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2206196","9.6464","0.0008","7.6262","0.0008","19.7151","0.0008","90","","96.485","0.006","90","","1441.1","0.2","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dichlorobis[1-methylimidazoline-2(3H)-thione]cadmium(II)","","- C8 H12 Cd Cl2 N4 S2 -","- C8 H12 Cd Cl2 N4 S2 -","- C32 H48 Cd4 Cl8 N16 S8 -","4","1","HB6226","Beheshti, Azizolla; Brooks, Neil R.; Clegg, William; Hyvadi, Reza","Dichlorobis[1-methylimidazoline-2(3<i>H</i>)-thione]cadmium(II)","Acta Crystallographica Section E","2005","61","7","m1383","m1385","10.1107/S1600536805019203","","","0.71073","MoKα","","0.0344","0.0225","","","0.0429","0.0461","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206197","9.4211","0.0019","10.741","0.002","19.185","0.004","78.17","0.03","79","0.03","76","0.03","1823.2","0.7","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","μ~2~-Aqua-bis(μ~2~-trifluoroaceto-κ^2^O,O')bis[(trifluoroacetato- κO)bis(pyridine-κN)cobalt(II)]","","- C28 H22 Co2 F12 N4 O9 -","- C28 H22 Co2 F12 N4 O9 -","- C56 H44 Co4 F24 N8 O18 -","2","1","HB6227","Burley, Jonathan C.; Prior, Timothy J.","μ~2~-Aqua-bis(μ~2~-trifluoroaceto-κ^2^<i>O</i>,<i>O</i>')bis[bis(pyridine-κ<i>N</i>)(trifluoroacetato-κ<i>O</i>)cobalt(II)]","Acta Crystallographica Section E","2005","61","7","m1422","m1424","10.1107/S1600536805019586","","","0.71073","MoKα","","0.1014","0.0792","","","0.2126","0.24","","","","","","1.051","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206198","10.3757","0.0005","10.8125","0.0005","16.9455","0.0008","90","","92.095","0.003","90","","1899.8","0.16","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5-nitro-2-furaldehyde N-(hydroxymethyl)semicarbazone","","- C7 H8 N4 O5 -","- C7 H8 N4 O5 -","- C56 H64 N32 O40 -","8","1","HG6183","Doriguetto, Antonio C.; de Paula Silva, Carlos H. T.; Ellena, Javier; Trossini, Gustavo H. G.; Chin, Chung Man; Ferreira, Elizabeth I.","5-Nitro-2-furaldehyde <i>N</i>-(hydroxymethyl)semicarbazone","Acta Crystallographica Section E","2005","61","7","o2099","o2101","10.1107/S1600536805017721","","","0.71073","MoKα","","","0.0386","","","","0.1113","","","","","","1.066","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206199","19.6572","0.0016","8.0741","0.0007","17.6413","0.0015","90","","90","","90","","2799.9","0.4","298","2","298","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","1,4-Dimethyl-1,4-diazoniabicyclo[2.2.2]octane tetrachlorocuprate(II)","","- C8 H18 Cl4 Cu N2 -","- C8 H18 Cl4 Cu N2 -","- C64 H144 Cl32 Cu8 N16 -","8","2","HG6186","Sun, Xian-Ming; Qu, Yang","1,4-Dimethyl-1,4-diazoniabicyclo[2.2.2]octane tetrachlorocuprate(II)","Acta Crystallographica Section E","2005","61","7","m1360","m1362","10.1107/S160053680501860X","","","0.71073","MoKα","","0.0342","0.0305","","","0.0733","0.0754","","","","","","1.028","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206200","20.4833","0.0018","21.6089","0.0018","16.0523","0.0014","90","","126.549","0.002","90","","5707.9","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","12-chloro-2,10-dibenzyloxy-3,9-dimethoxytetrahydroprotoberberine","2,10-dibenzyloxy-12-chloro-3,9-dimethoxy-5,8,13,13a- tetrahydro-6H-dibenzo[a,g]quinolizine","","- C33 H32 Cl N O4 -","- C33 H32 Cl N O4 -","- C264 H256 Cl8 N8 O32 -","8","1","HG6192","Ding, Yu; Yao, Guang-Min; Chen, Yi-Lang; Yang, Yu-She","Racemic 2,10-dibenzyloxy-12-chloro-3,9-dimethoxy-5,8,13,13a-tetrahydro-6<i>H</i>-dibenzo[<i>a,g</i>]quinolizine","Acta Crystallographica Section E","2005","61","7","o2020","o2021","10.1107/S1600536805017307","","","0.71073","MoKα","","0.1003","0.0626","","","0.1579","0.1769","","","","","","0.956","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206201","8.414","0.0017","9.513","0.0019","10.497","0.002","102.57","0.03","96.58","0.03","97.08","0.03","805.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-Cyclopropyl-6-fluoro-7-(4-formylpiperazin-1-yl)- 4-oxo-1,4-dihydroquinoline-3-carboxylic acid","","- C18 H17 F N3 O4 -","- C18 H17 F N3 O4 -","- C36 H34 F2 N6 O8 -","2","1","HG6194","Xian-Wen Li; Feng Zhi; Jian-Hua Shen; Yi-Qiao Hu","1-Cyclopropyl-6-fluoro-7-(4-formylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid","Acta Crystallographica Section E","2005","61","7","o2235","o2236","10.1107/S1600536805018623","","","0.71073","MoKα","","0.1129","0.054","","","0.1303","0.1561","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206202","12.296","0.001","10.587","0.002","17.164","0.002","90","","99.77","0.03","90","","2202","0.6","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","4-{[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-[(2,6- dimethylphenyl)aminocarbonylmethyl]piperazine","","- C23 H26 Cl N5 O2 -","- C23 H26 Cl N5 O2 -","- C92 H104 Cl4 N20 O8 -","4","1","HG6196","Wang, Hai-Bo; Pu, Yue-Qing; Chen, Jia-Hui; Wang, Jin-Tang","4-{[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-[(2,6-dimethylphenyl)aminocarbonylmethyl]piperazine","Acta Crystallographica Section E","2005","61","7","o1994","o1996","10.1107/S1600536805017228","","","0.71073","MoKα","","0.1047","0.0577","","","0.1674","0.2011","","","","","","1.01","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206203","13.9136","0.0007","13.9136","0.0007","4.7065","0.0004","90","","90","","90","","911.12","0.1","105","2","105","2","","","","","","","","4","P 42","P 4c","77","","L-threonyl-L-alanine","","- C7 H14 N2 O4 -","- C7 H14 N2 O4 -","- C28 H56 N8 O16 -","4","1","HG6197","Görbitz, Carl Henrik","<small>L</small>-Threonyl-<small>L</small>-alanine","Acta Crystallographica Section E","2005","61","7","o2012","o2014","10.1107/S1600536805017174","","","0.71073","MoKα","","0.0357","0.0293","","","0.0705","0.074","","","","","","1.091","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206204","11.0071","0.0017","7.915","0.0012","16.645","0.003","90","","104.823","0.003","90","","1401.9","0.4","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-(2-Fluorobenzylideneamino)-3-(1,2,4-triazol-4-ylmethyl)-1H-1,2,4-triazole- 5(4H)-thione","","- C12 H10 F N7 S -","- C12 H10 F N7 S -","- C48 H40 F4 N28 S4 -","4","1","HG6198","Wei-Hua Li; Guan-Ping Yu; Fa-Qian Liu; Bao-Rong Hou; Zhi-Gang Yu","4-(2-Fluorobenzylideneamino)-3-(1,2,4-triazol-4-ylmethyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2005","61","7","o2058","o2060","10.1107/S1600536805017435","","","0.71073","MoKα","","0.0625","0.036","","","0.0841","0.0986","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206205","11.232","0.002","12.274","0.003","16.013","0.003","74.95","0.03","89.49","0.03","68.79","0.03","1978.6","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","trans-Carbonylchlorobis[tris(pentafluorophenyl)phosphine)]rhodium(I)","","- C37 Cl F30 O P2 Rh -","- C37 Cl F30 O P2 Rh -","- C74 Cl2 F60 O2 P4 Rh2 -","2","1","HG6199","Meijboom, Reinout; Muller, Alfred; Roodt, Andreas","<i>trans</i>-Carbonylchlorobis[tris(pentafluorophenyl)phosphine)]rhodium(I)","Acta Crystallographica Section E","2005","61","7","m1283","m1285","10.1107/S1600536805017447","","","0.71073","MoKα","","","0.0495","","","","0.1058","","","","","","0.976","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206206","18.441","0.004","7.8992","0.001","13.014","0.003","90","","95.516","0.016","90","","1887","0.6","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Z)-4-[(E)-(4-ethylphenyl)diazenyl]-6-{[1,3-dihydroxy-2-(hydroxymethyl)propan- 2-ylamino]methylene}cyclohexa-2,4-dienone","","- C19 H23 N3 O4 -","- C19 H23 N3 O4 -","- C76 H92 N12 O16 -","4","1","HG6200","Şahin, Onur; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","(<i>Z</i>)-6-{[1,3-Dihydroxy-2-(hydroxymethyl)propan-2-ylamino]methylene}-4-[(<i>E</i>)-(4-ethylphenyl)diazenyl]cyclohexa-2,4-dienone","Acta Crystallographica Section E","2005","61","7","o2076","o2078","10.1107/S1600536805017733","","","0.71073","MoKα","","0.2105","0.1073","","","0.2683","0.3125","","","","","","0.927","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206207","5.633","0.0011","25.961","0.005","7.977","0.0016","90","","102.26","0.03","90","","1139.9","0.4","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-(Hydroxyethylamino)-1-phenylbut-2-en-1-one","","- C12 H15 N O2 -","- C12 H15 N O2 -","- C48 H60 N4 O8 -","4","1","HG6201","Yao-Cheng Shi","<i>R</i>~2~^2^(14) dimers in 3-(hydroxyethyl)amino-1-phenylbut-2-en-1-one","Acta Crystallographica Section E","2005","61","7","o2005","o2007","10.1107/S1600536805017290","","","0.71073","MoKα","","0.1571","0.0714","","","0.1728","0.2199","","","","","","0.974","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206208","9.1916","0.001","9.9676","0.0011","10.0055","0.0011","86.049","0.002","72.405","0.002","79.7","0.002","859.61","0.16","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","2-benzylamino-4-phenyl-5,5-dimethyl-1,3,2-dioxaphosphorinane-2-oxide","","- C18 H22 N O3 P -","- C18 H22 N O3 P -","- C36 H44 N2 O6 P2 -","2","1","HG6202","Wan, Shi-Guan; Liu, Chang; Yu, Yan; Yang, Xing-Yu","2-Benzylamino-5,5-dimethyl-4-phenyl-1,3,2-dioxaphosphorinane 2-oxide","Acta Crystallographica Section E","2005","61","7","o2117","o2119","10.1107/S1600536805018003","","","0.71073","MoKα","","0.0475","0.0445","","","0.1178","0.1212","","","","","","1.073","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206209","5.4935","0.0005","22.3315","0.001","7.997","0.0004","90","","99.401","0.006","90","","967.88","0.11","291","","291","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Quinolinum perchlorate","","- C9 H8 Cl N O4 -","- C9 H8 Cl N O4 -","- C36 H32 Cl4 N4 O16 -","4","1","HG6203","Sieroń, Lesław","Quinolinium perchlorate","Acta Crystallographica Section E","2005","61","7","o2091","o2092","10.1107/S1600536805017927","","","0.71073","MoKα","","0.0428","0.0378","","","0.1036","0.1075","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206210","8.7906","0.0012","9.6774","0.0011","10.7788","0.0012","82.41","0.009","78.47","0.01","63.796","0.009","805.11","0.18","150","2","150","2","","","","","","","","3","P -1","-P 1","2","1,3-Bis(3,5-dimethylphenoxy)propane","1,3-Bis(3,5-dimethylphenoxy)propane","","- C19 H24 O2 -","- C19 H24 O2 -","- C38 H48 O4 -","2","1","HG6204","Tooke, Duncan M.; Lutz, M.; Spek, Anthony L.","1,3-Bis(3,5-dimethylphenoxy)propane","Acta Crystallographica Section E","2005","61","7","o2152","o2154","10.1107/S1600536805018532","","","0.71073","MoKα","","0.0741","0.0498","","","0.1207","0.1349","","","","","","1.034","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206211","11.155","0.002","7.0897","0.0016","17.488","0.004","90","","99.313","0.003","90","","1364.8","0.5","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","Bis(kokusaginine)trihydrate","4,6,7-Trimethoxyfuro[2,3-b]quinoline‒water (2/3)","","- C28 H32 N2 O11 -","- C28 H32 N2 O11 -","- C56 H64 N4 O22 -","2","1","HK6009","Latip, Jalifah; Ali, Noor Hapeedah. M.; Yamin, Bohari M.","4,6,7-Trimethoxyfuro[2,3-<i>b</i>]quinoline‒water (2/3)","Acta Crystallographica Section E","2005","61","7","o2230","o2232","10.1107/S1600536805019082","","","0.71073","MoKα","","0.047","0.041","","","0.099","0.102","","","","","","1.16","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206212","7.4651","0.0015","13.0034","0.0016","15.9759","0.0018","90","","90","","90","","1550.8","0.4","296","2","296","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","2,5-dibenzoyl-1,4-phenylenediamine","2,5-dibenzoyl-1,4-phenylenediamine","","- C20 H16 N2 O2 -","- C20 H16 N2 O2 -","- C80 H64 N8 O8 -","4","0.5","HK6017","Zhu, Hong-Jun; Wang, Dan-Dan; Song, Guang-Liang; Wang, Jin-Tang; Wang, Ke-Le","2,5-Dibenzoyl-1,4-phenylenediamine","Acta Crystallographica Section E","2005","61","7","o2209","o2210","10.1107/S1600536805019112","","","0.71073","MoKα","","0.147","0.0543","","","0.1202","0.1509","","","","","","1.016","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206213","7.1993","0.0005","9.2058","0.0007","19.9448","0.0016","101.133","0.002","100.209","0.002","91.704","0.002","1273.64","0.17","223","2","223","2","","","","","","","","3","P -1","-P 1","2","","(Z)-2,3-Dichloro-1,1,4,4-tetrakis-(4-chlorophenyl)but-2-ene","","- C28 H18 Cl6 -","- C28 H18 Cl6 -","- C56 H36 Cl12 -","2","1","HK6018","Shimakoshi, Hisashi; Aritome, Isao; Tokunaga, Mami; Hisaeda, Yoshio","(<i>Z</i>)-2,3-Dichloro-1,1,4,4-tetrakis(4-chlorophenyl)but-2-ene","Acta Crystallographica Section E","2005","61","7","o2063","o2064","10.1107/S160053680501768X","","","0.71073","MoKα","","0.0679","0.0498","","","0.1166","0.1282","","","","","","1.025","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206214","7.985","0.0005","10.9104","0.0006","11.1556","0.0007","90","","108.414","0.002","90","","922.11","0.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Amino-5-methylpyridinium phosphate","","- C6 H11 N2 O4 P -","- C6 H11 N2 O4 P -","- C24 H44 N8 O16 P4 -","4","1","IS6071","Hai Feng; Cui-Rong Sun; Li Li; Zhi-Min Jin; Bin Tu","2-Amino-5-methylpyridinium phosphate","Acta Crystallographica Section E","2005","61","7","o1983","o1984","10.1107/S1600536805014716","","","0.71073","MoKα","","0.0468","0.0352","","","0.0891","0.093","","","","","","0.973","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206215","20.692","0.011","12.456","0.006","11.792","0.006","90","","114.51","0.008","90","","2765","2","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-(4-tert-Butylphenoxy)-2-chloropyrimidine","","- C14 H15 Cl N2 O -","- C14 H15 Cl N2 O -","- C112 H120 Cl8 N16 O8 -","8","1","IS6079","Wei-Min Liu; You-Quan Zhu; Yi-Feng Wang; Gong-Chun Li; Hua-Zheng Yang","4-(4-<i>tert</i>-Butylphenoxy)-2-chloropyrimidine","Acta Crystallographica Section E","2005","61","7","o2040","o2041","10.1107/S1600536805017460","","","0.71073","MoKα","","0.136","0.0552","","","0.1089","0.1337","","","","","","1.001","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206216","6.2021","0.0018","7.6","0.002","10.849","0.003","100.589","0.004","92.777","0.005","113.518","0.004","456.7","0.2","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","1,4-Bis[chloro(hydroximino)methyl]benzene N,N'-dimethylformamide disolvate","","- C14 H20 Cl2 N4 O4 -","- C14 H20 Cl2 N4 O4 -","- C14 H20 Cl2 N4 O4 -","1","0.5","IS6081","Liu, Xin-Gang; Feng, Ya-Qing; Liu, Dong-Qing; Zhao, Yao","1,4-Bis[chloro(hydroxyimino)methyl]benzene <i>N</i>,<i>N</i>'-dimethylformamide disolvate","Acta Crystallographica Section E","2005","61","7","o1970","o1972","10.1107/S1600536805018738","","","0.71073","MoKα","","0.062","0.0395","","","","0.1037","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206217","8.849","0.001","10.581","0.001","11.3773","0.0008","113.447","0.001","98.852","0.001","106.364","0.002","893.89","0.15","295","1","","","","","","","","","","5","P -1","-P 1","2","","2-(4,6-Dimethoxypyrimidin-2-yloxy)-6-fluoro-N-(3-methylpyridyl)benzylamine","","- C19 H19 F N4 O3 -","- C19 H19 F N4 O3 -","- C38 H38 F2 N8 O6 -","2","1","IS6083","De-Long Shen; Qi-Sun Gong; Cheng-Xia Tan; Jian-Quan Weng","2-(4,6-Dimethoxypyrimidin-2-yloxy)-6-fluoro-<i>N</i>-(3-methylpyridyl)benzylamine","Acta Crystallographica Section E","2005","61","7","o2270","o2271","10.1107/S1600536805019446","","","0.71073","MoKα","","0.0668","0.0496","","","0.1565","0.1726","","","","","","1.063","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206218","17.534","0.001","15.616","0.001","21.394","0.002","90","","90","","90","","5857.9","0.7","153.2","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C30 H30 F6 Fe O2 P2 -","- C30 H30 F6 Fe O2 P2 -","- C240 H240 F48 Fe8 O16 P16 -","8","1","IS6084","Hiroshi Nakazawa; Masumi Itazaki; Mari Owaribe","Dicarbonyl(η^5^-pentamethylcyclopentadienyl)(triphenylphosphine)iron(II) hexafluorophosphate","Acta Crystallographica Section E","2005","61","7","m1275","m1276","10.1107/S1600536805017344","","","0.7107","MoKα","","","0.0632","","","","0.1762","","","","","","1.113","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206219","9.2694","0.001","9.3192","0.001","23.448","0.003","90","","95.234","0.002","90","","2017.1","0.4","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(5-Benzyloxy-2,4-dichlorophenyl)hexahydroisoindole-1,3-dione","","- C21 H21 Cl2 N O4 -","- C21 H21 Cl2 N O4 -","- C84 H84 Cl8 N4 O16 -","4","1","IS6087","Neng-Xue Wang; Yan-Ping Luo; Qiong Chen; Guang-Fu Yang","2-(5-Benzyloxy-2,4-dichlorophenyl)perhydroisoindole-1,3-dione monohydrate","Acta Crystallographica Section E","2005","61","7","o2081","o2082","10.1107/S1600536805017770","","","0.71073","MoKα","","0.0699","0.0533","","","0.1251","0.1351","","","","","","1.065","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206220","14.0356","0.0012","15.0658","0.0013","7.1354","0.0006","90","","90","","90","","1508.8","0.2","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-methoxy-12-methyl-12-azatetracyclo[9.3^1.10^.0^2.7^] heptadeca-2(7),3,5-triene","","- C18 H25 N O -","- C18 H25 N O -","- C72 H100 N4 O4 -","4","1","IS6088","Swamy, G. Y. S. K.; Ravikumar, K.; Bhujanga Rao, A. K. S.","Dextromethorphan, an antitussive agent","Acta Crystallographica Section E","2005","61","7","o2071","o2073","10.1107/S1600536805017782","","","0.71073","MoKα","","0.0403","0.0383","","","0.1007","0.1022","","","","","","1.082","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206221","7.6684","0.0007","10.2831","0.0009","11.6172","0.001","102.895","0.002","102.286","0.002","102.822","0.002","836.89","0.13","150","2","","","","","","","","","","3","P -1","-P 1","2","","","","- C22 H16 N4 -","- C22 H16 N4 -","- C44 H32 N8 -","2","1","IS6089","Yong-Ru Liu; Xiang-Ping Li; Jing-An Zhang; Cheng-Yong Su","<i>N</i>,<i>N</i>'-Bis(4-pyridylmethylene)naphthalene-1,5-diamine","Acta Crystallographica Section E","2005","61","7","o2089","o2090","10.1107/S1600536805017940","","","0.71073","MoKα","","","0.0438","","","","0.108","","","","","","1.013","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206222","7.0192","0.0004","22.1771","0.001","10.5972","0.0007","90","","119.541","0.004","90","","1435.17","0.15","293","2","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(N-Ethylthiocarbamoyl)-3,5-di-2-furyl-2-pyrazoline","","- C14 H15 N3 O2 S -","- C14 H15 N3 O2 S -","- C56 H60 N12 O8 S4 -","4","1","IS6090","Özdemir Gonca; Şamil Işik; Özdemir Zuhal; Bilgin Altan","1-(<i>N</i>-Ethylthiocarbamoyl)-3,5-di-2-furyl-2-pyrazoline","Acta Crystallographica Section E","2005","61","7","o2205","o2206","10.1107/S160053680501915X","","","0.71073","MoKα","","0.0571","0.0494","","","0.1869","0.1393","","","","","","1.058","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206223","15.5846","0.0017","10.1592","0.0011","11.1622","0.0012","90","","121.118","0.002","90","","1513","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N-(Pyridin-2-yl)hydrazinecarbothioamide","","- C6 H8 N4 S -","- C6 H8 N4 S -","- C48 H64 N32 S8 -","8","1","JH6009","P. F. Rapheal; E. Manoj; M. R. Prathapachandra Kurup; E. Suresh","<i>N</i>-(Pyridin-2-yl)hydrazinecarbothioamide","Acta Crystallographica Section E","2005","61","7","o2243","o2245","10.1107/S1600536805019057","","","0.71073","MoKα","","0.0372","0.0349","","","0.1049","0.107","","","","","","1.119","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206224","9.766","0.0009","6.6155","0.0006","10.5192","0.001","90","","90","","90","","679.61","0.11","292","2","292","2","","","","","","","","4","P c c a","-P 2a 2ac","54","[Mn (C2 O4) (H2 O)2], H2 O","catena-Poly[[[diaquamanganese(II)]-μ-oxalato] monohydrate]","","- C2 H6 Mn O7 -","- C2 H6 Mn O7 -","- C8 H24 Mn4 O28 -","4","0.5","JH6010","Xucheng Fu; Chenggang Wang; Mingtian Li","<i>catena</i>-Poly[[[diaquamanganese(II)]-μ-oxalato] monohydrate]","Acta Crystallographica Section E","2005","61","7","m1348","m1349","10.1107/S1600536805018805","","","0.71073","MoKα","","0.0205","0.0198","","","0.0535","0.0539","","","","","","1.07","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206225","18.0582","0.0005","11.4381","0.0003","18.6791","0.0004","90","","108.796","0.001","90","","3652.45","0.16","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","poly[[tris(μ~4~-benzene-1,4-dicarboxylato)bis(μ~2~- N,N-diethylformamide)digadolinium(III)] monohydrate]","","- C34 H36 Gd2 N2 O15 -","- C34 H34 Gd2 N2 O15 -","- C136 H136 Gd8 N8 O60 -","4","0.5","LH6399","Poulsen, Rasmus D.; Overgaard, Jacob; Chevallier, Marie-Agnes; Clausen, Henrik F.; Iversen, Bo B.","A gadolinium-based metal‒organic framework, poly[[tris(μ~4~-benzene-1,4-dicarboxylato)bis(μ~2~-<i>N</i>,<i>N</i>-diethylformamide)digadolinium(III)] monohydrate]","Acta Crystallographica Section E","2005","61","7","m1337","m1339","10.1107/S1600536805018271","","","0.71073","MoKα","","0.0314","0.0221","","","0.0522","0.0537","","","","","","0.95","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206226","28.242","0.006","9.5962","0.0019","21.108","0.004","90","","127.74","0.03","90","","4524","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","6a-Methyl-7-phenylsulfonyl-6-phenylsulfonylmethyl-7,7a-dihydro-6aH- cyclopropa[d][1,2,3]triazolo[4,3-b]pyridazine:acetone solvate 2:1","","- C21.5 H21 N4 O4.5 S2 -","- C21.5 H21 N4 O4.5 S2 -","- C172 H168 N32 O36 S16 -","8","1","LH6417","Anna Katrusiak; Andrzej Katrusiak","6a-Methyl-7-phenylsulfonyl-6-phenylsulfonylmethyl-7,7a-dihydro-6a<i>H</i>-cyclopropa[<i>d</i>][1,2,3]triazolo[4,3-<i>b</i>]pyridazine acetone hemisolvate","Acta Crystallographica Section E","2005","61","7","o2142","o2144","10.1107/S1600536805018106","","","0.71073","MoKα","","0.2284","0.0584","","","0.0802","0.1207","","","","","","0.902","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206227","6.413","0.001","9.763","0.002","12.113","0.002","79.54","0.03","79.26","0.03","80.61","0.03","726.1","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","bis(2,4-pyridinedicarboxylato-N,O)-(μ~2~-4,4'-bipyridine)-hexaaqua -dicobalt(II) dihydrate","μ-4,4'-Bipyridine-κ^2^N:N'-bis[triaqua(pyridine-2,4-dicarboxylato- κ^2^N,O)cobalt(II)] dihydrate","","- C24 H30 Co2 N4 O16 -","- C24 H30 Co2 N4 O16 -","- C24 H30 Co2 N4 O16 -","1","0.5","LH6428","Zhang, Xian-Ming","μ-4,4'-Bipyridine-κ^2^<i>N</i>:<i>N</i>'-bis[triaqua(pyridine-2,4-dicarboxylato-κ^2^<i>N</i>,<i>O</i>)cobalt(II)] dihydrate","Acta Crystallographica Section E","2005","61","7","m1332","m1333","10.1107/S1600536805015473","","","0.71073","MoKα","","0.0749","0.0523","","","0.1288","0.1454","","","","","","1.117","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206228","7.838","0.002","9.609","0.001","17.739","0.003","86.68","0.01","86.1","0.02","75.32","0.01","1288.3","0.4","303","2","303","2","","","","","","","","6","P -1","-P 1","2","","trans-Diaquadichlorooxovanadium(IV) bis[2-(2-pyridylamino)pyridinium] dichloride","","- C20 H24 Cl4 N6 O3 V -","- C20 H24 Cl4 N6 O3 V -","- C40 H48 Cl8 N12 O6 V2 -","2","1","LH6432","Hartung, Jens; Schmidt, Philipp; Svoboda, Ingrid; Fuess, Hartmut","<i>trans</i>-Diaquadichlorooxovanadium(IV) bis[2-(2-pyridylamino)pyridinium] dichloride","Acta Crystallographica Section E","2005","61","7","m1253","m1255","10.1107/S1600536805016843","","","0.71093","MoKα","","0.0612","0.0339","","","0.087","0.0966","","","","","","1.007","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206229","14.861","0.001","7.364","0.001","27.948","0.002","90","","93.42","0.01","90","","3053.1","0.5","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","gemfibrozil","5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid","","- C15 H22 O3 -","- C15 H22 O3 -","- C120 H176 O24 -","8","2","LH6433","Bruni, Bruno; Coran, Silvia; Di Vaira, Massimo; Giannellini, Valerio","5-(2,5-Dimethylphenoxy)-2,2-dimethylpentanoic acid (gemfibrozil)","Acta Crystallographica Section E","2005","61","7","o1989","o1991","10.1107/S1600536805016855","","","1.5418","CuKα","","0.0837","0.0579","","","0.1747","0.1884","","","","","","0.864","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206230","11.651","0.002","13.942","0.002","8.981","0.002","90","","110.837","0.003","90","","1363.4","0.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3040","Poly[(μ~3~-n-hexane-1,6-dicarboxylato)dysprosium(III)]","","- C9 H16 Dy O8 -","- C9 H16 Dy O8 -","- C36 H64 Dy4 O32 -","4","1","LH6434","Lill, Daniel T. de; Brennessel, William W.; Borkowski, Lauren A.; Gunning, Noel S.; Cahill, Christopher L.","Poly[(μ~3~-<i>n</i>-hexane-1,6-dicarboxylato)dysprosium(III)]","Acta Crystallographica Section E","2005","61","7","m1343","m1345","10.1107/S1600536805018246","","","0.71073","MoKα","","0.035","0.0294","","","0.0771","0.0795","","","","","","1.021","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206231","7.3829","0.0011","6.7658","0.001","11.1074","0.0017","90","","93.826","0.002","90","","553.59","0.14","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(5S,6R)-4,5-Dimethyl-6-phenylmorpholine-2,3-dione","","- C12 H13 N O3 -","- C12 H13 N O3 -","- C24 H26 N2 O6 -","2","1","LH6437","Ji-Dan Yan; Ming Lu; Yu-Ping Guo; Chun-Bao Li; Xiang-Yang Tang","(5<i>S</i>,6<i>R</i>)-4,5-Dimethyl-6-phenylmorpholine-2,3-dione","Acta Crystallographica Section E","2005","61","7","o2167","o2168","10.1107/S160053680501682X","","","0.71073","MoKα","","0.0364","0.0312","","","0.0844","0.087","","","","","","1.099","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206232","9.19","0.005","16.756","0.009","12.69","0.007","90","","95.126","0.01","90","","1946.3","1.8","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Di-μ~2~-acetato-bis[μ~2~-N,N'-bis(salicylidene)butane-1,4- diaminato]trimanganese(II)","","- C40 H42 Mn3 N4 O8 -","- C40 H42 Mn3 N4 O8 -","- C80 H84 Mn6 N8 O16 -","2","0.5","LH6439","Ma, Ji-Long; You, Zhong-Lu; Zhu, Hai-Liang","Di-μ~2~-acetato-bis[μ~2~-<i>N</i>,<i>N</i>'-bis(salicylidene)butane-1,4-diaminato]trimanganese(II)","Acta Crystallographica Section E","2005","61","7","m1286","m1288","10.1107/S1600536805017423","","","0.71073","MoKα","","0.0799","0.0405","","","0.0793","0.0878","","","","","","0.835","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206233","9.7833","0.001","9.9027","0.001","10.2853","0.0011","101.957","0.002","104.951","0.002","101.511","0.002","907.46","0.16","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","(Z)-4-(4-Methoxybenzylidene)-2-methylsulfanyl-3-phenethyl-1H-imidazol-5(4H)-one","","- C20 H20 N2 O2 S -","- C20 H20 N2 O2 S -","- C40 H40 N4 O4 S2 -","2","1","LH6440","Ping Wang; Xiao-He Chu; Wei-Ke Su","(<i>Z</i>)-4-(4-Methoxybenzylidene)-2-methylsulfanyl-3-phenethyl-1<i>H</i>-imidazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2005","61","7","o2200","o2201","10.1107/S1600536805018878","","","0.71073","MoKα","","0.0986","0.0817","","","0.1641","0.1733","","","","","","1.287","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206234","15.5563","0.0008","4.6549","0.0002","15.0454","0.0007","90","","103.399","0.001","90","","1059.83","0.09","293","2","293","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","Propane-1,3-diaminium bis(dihydrogenarsenate)","","- C3 H16 As2 N2 O8 -","- C3 H16 As2 N2 O8 -","- C12 H64 As8 N8 O32 -","4","0.5","LH6441","Wilkinson, Hazel S.; Harrison, William T. A.","Propane-1,3-diaminium bis(dihydrogenarsenate)","Acta Crystallographica Section E","2005","61","7","m1289","m1291","10.1107/S1600536805017411","","","0.71073","MoKα","","0.0406","0.0365","","","0.092","0.0944","","","","","","1.016","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206235","9.569","0.007","10.723","0.006","15.416","0.006","90","","90","","90","","1581.8","1.6","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-N-(1-Benzyl-2-hydroxy-ethyl)phthalamic acid","","- C17 H17 N O4 -","- C17 H17 N O4 -","- C68 H68 N4 O16 -","4","1","LH6442","McCormac, Paul B.; Pratt, Albert C.; Long, Conor; Howie, R. Alan","(<i>S</i>)-<i>N</i>-(1-Benzyl-2-hydroxyethyl)phthalamic acid","Acta Crystallographica Section E","2005","61","7","o2047","o2049","10.1107/S160053680501740X","","","0.71073","MoKα","","0.2404","0.0752","","","0.1053","0.1296","","","","","","0.853","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206236","10.114","0.002","10.26","0.002","15.126","0.003","78.7","0.03","73.88","0.03","87.45","0.03","1478.6","0.6","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","2-(acetylamino)-N-benzyl-2-(ethylsulfinyl)acetamide","","- C13 H18 N2 O3 S -","- C13 H18 N2 O3 S -","- C52 H72 N8 O12 S4 -","4","2","LH6443","Hempel, Andrew; Camerman, Norman; Camerman, Arthur; Mastropaolo, Donald","2-(Acetylamino)-<i>N</i>-benzyl-2-(ethylsulfinyl)acetamide: structural basis for lack of anticonvulsant activity","Acta Crystallographica Section E","2005","61","7","o2120","o2122","10.1107/S1600536805018258","","","1.54178","CuKα","","0.1229","0.0771","","","0.1738","0.1876","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206237","9.381","0.004","11.552","0.003","14.12","0.004","80.18","0.02","83.89","0.03","74.93","0.03","1452.8","0.9","298","","298","","","","","","","","","5","P -1","-P 1","2","","(μ~2~-chloro)(μ~2~-η^2^-2-tert-butyl-ethyn-1-yl)- bis[bis(η~5~-cyclopentadienyl)dimethylsilane]dititanium(II)","","- C30 H37 Cl Si2 Ti2 -","- C30 H37 Cl Si2 Ti2 -","- C60 H74 Cl2 Si4 Ti4 -","2","1","LH6444","Kooijman, Huub; Hogenbirk, Marijke; Schat, Gerrit; Akkerman, Otto S.; Bickelhaupt, Friedrich; Spek, Anthony L.","(μ~2~-η^2^-2-<i>tert</i>-Butylethyn-1-yl)(μ~2~-chloro)bis{[bis(η^5^-cyclopentadienyl)dimethylsilane]titanium}","Acta Crystallographica Section E","2005","61","7","m1329","m1331","10.1107/S1600536805017903","","","0.71073","MoKα","","0.1344","0.0703","","","0.1562","0.183","","","","","","1.172","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206238","11.46","0.02","13.094","0.005","13.563","0.009","90","","114.22","0.05","90","","1856","4","295","2","295","2","","","","","","","","3","I 1 2/m 1","-I 2y","12","","Benzylammonium 2,4-bis(dicyanomethylene)-2,3-dihydroisoindolide","","- C21 H14 N6 -","- C21 H14 N6 -","- C84 H56 N24 -","4","0.5","LH6446","Conway, Shane P.; Pratt, Albert C.; Long, Conor; Howie, R. Alan","Benzylammonium 2,4-bis(dicyanomethylene)-2,3-dihydroisoindolide","Acta Crystallographica Section E","2005","61","7","o2258","o2260","10.1107/S1600536805018866","","","0.71073","MoKα","","0.1029","0.0512","","","0.1145","0.127","","","","","","0.985","","","","has coordinates","211332","2020-10-21","18:00:00",""
"2206239","13.886","0.003","9.898","0.002","10.896","0.002","90","","91.46","0.02","90","","1497.1","0.5","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(Biphenyl-2-yl)-5-(1-methylhydrazino)-1,3,4-thiadiazole","","- C15 H14 N4 S -","- C15 H14 N4 S -","- C60 H56 N16 S4 -","4","1","LH6447","Hempel, Andrew; Lilian Y. Y. Ma; Camerman, Norman; Mastropaolo, Donald; Camerman, Arthur","2-(Biphenyl-2-yl)-5-(1-methylhydrazino)-1,3,4-thiadiazole: a thiadiazole‒hydrazine derivative with anticonvulsant properties","Acta Crystallographica Section E","2005","61","7","o2164","o2166","10.1107/S1600536805018453","","","1.54178","CuKα","","0.1618","0.0706","","","0.1333","0.1356","","","","","","0.892","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206240","13.392","0.0007","16.4043","0.0006","15.1901","0.001","90","","90","","90","","3337.1","0.3","120","2","120","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","α-Tris(2,4-pentanedionato-κ^2^O,O')vanadium(III)","","- C15 H21 O6 V -","- C15 H21 O6 V -","- C120 H168 O48 V8 -","8","1","LH6448","Kavitha, S. Jose; Panchanatheswaran, Krishnaswamy; Low, John N.; Glidewell, Christopher","The α polymorph of racemic tris(2,4-pentanedionato-κ^2^<i>O</i>,<i>O</i>')vanadium(III), redetermined at 120 K","Acta Crystallographica Section E","2005","61","7","m1326","m1328","10.1107/S1600536805018441","","","0.71073","MoKα","","0.156","0.0575","","","0.1045","0.1347","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206241","9.231","0.003","13.375","0.004","13.354","0.004","90","","90","","90","","1648.7","0.9","273","2","298","2","","","","","","","","4","C c c m","-C 2 2c","66","","Poly[μ-cyano-tetracyanodipyridinedicopper(II)]","","- C14 H10 Cu2 N6 -","- C14 H10 Cu2 N6 -","- C56 H40 Cu8 N24 -","4","0.25","LH6449","Xiaohua Pu; Xiaoming Jiang; Yibin Wei; Yanping Li; Pin Yang","Poly[dipyridinecopper(II)-μ-cyano-copper(II)-tri-μ-cyano]","Acta Crystallographica Section E","2005","61","7","m1393","m1395","10.1107/S1600536805019148","","","0.71073","MoKα","","0.0362","0.0299","","","0.0735","0.0769","","","","","","1.002","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206242","6.726","0.002","6.837","0.002","25.267","0.005","83.57","0.02","83.03","0.02","88.03","0.02","1145.8","0.5","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","2-(4-chlorobenzamido)ethanaminium chloride","","- C9 H12 Cl2 N2 O -","- C9 H12 Cl2 N2 O -","- C36 H48 Cl8 N8 O4 -","4","2","LH6450","Hempel, Andrew; Camerman, Norman; Mastropaolo, Donald; Camerman, Arthur","A monoamine oxidase B inhibitor: <i>N</i>-(2-aminoethyl)-<i>p</i>-chlorobenzamide (Ro16-6491) hydrochloride","Acta Crystallographica Section E","2005","61","7","o2283","o2285","10.1107/S1600536805019008","","","1.54178","CuKα","","0.1342","0.076","","","0.1918","0.2059","","","","","","1.074","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206243","9.9145","0.0014","10.214","0.002","10.521","0.002","76.905","0.01","63.051","0.009","67.639","0.01","876.4","0.3","103","2","103","2","","","","","","","","5","P -1","-P 1","2","","dichloro[1,2-bis(phenylsulfanyl)benzene]palladium","","- C18 H14 Cl2 Pd S2 -","- C18 H14 Cl2 Pd S2 -","- C36 H28 Cl4 Pd2 S4 -","2","1","LH6454","Nobuhiro Takeda; Daisuke Shimizu; Takahiro Sasamori; Norihiro Tokitoh","[1,2-Bis(phenylsulfanyl)benzene]dichloropalladium(II)","Acta Crystallographica Section E","2005","61","7","m1408","m1410","10.1107/S1600536805019409","","","0.7107","MoKα","","0.0186","0.0173","","","0.0426","0.0431","","","","","","1.091","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206244","7.022","0.001","13.667","0.002","15.192","0.002","90","","90","","90","","1458","0.4","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Bis(2-acetyl-5-hydroxyphenolato-κ^2^O,O')copper(II)","","- C16 H14 Cu O6 -","- C16 H14 Cu O6 -","- C64 H56 Cu4 O24 -","4","0.5","LH6458","Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Ng, Seik Weng","Bis(2-acetyl-5-hydroxyphenolato-κ^2^<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section E","2005","61","7","m1429","m1430","10.1107/S160053680501980X","","","0.71073","MoKα","","0.062","0.036","","","0.104","0.117","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206245","8.8121","0.0008","10.0253","0.0009","10.172","0.0009","69.474","0.001","80.252","0.001","81.477","0.001","825.58","0.13","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Bis(3-bromo-1-oxidoanthraquinone-κ^2^<i>O</i>^1^,<i>O</i>^9^)bis(pyridine- κN)copper(II) dihydrate","","- C38 H26 Br2 Cu N2 O8 -","- C38 H26 Br2 Cu N2 O8 -","- C38 H26 Br2 Cu N2 O8 -","1","0.5","LH6459","Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Koushik, Saha; Ng, Seik Weng","Bis(3-bromo-1-oxidoanthraquinone-κ^2^<i>O</i>^1^,<i>O</i>^9^)bis(pyridine-κ<i>N</i>)copper(II) dihydrate","Acta Crystallographica Section E","2005","61","7","m1431","m1432","10.1107/S1600536805019811","","","0.71073","MoKα","","0.091","0.048","","","0.122","0.144","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206247","5.7994","0.0007","9.1494","0.0012","12.8573","0.0015","92.152","0.01","94.282","0.01","90.551","0.01","679.78","0.15","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","N,N-Bis(2-cyanoethyl)-p-toluenesulfonamide","","- C13 H15 N3 O2 S -","- C13 H15 N3 O2 S -","- C26 H30 N6 O4 S2 -","2","1","NC6032","Yathirajan, Hemmige S.; Anilkumar, Haleyur G.; Lokanatharai, Kuriya M.; Nagaraj, Basavegowda; Bolte, Michael","<i>N</i>,<i>N</i>-Bis(2-cyanoethyl)-<i>p</i>-toluenesulfonamide","Acta Crystallographica Section E","2005","61","7","o1965","o1966","10.1107/S1600536805016041","","","0.71073","MoKα","","0.0388","0.0324","","","0.077","0.08","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206248","6.838","0.003","9.946","0.004","10.087","0.004","105.94","0.05","96.54","0.05","103.44","0.05","629.9","0.5","291","2","291","2","","","","","","","","3","P -1","-P 1","2","","3,4-Dihydroxy-9H-xanthen-9-one trihydrate","","- C13 H14 O7 -","- C13 H14 O7 -","- C26 H28 O14 -","2","1","NC6035","Gales, Luis; Sousa, Maria E.; Pinto, Madalena M. M.; Damas, Ana M.","3,4-Dihydroxy-9<i>H</i>-xanthen-9-one trihydrate","Acta Crystallographica Section E","2005","61","7","o2213","o2215","10.1107/S1600536805018994","","","0.71069","MoKα","","0.0755","0.0499","","","0.1284","0.1514","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206249","7.4402","0.0005","12.4849","0.0009","8.4844","0.0006","90","","104.524","0.0001","90","","762.93","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis[2-(hydroxymethyl)pyridine-κ^2^N,O]dinitratocopper(II)","","- C12 H14 Cu N4 O8 -","- C12 H14 Cu N4 O8 -","- C24 H28 Cu2 N8 O16 -","2","0.5","NG6149","Feng He; Di Liu","Bis[2-(hydroxymethyl)pyridine-κ^2^<i>N</i>,<i>O</i>]dinitratocopper(II)","Acta Crystallographica Section E","2005","61","7","m1350","m1351","10.1107/S1600536805018696","","","0.71073","MoKα","","0.0263","0.0248","","","0.0752","0.0763","","","","","","1.05","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2206250","5.47","0.001","16.618","0.003","17.322","0.003","90","","90","","90","","1574.6","0.5","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","[o-Phenylenebis(salicylideneaminato)]copper(II)","","- C20 H14 Cu N2 O2 -","- C20 H14 Cu N2 O2 -","- C80 H56 Cu4 N8 O8 -","4","1","NG6151","Yang, Yu-Min","[<i>o</i>-Phenylenebis(salicylideneaminato)]copper(II)","Acta Crystallographica Section E","2005","61","7","m1425","m1426","10.1107/S1600536805019975","","","0.71073","MoKα","","0.1299","0.0756","","","0.1446","0.1711","","","","","","1.028","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2206251","14.789","0.006","12.853","0.005","10.688","0.004","90","","92.549","0.006","90","","2029.6","1.4","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Anthrapinacol","9,9'-Bi-10H-anthracene-9,9'-diol","","- C28 H22 O2 -","- C28 H22 O2 -","- C112 H88 O8 -","4","1","OB6506","Liu, Jian-Cheng; Jin, Shuo; Liu, Bo; Guo, Jian-Ping","9,9'-Bi-10<i>H</i>-anthracene-9,9'-diol","Acta Crystallographica Section E","2005","61","7","o2035","o2037","10.1107/S1600536805014005","","","0.71073","MoKα","","0.1095","0.0621","","","0.108","0.1213","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206252","14.532","0.002","9.7074","0.0013","14.823","0.002","90","","96.167","0.002","90","","2078.9","0.5","295","2","295","2","","","","","","","","6","C 1 c 1","C -2yc","9","","(2-Methylpropane-1,2-diamine-κ^2^N,N')[tris(2-aminoehtttyl)amine- κ^4^N,N',N'',N''')nickel(II) diperchlorate","","- C10 H30 Cl2 N6 Ni O8 -","- C10 H30 Cl2 N6 Ni O8 -","- C40 H120 Cl8 N24 Ni4 O32 -","4","1","OB6524","Yung-Chan Lin; Tian-Huey Lu; Chang-Yao Li; Fen-Ling Liao; Chung-Sun Chung","(2-Methylpropane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')[tris(2-aminoethyl)amine-κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']nickel(II) diperchlorate","Acta Crystallographica Section E","2005","61","7","m1398","m1400","10.1107/S160053680501932X","","","0.71073","MoKα","","0.0483","0.0392","","","0.108","0.1158","","","","","","0.914","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206253","12.7001","0.0014","32.015","0.005","7.3041","0.0019","90","","90","","90","","2969.8","1","297","2","297","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","brucinium 3-nitrohydrogenphthalate dihydrate","2,3-dimethoxystrychnidinium-10-one 2-carboxy-6-nitrophthalate dihydrate","","- C31 H35 N3 O12 -","- C31 H35 N3 O12 -","- C124 H140 N12 O48 -","4","1","OB6527","Graham Smith; Urs D. Wermuth; David J. Young; Peter C. Healy","Brucinium 2-carboxy-6-nitrophthalate dihydrate: the 1:1 proton-transfer compound of brucine with 3-nitrophthalic acid","Acta Crystallographica Section E","2005","61","7","o2008","o2011","10.1107/S1600536805017149","","","0.71069","MoKα","","0.0935","0.065","","","0.1626","0.1794","","","","","","1.169","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206254","8.355","0.001","9.75","0.001","12.202","0.002","99.292","0.003","96.912","0.003","97.103","0.003","963.4","0.2","289","2","289","2","","","","","","","","4","P -1","-P 1","2","","Diethyl 2,8-diamino-4,10-bis(3-nitrophenyl)naphtha[1,2-b;6,5-b']dipyran- 3,9-dicarboxylate dimethylformamide disolvate","","- C40 H42 N6 O12 -","- C40 H42 N6 O12 -","- C40 H42 N6 O12 -","1","0.5","OB6529","Yu-Cheng Wang; Xiang-Shan Wang; Zhao-Sen Zeng; Da-Qing Shi","Diethyl 2,8-diamino-4,10-bis(3-nitrophenyl)naphtho[1,2-<i>b</i>;6,5-<i>b</i>']dipyran-3,9-dicarboxylate dimethylformamide disolvate","Acta Crystallographica Section E","2005","61","7","o2027","o2029","10.1107/S1600536805017113","","","0.71073","MoKα","","0.0955","0.0707","","","0.2198","0.2415","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206255","11.5861","0.0005","13.7665","0.0007","16.8391","0.0008","90","","90","","90","","2685.8","0.2","295","","295","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(5R,6R,7R,9R,13R,14S)-21-Cyclopropylmethyl-6,14-endo-ethano- 2',3',4',5',7,8-hexahydro-4',4',5',5'-tetramethylfurano- [2',3'6,7]normorphide hydrochloride methanol solvate","","- C29 H42 Cl N O4 -","- C29 H42 Cl N O4 -","- C116 H168 Cl4 N4 O16 -","4","1","OB6533","Čejka, Jan; Kratochvíl, Bohumil; Chudík, Miloslav; Jegorov, Alexandr","(5<i>R</i>,6<i>R</i>,7<i>R</i>,9<i>R</i>,13<i>R</i>,14<i>S</i>)-21-Cyclopropylmethyl-6,14-<i>endo</i>-ethano-2',3',4',5',7,8-hexahydro-4',4',5',5'-tetramethylfurano[2',3'6,7]normorphide hydrochloride methanol solvate","Acta Crystallographica Section E","2005","61","7","o2274","o2276","10.1107/S1600536805019410","","","1.5418","CuKα","","0.0461","0.0412","","0.0524","0.0491","0.0491","","","","","","1.0818","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206256","13.689","0.0004","8.2386","0.0002","16.7066","0.0005","90","","92.9198","0.0009","90","","1881.69","0.09","296","1","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(4-Methylphenylsulfonyl)-1,3-diphenylprop-2-en-1-one","","- C22 H18 O3 S -","- C22 H18 O3 S -","- C88 H72 O12 S4 -","4","1","OB6534","Jian-Ming Gu; Xiu-Rong Hu; Wei-Ming Xu","2-(4-Methylphenylsulfonyl)-1,3-diphenylprop-2-en-1-one","Acta Crystallographica Section E","2005","61","7","o2183","o2184","10.1107/S1600536805018684","","","0.7107","MoKα","","","0.045","","","","0.141","","","","","","1.004","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206257","11.3701","0.0005","19.4632","0.0008","17.7735","0.0007","90","","103.338","0.001","90","","3827.2","0.3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","(2,2'-Bipyridine)chloro(4'-tolyl-2,2':6',2""-terpyridine)iridium(III) bis(hexafluorophosphate) acetonitrile disolvate","","- C36 H31 Cl F12 Ir N7 P2 -","- C36 H31 Cl F12 Ir N7 P2 -","- C144 H124 Cl4 F48 Ir4 N28 P8 -","4","1","OB6535","Yutaka, Tomona; Obara, Shinya; Haga, Masa-aki; Yokoyama, Yoshimi; Sakai, Ken","(2,2'-Bipyridine)chloro(4'-tolyl-2,2':6',2''-terpyridine)iridium(III) bis(hexafluorophosphate) acetonitrile disolvate","Acta Crystallographica Section E","2005","61","7","m1357","m1359","10.1107/S1600536805018702","","","0.71073","MoKα","","0.0202","0.0177","","","0.0438","0.0449","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206258","11.9675","0.0015","11.066","0.002","32.7891","0.0014","90","","90","","90","","4342.3","1","290","2","290","2","","","","","","","","4","P c a 21","P 2c -2ac","29","(3RS,4RS)-3-(2-Furyl)-2-phenetyl-4-(pyrrolidin-1-ylcarbonyl)-3,4- dihydroisoquinolin-1(2H)-one","(3RS,4RS)-3-(2-Furyl)-2-phenetyl-4-(pyrrolidin-1-ylcarbonyl)-3,4- dihydroisoquinolin-1(2H)-one","","- C26 H26 N2 O3 -","- C26 H26 N2 O3 -","- C208 H208 N16 O24 -","8","2","OB6537","Rosica Petrova; Boris Shivachev; Krasimir Kosev; Malinka Stoyanova; Silvia Angelova","(3<i>RS</i>,4<i>RS</i>)-3-(2-Furyl)-2-phenethyl-4-(pyrrolidin-1-ylcarbonyl)-3,4-dihydroisoquinolin-1(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","7","o2248","o2250","10.1107/S1600536805019239","","","0.71073","MoKα","","0.1428","0.0551","","","0.1026","0.1287","","","","","","0.98","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206259","12.6213","0.0018","11.2582","0.0016","14.291","0.002","90","","109.869","0.003","90","","1909.8","0.5","223","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Diaquatetraimidazolecobalt(II) dibromide","","- C12 H20 Br2 Co N8 O2 -","- C12 H20 Br2 Co N8 O2 -","- C48 H80 Br8 Co4 N32 O8 -","4","0.5","OM6244","Zhang, Hui; Fang, Liang; Yuan, Runzhang","Diaquatetraimidazolecobalt(II) dibromide","Acta Crystallographica Section E","2005","61","7","m1389","m1390","10.1107/S1600536805018611","","","0.71073","MoKα","","0.0252","0.0209","","","0.0487","0.05","","","","","","1.085","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206260","5.8988","0.001","7.935","0.002","13.903","0.004","97.762","0.01","91.487","0.01","106.146","0.015","618","0.3","105","","105","","","","","","","","","4","P -1","-P 1","2","2,2'-Bis-(3,5-dimethylphenyltellura)azobenzene","(μ-Diazenediyldiphenyl-κ^2^C^2^,N^2^:κ^2^C^2'^,N^1^)bis(3,5- dimethylphenyl)ditellurium(II)","","- C28 H26 N2 Te2 -","- C28 H26 N2 Te2 -","- C28 H26 N2 Te2 -","1","0.5","OM6247","Prabodhika Mallikaratchy; Richard E. Norman; Frank R. Fronczek; Thomas Junk","(μ-Diazenediyldiphenyl-κ^2^<i>C</i>^2^,<i>N</i>^2^:κ^2^<i>C</i>^2'^,<i>N</i>^1^)bis[(3,5-dimethylphenyl)tellurium(II)]","Acta Crystallographica Section E","2005","61","7","m1370","m1372","10.1107/S1600536805018659","","","0.71073","MoKα","","0.032","0.026","","","0.059","0.062","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206261","9.663","0.002","7.128","0.002","9.922","0.002","90","","98.42","0.03","90","","676","0.3","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","catena-Poly[[zinc(II)-μ-[2-(2-carboxylatophenyliminomethyl)phenolato- 1κ^3^O,N,O':1'κO''] methanol solvate]","","- C15 H13 N O4 Zn -","- C15 H13 N O4 Zn -","- C30 H26 N2 O8 Zn2 -","2","1","OM6248","Ju, Wen-Zheng; Shi, Lei; Xue, Jia-Yu","<i>catena</i>-Poly[[zinc(II)-μ-[2-(2-carboxylatophenyliminomethyl)phenolato-1κ^3^<i>O</i>,<i>N</i>,<i>O</i>':1'κ<i>O</i>'']] methanol solvate]","Acta Crystallographica Section E","2005","61","7","m1427","m1428","10.1107/S1600536805019823","","","0.71073","MoKα","","0.0317","0.0309","","","0.0856","0.0861","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206262","8.532","0.004","5.782","0.002","14.05","0.006","90","","102.784","0.007","90","","675.9","0.5","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(S)-3-[4-(Benzyloxy)phenyl]-2-hydroxypropanoic acid","","- C16 H16 O4 -","- C16 H16 O4 -","- C32 H32 O8 -","2","1","RN6049","Wang, He-Qing; Zeng, Qing-Le; Fang, Hua; Huang, Rong-Bin; Zhao, Yu-Fen","(<i>S</i>)-3-[4-(Benzyloxy)phenyl]-2-hydroxypropanoic acid","Acta Crystallographica Section E","2005","61","7","o2286","o2287","10.1107/S1600536805019100","","","0.71073","MoKα","","0.0727","0.0698","","","0.2","0.2038","","","","","","0.863","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206263","7.3871","0.0007","13.8981","0.0016","9.8971","0.0012","90","","108.441","0.008","90","","963.93","0.19","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N,N'-Bis(3-pyridylmethyl)benzene-1,4-dicarboxamide dihydrate","","- C20 H22 N4 O4 -","- C20 H22 N4 O4 -","- C40 H44 N8 O8 -","2","0.5","RN6050","Ge, Chun-Hua; Kou, Hui-Zhong; Wang, Ru-Ji; Jiang, Yun-Bo; Cui, Ai-Li","<i>N</i>,<i>N</i>'-Bis(3-pyridylmethyl)benzene-1,4-dicarboxamide dihydrate","Acta Crystallographica Section E","2005","61","7","o2024","o2026","10.1107/S1600536805017046","","","0.71073","MoKα","","0.0655","0.0392","","","0.0993","0.1291","","","","","","1.092","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206264","8.9163","0.0012","9.5613","0.0013","12.0628","0.0017","102.881","0.003","90.646","0.003","109.411","0.003","941.4","0.2","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","Methyl 2-[2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-ylsulfanylmethyl)phenyl]- 3-methoxyacrylate","","- C19 H20 N4 O3 S -","- C19 H20 N4 O3 S -","- C38 H40 N8 O6 S2 -","2","1","RN6051","De-You Teng; Feng-Qin Ji; Wei Huang","Methyl 2-[2-(5,7-dimethyl-1,2,4-triazolo[1,5-<i>a</i>]pyrimidin-2-ylsulfanylmethyl)phenyl]-3-methoxyacrylate","Acta Crystallographica Section E","2005","61","7","o1992","o1993","10.1107/S1600536805016703","","","0.71073","MoKα","","0.0887","0.0603","","","0.1566","0.1891","","","","","","1.105","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206265","9.814","0.003","5.9232","0.0017","9.701","0.003","90","","112.07","0.004","90","","522.6","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Butyramide","Butyramide","","- C4 H9 N O -","- C4 H9 N O -","- C16 H36 N4 O4 -","4","1","RN6052","Thomas C. Lewis; Derek A. Tocher","A low-temperature determination of butyramide","Acta Crystallographica Section E","2005","61","7","o1985","o1986","10.1107/S1600536805017022","","","0.71073","MoKα","","0.0533","0.041","","","0.1044","0.1112","","","","","","1.006","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206266","11.5254","0.0014","14.5357","0.0018","15.769","0.002","90","","90","","90","","2641.8","0.6","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","6α-Hydroxy-12-oleanen-3-one","","- C30 H48 O2 -","- C30 H48 O2 -","- C120 H192 O8 -","4","1","RZ6077","Kui-Wu Wang; Cui-Rong Sun; Xiao-Ji Cao; Yuan-Jiang Pan","6α-Hydroxy-12-oleanen-3-one: a triterpenoid from the stalks of <i>Celastrus hypoleucus</i>","Acta Crystallographica Section E","2005","61","7","o2022","o2023","10.1107/S1600536805017216","","","0.71073","MoKα","","0.047","0.0372","","","0.1011","0.1069","","","","","","1.074","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206267","11.5212","0.0018","7.9018","0.0012","30.551","0.005","90","","90","","90","","2781.3","0.8","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Ethyl 3-[(1,5-dimethylpyrazol-4-yl)carbonylhydrazino]butyrate","","- C12 H18 N4 O3 -","- C12 H18 N4 O3 -","- C96 H144 N32 O24 -","8","1","RZ6079","Li-Rong Wen; Zi-Qin Ke; Bo Qu; Ming Li","Ethyl 3-[(1,5-dimethylpyrazol-4-yl)carbonylhydrazino]butyrate","Acta Crystallographica Section E","2005","61","7","o2018","o2019","10.1107/S160053680501679X","","","0.71073","MoKα","","0.0718","0.0513","","","0.1447","0.1556","","","","","","0.992","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206268","15.054","0.007","6.538","0.003","36.23","0.015","90","","95.8","0.006","90","","3548","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(N-Salicylaldehyde-p-nitrobenzoylhydrazonato-κ^3^O,N,O') (morpholine-κN)copper(II)","","- C18 H18 Cu N4 O5 -","- C18 H18 Cu N4 O5 -","- C144 H144 Cu8 N32 O40 -","8","1","RZ6081","Yuan, Li-Hui; Wu, Qiong-Jie; Liu, Shi-Xiong","(Morpholine-κ<i>N</i>)(salicylaldehyde 4-nitrobenzoylhydrazonato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')copper(II)","Acta Crystallographica Section E","2005","61","7","m1310","m1312","10.1107/S1600536805017642","","","0.71073","MoKα","","0.0923","0.0537","","","0.109","0.1198","","","","","","1.044","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206269","11.629","0.003","9.927","0.002","14.019","0.003","90","","106.897","0.004","90","","1548.5","0.6","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(4-Methoxyphenyl)-3-methyl-5-(2-pyridyl)-4H-1,2,4-triazole dihydrate","","- C15 H18 N4 O3 -","- C15 H18 N4 O3 -","- C60 H72 N16 O12 -","4","1","RZ6085","Zuo-Xiang Wang; Yan Lan; Lu-Tong Yuan; Chun-Yi Liu","4-(4-Methoxyphenyl)-3-methyl-5-(2-pyridyl)-4<i>H</i>-1,2,4-triazole dihydrate","Acta Crystallographica Section E","2005","61","7","o2033","o2034","10.1107/S1600536805017137","","","0.71073","MoKα","","0.0657","0.0482","","","0.1113","0.1148","","","","","","0.968","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206270","10.4672","0.0002","11.2549","0.0002","17.1109","0.0004","92.235","0.0012","106.562","0.001","94.86","0.0012","1921","0.07","110","2","110","2","","","","","","","","4","P -1","-P 1","2","","5,10,15,20-Tetrakis(4-pyridyl)porphyrin triacetic acid clathrate","","- C46 H38 N8 O6 -","- C46 H38 N8 O6 -","- C92 H76 N16 O12 -","2","1","RZ6086","Sumod George; Israel Goldberg","5,10,15,20-Tetrakis(4-pyridyl)porphyrin tris(acetic acid) clathrate","Acta Crystallographica Section E","2005","61","7","o1973","o1975","10.1107/S1600536805016867","","","0.71073","MoKα","","0.0657","0.0473","","","0.1204","0.1338","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206271","11.4533","0.0014","12.9875","0.0015","6.259","0.0007","90","","99.191","0.002","90","","919.07","0.19","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-trans-trans-Dibromobis(4-fluoroaniline)bis(acetonitrile)nickel(II)","","- C16 H18 Br2 F2 N4 Ni -","- C16 H18 Br2 F2 N4 Ni -","- C32 H36 Br4 F4 N8 Ni2 -","2","0.5","RZ6087","John Fawcett; Fabrizio Sicilia; Gregory A Solan","<i>trans</i>,<i>trans</i>,<i>trans</i>-Diacetonitriledibromobis(4-fluoroaniline)nickel(II)","Acta Crystallographica Section E","2005","61","7","m1256","m1257","10.1107/S1600536805016995","","","0.71073","MoKα","","0.0294","0.027","","","0.068","0.0689","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206272","9.1778","0.0018","14.768","0.003","7.6109","0.0015","90","","90","","90","","1031.6","0.4","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","Trans-1,2-bis(4-pyridyl)ethylene monohydrate","","- C12 H12 N2 O -","- C12 H12 N2 O -","- C48 H48 N8 O4 -","4","1","RZ6088","Huang, Wei; Qian, Hui-Fen","<i>trans</i>-1,2-Bis(4-pyridyl)ethylene monohydrate","Acta Crystallographica Section E","2005","61","7","o2050","o2052","10.1107/S1600536805017666","","","0.71073","MoKα","","0.0367","0.0362","","","0.0894","0.0895","","","","","","1.168","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206273","9.414","0.002","11.041","0.002","12.347","0.002","105.83","0.03","103.87","0.03","107.4","0.03","1103.7","0.6","290","2","290","2","","","","","","","","7","P -1","-P 1","2","","9-(2,6-Dibromophenoxycarbonyl)-10-methylacridinium trifluoromethanesulfonate","","- C22 H14 Br2 F3 N O5 S -","- C22 H14 Br2 F3 N O5 S -","- C44 H28 Br4 F6 N2 O10 S2 -","2","1","RZ6089","Artur Sikorski; Karol Krzymiński; Antoni Konitz; Jerzy Błażejowski","9-(2,6-Dibromophenoxycarbonyl)-10-methylacridinium trifluoromethanesulfonate","Acta Crystallographica Section E","2005","61","7","o2131","o2133","10.1107/S1600536805017952","","","0.71073","MoKα","","0.147","0.0461","","","0.1008","0.1227","","","","","","0.94","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206274","26.088","0.004","37.204","0.006","6.5952","0.0011","90","","90","","90","","6401.2","1.8","294","2","294","2","","","","","","","","6","F d d 2","F 2 -2d","43","","(Z)-1-(2,5-dichlorophenyl)-2-(3-phenylthiazolidin-2-ylidene)ethanone","","- C17 H13 Cl2 N O S -","- C17 H13 Cl2 N O S -","- C272 H208 Cl32 N16 O16 S16 -","16","1","RZ6091","Xu, Liang-Zhong; Yu, Guan-Ping; Zhang, Pu-Yong; Li, Chun-Li","(<i>Z</i>)-1-(2,5-Dichlorophenyl)-2-(3-phenylthiazolidin-2-ylidene)ethanone","Acta Crystallographica Section E","2005","61","7","o2104","o2105","10.1107/S1600536805017964","","","0.71073","MoKα","","0.0832","0.0402","","","0.0764","0.0915","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206275","28.455","0.006","13.737","0.003","19.396","0.004","90","","115.46","0.03","90","","6845","3","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","di-μ~2~-chloro-bis[bis(triphenylphosphito)copper(I)]","","- C72 H60 Cl2 Cu2 O12 P4 -","- C72 H60 Cl2 Cu2 O12 P4 -","- C288 H240 Cl8 Cu8 O48 P16 -","4","0.5","RZ6092","Fang-Fang Jian; Ke-Fei Wang; Hai-Lian Xiao; Yuan-Biao Qiao","A dinuclear chloro(triphenylphosphito)copper(I) complex, di-μ~2~-chloro-bis[bis(triphenylphosphito)copper(I)]","Acta Crystallographica Section E","2005","61","7","m1324","m1325","10.1107/S1600536805018325","","","0.71073","MoKα","","0.093","0.0519","","","0.1238","0.1459","","","","","","1.066","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206276","11.67","0.002","13.466","0.003","14.792","0.003","94.77","0.03","90.82","0.03","96.26","0.03","2302","0.8","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","Tris(5,5'-dimethyl-2,2'-bipyridyl-κ^2^N,N')iron(II) bis(perchlorate) 5,5'-dimethyl-2,2'-bipyridyl solvate","","- C48 H48 Cl2 Fe N8 O8 -","- C48 H48 Cl2 Fe N8 O8 -","- C96 H96 Cl4 Fe2 N16 O16 -","2","1","RZ6093","Albada, Gerard A. van; Mutikainen, Ilpo; Turpeinen, Urho; Reedijk, Jan","Tris(5,5'-dimethyl-2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')iron(II) bis(perchlorate) 5,5'-dimethyl-2,2'-bipyridyl solvate","Acta Crystallographica Section E","2005","61","7","m1411","m1412","10.1107/S1600536805019574","","","0.71073","MoKα","","0.1311","0.0778","","","0.2036","0.238","","","","","","1.035","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206277","10.3988","0.0009","8.7056","0.0008","17.5354","0.0016","90","","102.184","0.002","90","","1551.7","0.2","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(2-Ethoxyphenyl)-6-phenyl-1,2,4-triazolo[3,4-b][1,3,4]thiadiazole","","- C17 H14 N4 O S -","- C17 H14 N4 O S -","- C68 H56 N16 O4 S4 -","4","1","RZ6094","Xiao-Bo Huang; Miao-Chang Liu; Li-Xue Zhang; An-Jiang Zhang; Ya-li Xu; Miao-lin Hu","3-(2-Ethoxyphenyl)-6-phenyl-1,2,4-triazolo[3,4-<i>b</i>][1,3,4]thiadiazole","Acta Crystallographica Section E","2005","61","7","o2233","o2234","10.1107/S160053680501901X","","","0.71073","MoKα","","0.053","0.0453","","","0.1113","0.1162","","","","","","1.042","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206278","8.1173","0.0013","9.8449","0.0015","13.6802","0.0017","90","","122.944","0.007","90","","917.4","0.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N^1^,N^4^-bis(pyridin-4-ylmethyl)terephthalamide dihydrate","","- C20 H22 N4 O4 -","- C20 H22 N4 O4 -","- C40 H44 N8 O8 -","2","0.5","SG6010","Zhang, Hong-Tao; You, Xiao-Zeng","<i>N</i>,<i>N</i>'-Bis(pyridin-4-ylmethyl)terephthalamide dihydrate: a self-interpenetrating hydrogen-bonding network","Acta Crystallographica Section E","2005","61","7","o2055","o2057","10.1107/S1600536805017563","","","0.71073","MoKα","","0.0907","0.0497","","","0.1019","0.113","","","","","","0.908","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206279","11.795","0.002","16.976","0.002","8.7656","0.0014","90","","99.764","0.003","90","","1729.7","0.5","294","2","294","2","","","","","","","","4","C 1 c 1","C -2yc","9","","4-[(4-Hydroxy-3-methoxybenzylidene)amino]-1,5-dimethyl-2-phenylpyrazolidin- 3-one","","- C19 H19 N3 O3 -","- C19 H19 N3 O3 -","- C76 H76 N12 O12 -","4","1","SG6011","Chun-Hua Diao; Zhi Fan; Ming Yu; Xin Chen; Zuo-Liang Jing; Qi-Liang Deng","4-[(4-Hydroxy-3-methoxybenzylidene)amino]-1,5-dimethyl-2-phenylpyrazolidin-3-one","Acta Crystallographica Section E","2005","61","7","o2322","o2323","10.1107/S1600536805019938","","","0.71073","MoKα","","0.0393","0.0306","","","0.08","0.0831","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206280","21.883","0.002","8.7246","0.0006","7.2407","0.0006","90","","90","","90","","1382.4","0.2","273","2","298","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","7-Amino-3-(3-aminophenyl)-1H-quinazoline-2,4-dithione","","- C14 H12 N4 S2 -","- C14 H12 N4 S2 -","- C56 H48 N16 S8 -","4","1","SG6012","Yu, Yun; Yang, Kai-Bin; Lin, Li-Rong; Huang, Rong-Bin; Zheng, Lan-Sun","7-Amino-3-(3-aminophenyl)-1<i>H</i>-quinazoline-2,4-dithione","Acta Crystallographica Section E","2005","61","7","o2310","o2311","10.1107/S1600536805019926","","","0.71073","MoKα","","0.0925","0.0662","","","0.1501","0.1644","","","","","","0.991","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206281","20.6025","0.0004","12.4769","0.0002","29.709","0.0006","90","","90","","90","","7636.9","0.2","173","2","173","2","","","","","","","","9","P c a 21","P 2c -2ac","29","","","","- C37 H41 Cl Fe N2 Ni O2 P2 S3 -","- C37 H41 Cl Fe N2 Ni O2 P2 S3 -","- C296 H328 Cl8 Fe8 N16 Ni8 O16 P16 S24 -","8","2","SG6013","Duff, S. E.; Hitchcock, P. B.; Davies, S. C.; Barclay, J. E.; Evans, D. J.","1,3-Bis(diphenylphosphino)propane-2κ^2^<i>P</i>,<i>P</i>'-dicarbonyl-1κ^2^<i>C</i>-chloro-2κ<i>Cl</i>-{μ-2,2',2''-nitrilotriethanethiolato(3‒)-1κ^4^<i>N</i>,<i>S</i>,<i>S</i>',<i>S</i>'':2κ^2^<i>S</i>,<i>S</i>'}iron(II)nickel(II) acetonitrile solvate","Acta Crystallographica Section E","2005","61","7","m1316","m1319","10.1107/S1600536805018088","","","0.71073","MoKα","","0.066","0.0522","","","0.1006","0.1069","","","","","","1.069","","","","has coordinates,has disorder,has Fobs","194481","2020-10-21","18:00:00",""
"2206282","9.5123","0.0012","9.2752","0.0011","24.424","0.003","90","","95.967","0.002","90","","2143.2","0.5","292","2","292","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1'-tert-Butyl-2'-(2,2-dimethyl-4-oxochroman-6-carbonyl)benzohydrazide","","- C23 H26 N2 O4 -","- C23 H26 N2 O4 -","- C92 H104 N8 O16 -","4","1","SG6014","Pei-Liang Zhao; Wei Huang; Guang-Fu Yang","1'-<i>tert</i>-Butyl-2'-(2,2-dimethyl-4-oxochroman-6-carbonyl)benzohydrazide","Acta Crystallographica Section E","2005","61","7","o2139","o2141","10.1107/S1600536805018398","","","0.71073","MoKα","","0.0954","0.0558","","","0.1212","0.138","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206283","11.9182","0.0005","16.5293","0.0007","21.1391","0.0009","90","","90","","90","","4164.4","0.3","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","catena-Poly[[tri-μ~2~-benzoato-dizinc(II)]-μ~2~-hydroxy]","","- C21 H16 O7 Zn2 -","- C21 H16 O7 Zn2 -","- C168 H128 O56 Zn16 -","8","1","SG6015","Yang, Shi-Yao; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","<i>catena</i>-Poly[[tri-μ~2~-benzoato-dizinc(II)]-μ~2~-hydroxy]","Acta Crystallographica Section E","2005","61","7","m1340","m1342","10.1107/S1600536805018404","","","0.71073","MoKα","","0.069","0.051","","","0.119","0.129","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206284","7.752","0.002","9.238","0.003","9.304","0.003","104.062","0.005","107.942","0.005","95.651","0.005","603.9","0.3","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","3-[(4,5-Dibromo-1-methyl-1H-pyrrole-2-carbonyl)amino]propanoic acid","","- C9 H10 Br2 N2 O3 -","- C9 H10 Br2 N2 O3 -","- C18 H20 Br4 N4 O6 -","2","1","SG6016","Yu-Xia Li; Po-Run Liu; Xiang-Chao Zeng; Shi-Hai Xu; Fen-Ni Liu","3-[(4,5-Dibromo-1-methyl-1<i>H</i>-pyrrole-2-carbonyl)amino]propanoic acid","Acta Crystallographica Section E","2005","61","7","o2150","o2151","10.1107/S1600536805018416","","","0.71073","MoKα","","0.0495","0.0345","","","0.0774","0.0852","","","","","","1.022","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206285","7.4688","0.0015","9.6157","0.0019","39.192","0.008","90","","90","","90","","2814.7","1","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(25R)-spirost-5-en-3-ol dimethyl sulfoxide solvate","","- C29 H48 O4 S -","- C29 H48 O4 S -","- C116 H192 O16 S4 -","4","1","SG6018","Xiufeng Zhang; Yan Cui; Lanfen Wang; Shiwei Zhang; Baozhen Yan; Yang Liu","(25<i>R</i>)-Spirost-5-en-3-ol dimethyl sulfoxide solvate","Acta Crystallographica Section E","2005","61","7","o2324","o2325","10.1107/S1600536805019884","","","0.71073","MoKα","","0.1408","0.0626","","","0.1546","0.1989","","","","","","1.046","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206286","9.2771","0.0005","16.0667","0.0009","14.5453","0.0008","90","","97.034","0.001","90","","2151.7","0.2","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","(diisopropylamino)(9-fluorenyl)(tert-butylamino)borane","(tert-butylamino)(diisopropylamino)(9-fluorenyl)borane","","- C23 H33 B N2 -","- C23 H33 B N2 -","- C92 H132 B4 N8 -","4","1","SG6020","Braunschweig, Holger; Breitling, Frank Michael; Seeler, Fabian","<i>rac</i>-(<i>tert</i>-Butylamino)(diisopropylamino)(9-fluorenyl)borane","Acta Crystallographica Section E","2005","61","7","o2303","o2304","10.1107/S1600536805019902","","","0.71073","MoKα","","0.0624","0.0543","","","0.1186","0.123","","","","","","1.12","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206287","12.3616","0.0012","12.3616","0.0012","11.1685","0.0011","90","","90","","90","","1706.6","0.3","173","1","173","1","","","","","","","","4","P 41","P 4w","76","","(2S,3R,4R,5R)-2-(tert-Butyldimethylsilyloxymethyl)-2,4,5- trimethyltetrahydrofuran-3,4-diol","","- C14 H30 O4 Si -","- C14 H30 O4 Si -","- C56 H120 O16 Si4 -","4","1","SJ6091","Fan, Hong-Tao; Schürmann, Markus; Preut, Hans; Krause, Norbert","(2<i>S</i>,3<i>R</i>,4<i>R</i>,5<i>R</i>)-2-(<i>tert</i>-Butyldimethylsilyloxymethyl)-2,4,5-trimethyltetrahydrofuran-3,4-diol","Acta Crystallographica Section E","2005","61","7","o1987","o1988","10.1107/S1600536805016831","","","0.71073","MoKα","","0.0839","0.0671","","","0.1781","0.1816","","","","","","1.146","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206288","28.869","0.007","3.76","0.001","15.403","0.006","90","","118.04","0.03","90","","1475.7","0.9","298","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N-(3,5-Dichloro-2-pyridyl)formamide","","- C6 H4 Cl2 N2 O -","- C6 H4 Cl2 N2 O -","- C48 H32 Cl16 N16 O8 -","8","1","SJ6093","Resinger, Ales; Wentrup, Curt; Karl A. Byriel; Colin H. L. Kennard","<i>N</i>-(3,5-Dichloro-2-pyridyl)formamide","Acta Crystallographica Section E","2005","61","7","o2053","o2054","10.1107/S1600536805017605","","","0.71073","MoKα","","0.0814","0.041","","","0.1054","0.1295","","","","","","0.872","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206289","5.1656","0.001","7.9102","0.0016","17.669","0.003","83.721","0.015","82.709","0.015","75.683","0.015","691.6","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","4-Chloro-2-[(2-nitro-phenyl)-hydrazono]-3-oxo-butyric acid ethyl ester","","- C12 H12 Cl N3 O5 -","- C12 H12 Cl N3 O5 -","- C24 H24 Cl2 N6 O10 -","2","1","SJ6095","Odabas̨oǧlu, Mustafa; Özdamar, Özgür; Büyükgüngör, Orhan","Ethyl 4-chloro-2-[(2-nitrophenyl)hydrazono]-3-oxobutyrate","Acta Crystallographica Section E","2005","61","7","o2065","o2067","10.1107/S1600536805017617","","","0.71073","MoKα","","0.103","0.061","","","0.172","0.19","","","","","","1.03","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2206290","9.0131","0.0008","9.4161","0.0009","9.8932","0.0009","62.458","0.007","66.52","0.007","86.438","0.007","675.08","0.13","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","4-Chloro-2-[(4-nitrophenyl)hydrazono]-3-oxo-butyric acid ethyl ester","","- C12 H12 Cl N3 O5 -","- C12 H12 Cl N3 O5 -","- C24 H24 Cl2 N6 O10 -","2","1","SJ6096","Odabaşoğlu, Mustafa; Özdamar, Özgür; Büyükgüngör, Orhan","Ethyl 4-chloro-2-[(4-nitrophenyl)hydrazono]-3-oxobutyrate","Acta Crystallographica Section E","2005","61","7","o2068","o2070","10.1107/S1600536805017629","","","0.71073","MoKα","","0.038","0.032","","","0.08","0.083","","","","","","1.04","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2206291","22.383","0.0017","7.4043","0.0006","23.3675","0.0018","90","","112.224","0.001","90","","3585","0.5","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3,3'-(Quinoxaline-2,3-diyldimethylene)bis(pentane-2,4-dione)","","- C20 H22 N2 O4 -","- C20 H22 N2 O4 -","- C160 H176 N16 O32 -","8","1","SJ6097","Liliana Dobrzańska; Gareth O. Lloyd","3,3'-(Quinoxaline-2,3-diyldimethylene)bis(pentane-2,4-dione)","Acta Crystallographica Section E","2005","61","7","o2114","o2116","10.1107/S1600536805018131","","","0.71073","MoKα","","0.0561","0.0443","","","0.11","0.1165","","","","","","1.002","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206292","8.09","0.002","9.576","0.002","11.456","0.003","85.739","0.004","81.378","0.004","79.82","0.005","862.6","0.4","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","Bis(2,4'-bipyridin-1'-ium) 2,5-dicarboxybenzene-1,4-carboxylate benzene-1,2,4,5-tetracarboxylic acid","","- C40 H28 N4 O16 -","- C40 H28 N4 O16 -","- C40 H28 N4 O16 -","1","0.5","SJ6098","Shu-Xin Cui; Jing-Ping Zhang; Lei Wang; Yu-Long Zhao","Bis(2,4'-bipyridin-1'-ium) 2,5-dicarboxybenzene-1,4-carboxylate benzene-1,2,4,5-tetracarboxylic acid","Acta Crystallographica Section E","2005","61","7","o2193","o2195","10.1107/S1600536805018593","","","0.71073","MoKα","","0.0933","0.0498","","","0.0998","0.1155","","","","","","0.875","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206293","9.651","0.003","10.584","0.003","10.681","0.003","82.24","0.02","84.87","0.02","68.06","0.02","1001.8","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","bis[trans-(μ~2~-pentafluoroanilino-κ^2^N:N)]bis[dimethylaluminium(III)]","","- C16 H14 Al2 F10 N2 -","- C16 H14 Al2 F10 N2 -","- C32 H28 Al4 F20 N4 -","2","1","SJ6099","Niemeyer, Mark; Hoffmann, Michael","A dimeric aluminium amide, bis(<i>trans</i>-μ~2~-pentafluoroanilino-κ^2^<i>N</i>:<i>N</i>)bis[dimethylaluminium(III)]","Acta Crystallographica Section E","2005","61","7","m1334","m1336","10.1107/S1600536805017915","","","0.71073","MoKα","","0.04","0.037","","","0.105","0.107","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206294","17.608","0.003","17.608","0.003","17.224","0.003","90","","90","","90","","5340.2","1.6","298","2","298","2","","","","","","","","6","P 42/n :2","-P 4bc","86","","Bis[4-Bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato]manganese(III) nitrate","","- C26 H20 Br2 Mn N5 O5 -","- C26 H20 Br2 Mn N5 O5 -","- C208 H160 Br16 Mn8 N40 O40 -","8","1","SJ6100","Wang, Nong","Bis[4-bromo-2-(pyridin-2-ylmethyliminomethyl)phenolato]manganese(III) nitrate","Acta Crystallographica Section E","2005","61","7","m1304","m1306","10.1107/S1600536805017757","","","0.71073","MoKα","","0.0873","0.0463","","","0.1045","0.1252","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206295","14.8348","0.0012","11.1902","0.0009","16.0909","0.0013","90","","112.479","0.001","90","","2468.2","0.3","293","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 2,2''-dioxo-2,3,5,6,7,7a-hexahydroacenaphthene- 1-spiro-3'-1'H-pyrrolizine-2'spiro-1''-acenaphthene-1-carboxylate","","- C32 H25 N O4 -","- C32 H25 N O4 -","- C128 H100 N4 O16 -","4","1","SJ6101","G. Usha; S. Selvanayagam; D. Velmurugan; K. Ravikumar; R. Rathna Durga; R. Raghunathan","Ethyl 2,2''-dioxo-2',3',5',6',7',7a'-hexahydroacenaphthene-1-spiro-3'-1'<i>H</i>-pyrrolizine-2'spiro-1''-acenaphthene-1-carboxylate","Acta Crystallographica Section E","2005","61","7","o2267","o2269","10.1107/S1600536805019276","","","0.71073","Mo-Kα","","0.0817","0.061","","","0.1615","0.1775","","","","","","0.999","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206296","11.775","0.002","7.0646","0.0014","24.362","0.005","90","","94.777","0.004","90","","2019.5","0.7","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-(1-Benzylpiperidin-4-yl)-N'-(4-methoxybenzoyl)thiourea","","- C21 H25 N3 O2 S -","- C21 H25 N3 O2 S -","- C84 H100 N12 O8 S4 -","4","1","SJ6102","Yusof, Sukeri M.; Yamin, Bohari M.","<i>N</i>-(1-Benzylpiperidin-4-yl)-<i>N</i>'-(4-methoxybenzoyl)thiourea","Acta Crystallographica Section E","2005","61","7","o2265","o2266","10.1107/S1600536805019434","","","0.71073","MoKα","","0.091","0.068","","","0.125","0.133","","","","","","1.18","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206297","13.938","0.004","10.414","0.003","19.311","0.004","90","","131.108","0.013","90","","2112","1.1","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2-Diphenylphosphanylbenzylidene)-4-methylphenylamine","","- C26 H22 N P -","- C26 H22 N P -","- C104 H88 N4 P4 -","4","1","SJ6103","Shamsuddin, Mustaffa; Nur, Abdul Malik M.; Yamin, Bohari M.","<i>N</i>-[2-(Diphenylphosphanyl)benzylidene]-4-methylaniline","Acta Crystallographica Section E","2005","61","7","o2263","o2264","10.1107/S1600536805019422","","","0.71073","MoKα","","0.098","0.067","","","0.13","0.14","","","","","","1.19","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206298","9.9969","0.0006","16.5736","0.001","14.6322","0.0009","90","","109.248","0.001","90","","2288.8","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-Poly[[copper(I)-di-μ-trans-1-(2-pyridyl)-2-(4-pyridyl)ethylene- κ^2^N^2^:N^4^;κ^2^N^4^:N^2^] tetrafluoroborate]","","- C24 H20 B Cu F4 N4 -","- C24 H20 B Cu F4 N4 -","- C96 H80 B4 Cu4 F16 N16 -","4","1","SJ6104","Kai-Long Zhong; Wen-Jie Lu","<i>catena</i>-Poly[[copper(I)-di-μ-<i>trans</i>-1-(2-pyridyl)-2-(4-pyridyl)ethylene-κ^2^<i>N</i>^2^:<i>N</i>^4^;κ^2^<i>N</i>^4^:<i>N</i>^2^] tetrafluoroborate]","Acta Crystallographica Section E","2005","61","7","m1416","m1418","10.1107/S1600536805019501","","","0.71073","Mo-Kα","","0.0883","0.0459","","","0.0993","0.1105","","","","","","1.002","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206299","8.4629","0.0013","8.753","0.0013","9.5926","0.0014","110.489","0.002","94.886","0.002","108.3","0.002","616.57","0.16","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","1,2,3,4-Tetraphenylbutane-1,4-dione benzene solvate","","- C34 H28 O2 -","- C34 H28 O2 -","- C34 H28 O2 -","1","0.5","SJ6105","Amit Jhawar; Ilia A. Guzei; Vitaliy I. Timokhin; Robert West","1,2,3,4-Tetraphenylbutane-1,4-dione benzene solvate and a brief analysis of the solvated organic structures in the Cambridge Structural Database","Acta Crystallographica Section E","2005","61","7","o2291","o2293","10.1107/S1600536805019513","","","0.71073","Mo-Kα","","0.0687","0.0537","","","0.1277","0.1385","","","","","","1.035","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206300","12.6529","0.001","12.6529","0.001","12.6529","0.001","90","","90","","90","","2025.7","0.3","173","2","173","2","","","","","","","","3","P 21 3","P 2ac 2ab 3","198","","Tetrakis(trimethylsilyl)methane","","- C13 H36 Si4 -","- C13 H36 Si4 -","- C52 H144 Si16 -","4","0.333333","SJ6109","Lerner, Hans-Wolfram; Bolte, Michael","Tetrakis(trimethylsilyl)methane","Acta Crystallographica Section E","2005","61","7","o2326","o2327","10.1107/S1600536805020015","","","0.71073","Mo-Kα","","0.096","0.094","","","0.2311","0.2373","","","","","","1.181","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206301","9.8153","0.0016","10.4218","0.0017","10.5894","0.0017","110.538","0.002","93.864","0.002","97.819","0.002","997.2","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","4(4'-Hydroxy-3'-methoxystyryl)-1-methylpyridinium 4-chlorobenzenesulfonate","4(4'-Hydroxy-3'-methoxystyryl)-1-methylpyridinium 4-chlorobenzenesulfonate","","- C21 H20 Cl N O5 S -","- C21 H20 Cl N O5 S -","- C42 H40 Cl2 N2 O10 S2 -","2","1","SU6202","Suchada Chantrapromma; Boonwasana Jindawong; Hoong-Kun Fun; Shazia Anjum; Chatchanok Karalai","4-(4'-Hydroxy-3'-methoxystyryl)-1-methylpyridinium 4-chlorobenzenesulfonate","Acta Crystallographica Section E","2005","61","7","o2096","o2098","10.1107/S1600536805017769","","","0.71073","MoKα","","0.0491","0.0451","","","0.1213","0.1257","","","","","","1.039","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206302","4.0743","0.0007","11.154","0.002","14.778","0.004","90","","94.651","0.017","90","","669.4","0.2","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5,6-dihydrothieno[2,3-d][1,3]dithiol-2-one","","- C5 H4 O S3 -","- C5 H4 O S3 -","- C20 H16 O4 S12 -","4","1","SU6203","Santos, Isabel C.; Belo, Dulce; Mendonça, Joana; Figueira, Mauro João; Almeida, Manuel; Rovira, Concepcion","5,6-Dihydrothieno[2,3-<i>d</i>][1,3]dithiol-2-one","Acta Crystallographica Section E","2005","61","7","o2161","o2163","10.1107/S1600536805018234","","","0.71073","MoKα","","0.0555","0.0394","","","0.093","0.0992","","","","","","1.086","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206303","17.1422","0.0012","6.9643","0.0003","18.2627","0.0013","90","","106.961","0.005","90","","2085.4","0.2","100","","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-Benzyl-3-[2-(1-piperidinio)ethyl]benzimidazolium dichloride monohydrate","","- C21 H29 Cl2 N3 O -","- C21 H29 Cl2 N3 O -","- C84 H116 Cl8 N12 O4 -","4","1","SU6204","Selvi Karaca; Mehmet Akkurt; Ülkü Yılmaz; Hasan Küçükbay; Orhan Büyükgüngör","1-Benzyl-3-[2-(1-piperidinio)ethyl]benzimidazolium dichloride monohydrate","Acta Crystallographica Section E","2005","61","7","o2128","o2130","10.1107/S1600536805018337","","","0.71073","MoKα","","0.0386","0.0305","","","0.0755","0.0783","","","","","","1.037","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206304","7.621","0.0004","10.4049","0.0006","13.155","0.0008","68.003","0.001","85.642","0.001","78.651","0.001","948.28","0.09","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[[tetraaquacopper(II)]-μ-4,4'-bipyridine-κ^2^N:N'] 4-sulfonatobenzoate]","","- C17 H20 Cu N2 O9 S -","- C17 H20 Cu N2 O9 S -","- C34 H40 Cu2 N4 O18 S2 -","2","1","TK6226","Zhang, Li-Ping; Zhu, Long-Guan","<i>catena</i>-Poly[[[tetraaquacopper(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] 4-sulfonatobenzoate]","Acta Crystallographica Section E","2005","61","7","m1264","m1265","10.1107/S1600536805017125","","","0.71073","MoKα","","0.034","0.031","","","0.081","0.083","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206305","7.27","0.002","11.927","0.004","18.528","0.006","90","","98.24","0.005","90","","1590","0.9","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-tert-Butyl-3-(trifluoromethyl)-1H-pyrazol-5-yl 4-chlorobenzoate","","- C15 H14 Cl F3 N2 O2 -","- C15 H14 Cl F3 N2 O2 -","- C60 H56 Cl4 F12 N8 O8 -","4","1","TK6227","Li, Yang; Li, Jiang-Sheng; Huang, Peng-Mian; Duan, Xue-Ming; Dong, Chuan-Ming; Zeng, Tao","1-<i>tert</i>-Butyl-3-(trifluoromethyl)-1<i>H</i>-pyrazol-5-yl 4-chlorobenzoate","Acta Crystallographica Section E","2005","61","7","o2189","o2190","10.1107/S1600536805018477","","","0.71073","MoKα","","0.093","0.038","","","0.076","0.096","","","","","","1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206306","8.0521","0.0001","9.711","0.0001","35.8868","0.0004","90","","90","","90","","2806.13","0.06","100","","100","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-(p-Tolyl)-β-L-rhamnopyranosylamine 1.5-hydrate","","- C13 H22 N O5.5 -","- C13 H22 N O5.5 -","- C104 H176 N8 O44 -","8","2","TK6228","Punzo, Francesco; Watkin, David J.; Cook, Joseph M. D.; Hotchkiss, David; Fleet, George W. J.","<i>N</i>-(<i>p</i>-Tolyl)-β-<small>L</small>-rhamnopyranosylamine 1.5-hydrate","Acta Crystallographica Section E","2005","61","7","o2155","o2157","10.1107/S1600536805018489","","","0.71073","MoKα","","0.041","0.036","","0.096","0.093","0.096","","","","","","0.946","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206307","11.1653","0.0014","13.3535","0.0017","7.738","0.001","90","","107.082","0.002","90","","1102.8","0.2","292","2","292","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Diethyl 2,3-bis(benzo[1,3]dioxole-5-carbonyl)but-2-enedioate","","- C24 H20 O10 -","- C24 H20 O10 -","- C48 H40 O20 -","2","0.5","TK6229","Wang, Zhi-Guo; Chen, Ai-Hua; Yin, Guo-Dong; Wu, An-Xin","Diethyl 2,3-bis(benzo[1,3]dioxole-5-carbonyl)but-2-enedioate","Acta Crystallographica Section E","2005","61","7","o2320","o2321","10.1107/S1600536805020003","","","0.71073","MoKα","","0.065","0.054","","","0.139","0.147","","","","","","1.08","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206308","7.4467","0.0016","6.1343","0.0011","22.72","0.003","90","","92.508","0.019","90","","1036.9","0.3","298","2","298","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","4-(2-Naphthyl)pyrimidine","","- C14 H10 N2 -","- C14 H10 N2 -","- C56 H40 N8 -","4","1","TK6230","Ingebrigtsen, Truls; Lejon, Tore; Hansen, Lars Kr.","4-(2-Naphthyl)pyrimidine","Acta Crystallographica Section E","2005","61","7","o2256","o2257","10.1107/S1600536805019306","","","0.71069","MoKα","","0.187","0.04","","","0.071","0.097","","","","","","0.82","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206309","9.801","0.003","15.549","0.004","26.142","0.007","90","","90","","90","","3983.9","1.9","273","2","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-[4,5-Bis(4-methoxyphenyl)-1H-imidazol-2-yl]benzonitrile","","- C24 H19 N3 O2 -","- C24 H19 N3 O2 -","- C192 H152 N24 O16 -","8","1","WK6050","Xu-Feng Liu; Zeng-Pei Zhong; Zun-Le Xu","4-[4,5-Bis(4-methoxyphenyl)-1<i>H</i>-imidazol-2-yl]benzonitrile","Acta Crystallographica Section E","2005","61","7","o1976","o1977","10.1107/S1600536805016946","","","0.71073","MoKα","","","0.0541","","","","0.1296","","","","","","1.023","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206310","9.206","0.003","8.282","0.003","11.347","0.003","90","","123.255","0.017","90","","723.5","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis(4-pyridylformyl)piperazine","","- C16 H16 N4 O2 -","- C16 H16 N4 O2 -","- C32 H32 N8 O4 -","2","0.5","WK6051","Cai-Feng Ding; Mei Zhu; Xue-Mei Li; Shu-Sheng Zhang; Hong Xu; Ping-Kai Ouyang","<i>N</i>,<i>N</i>'-Bis(4-pyridylformyl)piperazine","Acta Crystallographica Section E","2005","61","7","o1981","o1982","10.1107/S1600536805016958","","","0.71073","MoKα","","0.048","0.0442","","","0.1133","0.1173","","","","","","1.085","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206311","5.5771","0.0001","14.6164","0.0003","19.2112","0.0004","90","","90","","90","","1566.04","0.05","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3-O-Benzoyl-1,2-O-isopropylidene-β-D-fructopyranose","","- C16 H20 O7 -","- C16 H20 O7 -","- C64 H80 O28 -","4","1","WK6054","Langer, Vratislav; Mičová, Ju̇lia; Steiner, Bohumil; Koóš, Miroslav","3-<i>O</i>-Benzoyl-1,2-<i>O</i>-isopropylidene-β-<small>D</small>-fructopyranose","Acta Crystallographica Section E","2005","61","7","o2172","o2174","10.1107/S1600536805018520","","","0.71073","MoKα","","0.0642","0.0413","","","0.0881","0.1026","","","","","","0.988","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206312","34.33","0.003","7.038","0.0003","6.1666","0.0003","90","","91.377","0.006","90","","1489.51","0.16","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","Ammonium magnesium phosphite 18-hydrate","Diammonium trimagnesium tetrakis[hydrogenphosphate(III)] octadecahydrate","","- H48 Mg3 N2 O30 P4 -","- H48 Mg3 N2 O30 P4 -","- H96 Mg6 N4 O60 P8 -","2","0.25","WM6070","Messouri, Ibtissam; El Bali, Brahim; Capitelli, Francesco; Piniella, Juan F.; Lachkar, Mohammed; Slimani, Zineb","Diammonium tris[hexaaquamagnesium(II)] tetrakis[hydrogenphosphate(III)], (NH~4~)~2~[Mg(H~2~O)~6~]~3~(HPO~3~)~4~","Acta Crystallographica Section E","2005","61","7","i129","i131","10.1107/S160053680501723X","","","0.71073","MoKα","","0.0242","0.0221","","","0.0627","0.0637","","","","","","1.108","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206313","4.9916","0.0009","6.2388","0.0011","37.342","0.007","90","","90","","90","","1162.9","0.4","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-(N-Phenylazo)aminobenzaldehyde","","- C13 H11 N3 O -","- C13 H11 N3 O -","- C52 H44 N12 O4 -","4","1","WN6356","Liu, Xin-Gang; Feng, Ya-Qing; Liu, Dong-Qing; Zhao, Yao","4-[(Phenyldiazenyl)amino]benzaldehyde","Acta Crystallographica Section E","2005","61","7","o2185","o2186","10.1107/S1600536805018751","","","0.71073","MoKα","","0.07","0.0373","","","","0.0939","","","","","","1.083","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206314","9.9258","0.0011","20.089","0.002","11.8605","0.0013","90","","111.324","0.002","90","","2203.1","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","xanthone V1","5,9,10-Trihydroxy-2,2-dimethyl-12-(3-methylbut-2-enyl)-2H,6H- pyrano[3,2-b]xanthen-6-one methanol solvate","","- C24 H26 O7 -","- C24 H26 O7 -","- C96 H104 O28 -","4","1","WN6357","Suchada Chantrapromma; Nawong Boonnak; Hoong-Kun Fun; Shazia Anjum; Atta-ur-Rahman; Chatchanok Karalai","5,9,10-Trihydroxy-2,2-dimethyl-12-(3-methylbut-2-enyl)-2<i>H</i>,6<i>H</i>-pyrano[3,2-<i>b</i>]xanthen-6-one methanol solvate","Acta Crystallographica Section E","2005","61","7","o2136","o2138","10.1107/S1600536805018192","","","0.71073","MoKα","","0.0953","0.0868","","","0.2245","0.2298","","","","","","1.107","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206315","9.069","0.002","6.136","0.001","32.537","0.007","90","","96.87","0.03","90","","1797.6","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ethyl 2-amino-4-(3-fluorophenyl)-4H-benzo[h]chromene-3-carboxylate","","- C22 H18 F N O3 -","- C22 H18 F N O3 -","- C88 H72 F4 N4 O12 -","4","1","WN6358","Guo, Cheng; Gu, Xi-Feng; Zhang, Lian-Di; Li, Yan","Ethyl 2-amino-4-(3-fluorophenyl)-4<i>H</i>-benzo[<i>h</i>]chromene-3-carboxylate","Acta Crystallographica Section E","2005","61","7","o2125","o2127","10.1107/S1600536805018283","","","0.71073","MoKα","","0.1867","0.0837","","","0.2261","0.2894","","","","","","0.998","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206316","11.183","0.0009","13.9851","0.001","12.3419","0.0009","90","","116.445","0.001","90","","1728.2","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","3-[3-(4-Chlorophenyl)-4-oxothiazolidin-2-yl]-6-methyl-4H-benzopyran-4-one","","- C19 H14 Cl N O3 S -","- C19 H14 Cl N O3 S -","- C76 H56 Cl4 N4 O12 S4 -","4","1","WW6378","Zhou, Zhong-Zhen; Huang, Wei; Zhao, Pei-Liang; Chen, Qiong; Yang, Guang-Fu","3-[3-(4-Chlorophenyl)-4-oxothiazolidin-2-yl]-6-methyl-4<i>H</i>-benzopyran-4-one","Acta Crystallographica Section E","2005","61","7","o2261","o2262","10.1107/S1600536805019355","","","0.71073","MoKα","","0.0551","0.0443","","","0.1252","0.1344","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206317","13.962","0.001","6.009","0.001","8.877","0.001","90","","90","","90","","744.76","0.16","295","2","295","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Diaquadithiocyanatocopper(II)","","- C2 H4 Cu N2 O2 S2 -","- C2 H4 Cu N2 O2 S2 -","- C8 H16 Cu4 N8 O8 S8 -","4","0.5","WW6382","Wu, Tao; Ma, Ming-Zhi; Zhou, Rui; Li, Dan; Ng, Seik Weng","Diaquadithiocyanatocopper(II)","Acta Crystallographica Section E","2005","61","7","m1401","m1402","10.1107/S1600536805019215","","","0.71073","MoKα","","0.033","0.032","","","0.085","0.086","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206318","8.2474","0.0016","8.4577","0.0017","10.488","0.002","70.05","0.03","76.83","0.03","62.73","0.03","609","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Bis(3-hydroxypyridine-κN)(nitrato-κ^2^O,O')silver(I)","","- C10 H10 Ag N3 O5 -","- C10 H10 Ag N3 O5 -","- C20 H20 Ag2 N6 O10 -","2","1","WW6388","Lu, Zhen-Zhong; Huo, Li-Hua; Gao, Shan; Zhao, Hui; Zhao, Jing-Gui","Bis(3-hydroxypyridine-κ<i>N</i>)(nitrato-κ^2^<i>O</i>,<i>O</i>')silver(I)","Acta Crystallographica Section E","2005","61","7","m1386","m1388","10.1107/S1600536805019240","","","0.71073","MoKα","","0.0302","0.0261","","","0.0645","0.0784","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206319","6.101","0.001","8.598","0.002","11.479","0.002","94.88","0.03","98.56","0.03","92.42","0.03","592.4","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","2,5-dibenzoyl-terephthalic acid","2,5-Dibenzoylterephthalic acid ethanol disolvate","","- C26 H26 O8 -","- C26 H26 O8 -","- C26 H26 O8 -","1","0.5","WW6389","Zhu, Hong-jun; Wang, Dan-Dan; Song, Guang-Liang; Wang, Jin-Tang; Lu, Wei-Wei; Yu, Rong","2,5-Dibenzoylterephthalic acid ethanol disolvate","Acta Crystallographica Section E","2005","61","7","o2237","o2238","10.1107/S1600536805019173","","","0.71073","MoKα","","0.0895","0.0548","","","0.1494","0.17","","","","","","1.046","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206320","11.1332","0.0002","10.0822","0.0003","17.4142","0.0004","90","","104.058","0.001","90","","1896.15","0.08","106","2","106","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","butyltriphenylphosphonium bromide","Butyltriphenylphosphonium bromide","","- C22 H24 Br P -","- C22 H24 Br P -","- C88 H96 Br4 P4 -","4","1","WW6397","Czerwinski, Edmund W.","Butyltriphenylphosphonium bromide","Acta Crystallographica Section E","2005","61","7","o2272","o2273","10.1107/S160053680501929X","","","1.5418","CuKα","","0.0386","0.0339","","","","0.0948","","","","","","1.139","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206321","23.081","0.004","4.5554","0.0008","13.069","0.002","90","","108.741","0.002","90","","1301.3","0.4","294","2","294","2","","","","","","","","5","C 1 c 1","C -2yc","9","","2-Chloro-4,6-di-morpholino-1,3,5-triazine","","- C11 H16 Cl N5 O2 -","- C11 H16 Cl N5 O2 -","- C44 H64 Cl4 N20 O8 -","4","1","WW6398","Zeng, Tao; Dong, Chuan-Ming; Shu, Xue-Gui; Li, Jiang-Sheng; Huang, Peng-Mian","2-Chloro-4,6-dimorpholino-1,3,5-triazine","Acta Crystallographica Section E","2005","61","7","o2211","o2212","10.1107/S1600536805019021","","","0.71073","MoKα","","0.0288","0.0262","","","0.0646","0.0664","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206322","7.655","0.0007","9.0221","0.0008","22.927","0.002","90","","92.811","0.002","90","","1581.5","0.2","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(2,4-Dichlorophenoxy)-N-[5-(3-pyridyl)-1,3,4-thiadiazol-2-yl]acetamide","","- C15 H10 Cl2 N4 O2 S -","- C15 H10 Cl2 N4 O2 S -","- C60 H40 Cl8 N16 O8 S4 -","4","1","WW6406","Song, Xin-Jian; Shi, Bo-An; Wang, Yan-Gang; Liu, Hong-Xia; Wang, Yan","2-(2,4-Dichlorophenoxy)-<i>N</i>-[5-(3-pyridyl)-1,3,4-thiadiazol-2-yl]acetamide","Acta Crystallographica Section E","2005","61","7","o2254","o2255","10.1107/S1600536805019343","","","0.71073","MoKα","","0.0503","0.0419","","","0.1076","0.1216","","","","","","1.078","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206323","8.1827","0.0006","7.0914","0.0005","13.1674","0.0009","90","","101.154","0.001","90","","749.63","0.09","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","ethylenediammonium hexaaquazinc(II) sulfate","Ethane-1,2-diaminium hexaaquazinc(II) sulfate","","- C2 H22 N2 O14 S2 Zn -","- C2 H22 N2 O14 S2 Zn -","- C4 H44 N4 O28 S4 Zn2 -","2","0.5","XU6014","Apinpus, Rujiwatra; Jumras, Limtrakul","Ethane-1,2-diaminium hexaaquazinc(II) sulfate","Acta Crystallographica Section E","2005","61","7","m1403","m1404","10.1107/S1600536805019604","","","0.71073","MoKα","","0.024","0.024","","","0.064","0.064","","","","","","1.139","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206324","16.5457","0.0009","16.7931","0.0009","22.4135","0.0012","90","","90","","90","","6227.7","0.6","295","2","295","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","(Tris{2-[(1-methylimidazol-2-yl)methylimino]ethyl}amine)iron(II) diperchlorate acetonitrile solvate","","- C23 H33 Cl2 Fe N11 O8 -","- C23 H33 Cl2 Fe N11 O8 -","- C184 H264 Cl16 Fe8 N88 O64 -","8","1","XU6015","Chen, Hong-Mei; Yang, Shi-Ping; Chen, Qiong-Qiong; Chen, Jia-Min; Yu, Xi-Bin","(Tris{2-[(1-methylimidazol-2-yl)methylimino]ethyl}amine)iron(II) diperchlorate acetonitrile solvate","Acta Crystallographica Section E","2005","61","7","m1277","m1279","10.1107/S1600536805017083","","","0.71073","MoKα","","0.078","0.053","","","0.15","0.163","","","","","","0.989","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206325","13.161","0.003","11.905","0.003","25.144","0.007","90","","98.794","0.004","90","","3893.3","1.7","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","dichloro[bis(bis(benzimidazol-2-ylmethyl)-amine)] manganese(II) methanol trisolvate","","- C35 H42 Cl2 Mn N10 O3 -","- C35 H42 Cl2 Mn N10 O3 -","- C140 H168 Cl8 Mn4 N40 O12 -","4","1","XU6017","Zhou, Qing-Hua; Yang, Pin","Bis[bis(benzimidazol-2-ylmethyl)amine]-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'';κ^2^<i>N</i>,<i>N</i>'-chloromanganese(II) chloride methanol trisolvate","Acta Crystallographica Section E","2005","61","7","m1292","m1294","10.1107/S1600536805017678","","","0.71073","MoKα","","0.097","0.049","","","0.066","0.071","","","","","","0.925","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206326","6.9505","0.0007","7.6096","0.0007","15.225","0.0015","95.985","0.002","96.095","0.002","93.712","0.002","794","0.13","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H12 F2 N6 O2 S -","- C14 H12 F2 N6 O2 S -","- C28 H24 F4 N12 O4 S2 -","2","1","YA6246","Hu, Xiao-Wei; Chen, Qiong; Liu, Zu-Ming; Yang, Guang-Fu","The herbicide flumetsulam as the acetonitrile solvate","Acta Crystallographica Section E","2005","61","7","o2083","o2085","10.1107/S1600536805017745","","","0.71073","MoKα","","0.048","0.044","","","0.121","0.134","","","","","","1.1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206327","22.0779","0.0017","11.0552","0.0009","18.9962","0.0015","90","","90","","90","","4636.5","0.6","292","2","292","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","1,3:4,6-Bis(1,4-diphenylethynyl-2,3-xylylene)tetrahydro-3a,6a- bis(ethoxycarbonyl)imidazo[4,5-d]imidazole-2,5(1H,3H)-dione","","- C58 H42 N4 O6 -","- C58 H42 N4 O6 -","- C232 H168 N16 O24 -","4","0.5","YA6247","Neng-Fang She; Hui-Zhen Guo; An-Xin Wu","1,3:4,6-Bis(1,4-diphenylethynyl-2,3-xylylene)tetrahydro-3a,6a-bis(ethoxycarbonyl)imidazo[4,5-<i>d</i>]imidazole-2,5(1<i>H</i>,3H)-dione, a molecular clip based on di(ethoxycarbonyl)glycoluril","Acta Crystallographica Section E","2005","61","7","o2003","o2004","10.1107/S1600536805017162","","","0.71073","MoKα","","0.101","0.062","","","0.155","0.174","","","","","","1.05","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206328","25.824","0.013","13.962","0.003","15.861","0.004","90","","124.93","0.04","90","","4689","4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dipropyl 3,6-bis(4-chlorophenyl)-1,2-dihydro-1,2,4,5-tetrazine-1,2-dicarboxylate","","- C22 H22 Cl2 N4 O4 -","- C22 H22 Cl2 N4 O4 -","- C176 H176 Cl16 N32 O32 -","8","1","YA6249","Guo-Wu Rao; Wei-Xiao Hu","Dipropyl 3,6-bis(4-chlorophenyl)-1,2-dihydro-1,2,4,5-tetrazine-1,2-dicarboxylate","Acta Crystallographica Section E","2005","61","7","o2102","o2103","10.1107/S1600536805017101","","","0.71073","MoKα","","0.076","0.041","","","0.115","0.134","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206329","8.6588","0.0004","12.3368","0.0007","15.4441","0.0009","90","","90","","90","","1649.77","0.15","90","0.2","90","0.2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","6-O-acetylcodeine","6α-Acetoxy-4,5α-epoxy-3-methoxy-17-methyl-morphin-7-ene","","- C20 H23 N O4 -","- C20 H23 N O4 -","- C80 H92 N4 O16 -","4","1","AC6177","Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.","6α-Acetoxy-4,5α-epoxy-3-methoxy-17-methylmorphin-7-ene","Acta Crystallographica Section E","2005","61","8","o2579","o2581","10.1107/S1600536805022130","","","0.71073","MoKα","","0.0962","0.0475","","","0.0943","0.1125","","","","","","0.982","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206330","11.7235","0.0009","18.378","0.0013","14.1604","0.001","90","","109.903","0.001","90","","2868.7","0.4","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,6-Dibenzyl-8b,8c-diphenyl-2,3a,4a,6,7a,8a- hexaazaperhydrocyclopenta[def]fluorene-4,8-dione","","- C34 H32 N6 O2 -","- C34 H32 N6 O2 -","- C136 H128 N24 O8 -","4","1","AC6178","Li, Yi-Tao; Long, Tao; Wu, An-Xin","2,6-Dibenzyl-8b,8c-diphenyl-2,3a,4a,6,7a,8a-hexaazaperhydrocyclopenta[<i>def</i>]fluorene-4,8-dione","Acta Crystallographica Section E","2005","61","8","o2374","o2375","10.1107/S1600536805020659","","","0.71073","MoKα","","0.1037","0.0626","","","0.1321","0.1513","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206331","9.192","0.004","6.996","0.004","10.869","0.005","90","","93.6","0.04","90","","697.6","0.6","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Aminopyridinium nitrate","","- C5 H7 N3 O3 -","- C5 H7 N3 O3 -","- C20 H28 N12 O12 -","4","1","AC6179","Rademeyer, Melanie","4-Aminopyridinium nitrate","Acta Crystallographica Section E","2005","61","8","o2496","o2498","10.1107/S1600536805020660","","","0.71073","MoKα","","0.086","0.0477","","","0.1019","0.1158","","","","","","0.943","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206332","8.628","0.002","12.727","0.002","15.4842","0.0019","90","","90","","90","","1700.3","0.5","290","2","290","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","6-O-acetylcodeine","6α-acetoxy-4,5α-epoxy-3-methoxy-17-methyl-morphin-7-ene","","- C20 H23 N O4 -","- C20 H23 N O4 -","- C80 H92 N4 O16 -","4","1","AC6180","Tsonko Kolev; Rumyana Bakalska; Boris Shivachev; Rosica Petrova","6-<i>O</i>-Acetylcodeine","Acta Crystallographica Section E","2005","61","8","o2582","o2584","10.1107/S1600536805022129","","","0.71073","MoKα","","0.1107","0.0489","","","0.1056","0.1264","","","","","","0.978","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206333","17.861","0.011","13.386","0.006","20.451","0.013","90","","91.744","0.005","90","","4887","5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,4-Bis{[(2Z)-2-(3-mesityl-3-methylcyclobutyl)-2-one thiosemicarbazono]ethyl} piperazine dimethylsulfoxide disolvate","","- C42 H68 N8 O2 S4 -","- C42 H68 N8 O2 S4 -","- C168 H272 N32 O8 S16 -","4","1","AT6012","Çiğdem Yüksektepe; Serkan Soylu; Hanife Saraçoğlu; Nezihe Çalışkan; Alaaddin Çukurovalı; Íbrahim Yılmaz; Cavit Kazaz","1,4-Bis[(<i>Z</i>)-2-(3-mesityl-3-methylcyclobutyl)-2-(thiosemicarbazono)ethyl]piperazine dimethyl sulfoxide disolvate","Acta Crystallographica Section E","2005","61","8","o2384","o2386","10.1107/S1600536805020350","","","0.71069","MoKα","","0.117","0.058","","","0.148","0.174","","","","","","0.94","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2206334","7.8929","0.0008","29.415","0.004","12.4679","0.0014","90","","90","","90","","2894.7","0.6","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-(2,3,5-Trimethylphenoxy)phthalonitrile","","- C17 H14 N2 O -","- C17 H14 N2 O -","- C136 H112 N16 O8 -","8","1","AT6019","Akbal, Tufan; Akdemir, Nesuhi; Ağar, Erbil; Kantar, Cihan; Erdönmez, Ahmet","4-(2,3,5-Trimethylphenoxy)phthalonitrile","Acta Crystallographica Section E","2005","61","8","o2630","o2631","10.1107/S1600536805022592","","","0.71073","MoKα","","0.082","0.036","","","0.089","0.1","","","","","","0.8","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206335","14.2841","0.0014","8.3753","0.0005","22.353","0.002","90","","90","","90","","2674.2","0.4","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","4-(2-Bromo-4-chlorophenoxy)phthalonitrile","","- C14 H6 Br Cl N2 O -","- C14 H6 Br Cl N2 O -","- C112 H48 Br8 Cl8 N16 O8 -","8","1","AT6020","Atalay, Şehriman; Ocak Ískeleli, Nazan; Ağar, Erbil; Akdemir, Nesuhi","4-(2-Bromo-4-chlorophenoxy)phthalonitrile","Acta Crystallographica Section E","2005","61","8","o2654","o2655","10.1107/S1600536805021057","","","0.71073","MoKα","","0.112","0.057","","","0.123","0.144","","","","","","1.05","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206336","14.929","0.005","8.2223","0.0016","18.737","0.006","90","","90","","90","","2300","1.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Bis[2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)ethoxy] ether","","- C20 H22 N8 O2 S2 -","- C20 H22 N8 O2 S2 -","- C80 H88 N32 O8 S8 -","4","0.5","AT6021","Wei Wang; Bing Zhao; Peng-Wu Zheng; Xue-Min Duan","Bis[2-(1-phenyl-1<i>H</i>-tetrazol-5-ylsulfanyl)ethoxy] ether","Acta Crystallographica Section E","2005","61","8","o2623","o2624","10.1107/S160053680502249X","","","0.71073","MoKα","","0.091","0.044","","","1.101","0.128","","","","","","1.01","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206337","8.2381","0.0014","12.269","0.002","12.937","0.002","90","","105.075","0.003","90","","1262.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(2-Nitrophenyl)-1-oxo-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane- 4-carboxamide","","- C11 H11 N2 O7 P -","- C11 H11 N2 O7 P -","- C44 H44 N8 O28 P4 -","4","1","AT6025","Zang, Hong-Jun; Guo, Ming-Lin","<i>N</i>-(2-Nitrophenyl)-1-oxo-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane-4-carboxamide","Acta Crystallographica Section E","2005","61","8","o2772","o2774","10.1107/S1600536805023974","","","0.71073","MoKα","","0.065","0.041","","","0.099","0.115","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206338","9.1471","0.0011","12.1267","0.0014","17.475","0.002","90","","94.516","0.002","90","","1932.4","0.4","293","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Caesium bis[N-(carbamoylmethyl)iminodiacetato]chromium(III) dihydrate","","- C12 H20 Cr Cs N4 O12 -","- C12 H20 Cr Cs N4 O12 -","- C48 H80 Cr4 Cs4 N16 O48 -","4","1","BD6007","Visser, Hendrik G.; Purcell, Walter; Cloete, Nicoline; Muller, Alfred","Caesium bis[<i>N</i>-(carbamoylmethyl)iminodiacetato]chromate(III) dihydrate","Acta Crystallographica Section E","2005","61","8","m1668","m1670","10.1107/S160053680502101X","","","0.71073","MoKα","","","0.0317","","","","0.0803","","","","","","1.025","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206339","9.3999","0.0018","20.274","0.004","9.7668","0.0019","90","","111.764","0.003","90","","1728.6","0.6","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2-(Acetylamido)-N-(4-chlorophenyl)-4,5,6,7-tetrahydro-1-benzothiophene- 3-carboxamide","","- C17 H17 Cl N2 O2 S -","- C17 H17 Cl N2 O2 S -","- C68 H68 Cl4 N8 O8 S4 -","4","1","BH6009","Chandrakumar, K.; Kokila, M. K.; Puttaraja; Mohan, S.; Manjunath Shetty, K. S.","2-(Acetylamido)-<i>N</i>-(4-chlorophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide","Acta Crystallographica Section E","2005","61","8","o2444","o2446","10.1107/S1600536805020970","","","0.71073","MoKα","","0.0731","0.0552","","","0.129","0.138","","","","","","1.088","","","","has coordinates,has disorder","176774","2020-10-21","18:00:00",""
"2206340","4.7347","0.0001","32.651","0.0007","9.3959","0.0002","90","","109.031","0.0009","90","","1373.15","0.05","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Benzyl N-[1-(furan-2-yl)ethylidene]hydrazinecarbodithioate","","- C14 H14 N2 O S2 -","- C14 H14 N2 O S2 -","- C56 H56 N8 O4 S8 -","4","1","BH6010","Khoo, Teng-Jin; Cowley, Andrew R.; Watkin, David J.; Crouse, Karen A.; Tarafder, M. T. H.","Benzyl <i>N</i>-[1-(furan-2-yl)ethylidene]hydrazinecarbodithioate","Acta Crystallographica Section E","2005","61","8","o2441","o2443","10.1107/S1600536805020969","","","0.71073","MoKα","","0.0666","0.0393","","0.0571","0.0467","0.0467","","","","","","1.089","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2206341","10.092","0.002","10.521","0.002","14.699","0.003","90","","90.43","0.03","90","","1560.7","0.5","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","α-Diphenylphosphoryl-o-cresol","2-[(diphenylphosphoryl)methyl]phenol","","- C19 H17 O2 P -","- C19 H17 O2 P -","- C76 H68 O8 P4 -","4","1","BH6014","Yulya V. Nelubina; Diana V. Alexanyan; Vladimir A. Kozlov; Konstantin A. Lyssenko; Irina L. Odinets","A monoclinic polymorph of α-diphenylphosphoryl-<i>o</i>-cresol","Acta Crystallographica Section E","2005","61","8","o2539","o2541","10.1107/S1600536805021811","","","0.71073","MoKα","","0.0693","0.0403","","","0.1063","0.1194","","","","","","1.005","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206342","4.442","0.0009","12.953","0.003","12.677","0.003","90","","95.62","0.03","90","","725.9","0.3","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H11 N3 O3 -","- C4 H11 N3 O3 -","- C16 H44 N12 O12 -","4","1","BH6015","Perpétuo, Genivaldo Julio; Janczak, Jan","Piperazinium nitrate","Acta Crystallographica Section E","2005","61","8","o2531","o2533","10.1107/S1600536805021951","","","0.71073","MoKα","","0.1085","0.0426","","","0.0911","0.1077","","","","","","1.048","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206343","9.9262","0.0008","22.549","0.0019","15.89","0.0013","90","","96.43","0.001","90","","3534.2","0.5","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(3,5-Dinitrobenzoato)tris(2-methyl-2-phenylpropyl)tin(IV)","","- C37 H42 N2 O6 Sn -","- C37 H42 N2 O6 Sn -","- C148 H168 N8 O24 Sn4 -","4","1","BH6016","Tian, Lai-Jin; Yu, Feng-Yang; Sun, Yu-Xi; Zhang, Bo","(3,5-Dinitrobenzoato)tris(2-methyl-2-phenylpropyl)tin(IV)","Acta Crystallographica Section E","2005","61","8","m1537","m1538","10.1107/S1600536805021458","","","0.71073","MoKα","","0.0525","0.0468","","","0.1008","0.1037","","","","","","1.185","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206344","8.81","0.002","8.81","0.002","8.81","0.002","90","","90","","90","","683.8","0.3","295","","295","","","","","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","Lanthanum Dimagnesium","","- La Mg2 -","- La Mg2 -","- La8 Mg16 -","8","0.0416667","BR6195","Belgacem, Besma; Yahyaoui, Samia; Demchenko, P. Yu.; Bodak, O. I.; Dusek, Michal; Petricek, Vaclav; Ben Hassen, Rached","Lanthanum dimagnesium","Acta Crystallographica Section E","2005","61","8","i155","i157","10.1107/S1600536805021343","","","0.71069","MoKα","","0.0093","0.0083","","","0.0242","0.0245","","","","","","1.14","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206345","8.5386","0.0006","10.6333","0.0007","11.8912","0.0006","105.636","0.003","101.852","0.003","99.257","0.003","990.39","0.11","273","1","","","","","","","","","","5","P -1","-P 1","2","","poly[penta-μ-aqua-tetraaqua-μ-decavanadato-lithium(I)disodium(I)]","","- H36 Li2 Na4 O46 V10 -","- H36 Li2 Na4 O46 V10 -","- H36 Li2 Na4 O46 V10 -","1","0.5","BR6199","Chun-An Ma; Ai-Li Xie; Lian-Bang Wang","Polymeric bis(lithium disodium nonahydrate) decavanadate, {[LiNa~2~(H~2~O)~9~]~2~[V~10~O~28~]}~<i>n~</i>","Acta Crystallographica Section E","2005","61","8","i185","i187","10.1107/S1600536805023123","","","0.7107","MoKα","","","0.027","","","","0.097","","","","","","1.016","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206346","4.7586","0.001","8.253","0.0017","10.758","0.002","90","","92.845","0.002","90","","421.98","0.15","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","dipotassium iron(III) {hydrogen bis[hydrogenphosphate(V)]} difluoride","","- F2 Fe H3 K2 O8 P2 -","- F2 Fe H3 K2 O8 P2 -","- F4 Fe2 H6 K4 O16 P4 -","2","0.5","BR6201","Mi, Jin-Xiao; Wang, Cheng-Xin; Wei, Zan-Bin; Chen, Fu-Jin; Xu, Chun-Yan; Mao, Shao-Yu","K~2~Fe[H(HPO~4~)~2~]F~2~","Acta Crystallographica Section E","2005","61","8","i143","i145","10.1107/S1600536805020635","","","0.71073","MoKα","","0.0232","0.0231","","","0.0636","0.0637","","","","","","1.272","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2206347","10.34657","0.00003","10.34657","0.00003","10.34657","0.00003","90","","90","","90","","1107.61","0.003","293","2","293","2","","","","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","","sodium cadmium dizinc heptafluoride","","- Cd F7 Na Zn2 -","- Cd F7 Na Zn2 -","- Cd8 F56 Na8 Zn16 -","8","0.0416667","BR6202","Friese, K.; Grzechnik, A.; Morgenroth, W.; Buth, G.; Doyle, S.; Gesland, J.-Y.","Synchrotron study of pyrochlore-related NaCdZn~2~F~7~","Acta Crystallographica, Section E","2005","61","8","i182","i184","10.1107/S160053680502297X","","","0.45","synchrotron","","0.0393","0.0317","","","0.023","0.0393","","","","","","2.3","","","","has coordinates","282068","2023-03-26","10:12:38",""
"2206348","19.6816","0.0015","7.2656","0.0006","12.571","0.0015","90","","117.82","0.01","90","","1589.9","0.3","150","","150","","","","","","","","Synthetic","4","C 1 2/c 1","-C 2yc","15","","Potassium sodium phyllosilicate","","- K1.33 Na0.67 O5 Si2 -","- K1.33333 Na0.666667 O5 Si2 -","- K16 Na8 O60 Si24 -","12","1.5","BR6203","Spek, Anthony L.; Jong, Bernard H. W. S. de","Potassium sodium phyllosilicate, K~1.33~Na~0.67~Si~2~O~5~","Acta Crystallographica Section E","2005","61","8","i188","i190","10.1107/S1600536805022348","","","0.71073","MoKα","","0.0633","0.0427","","","0.1075","0.1179","","","","","","1.091","","","","has coordinates,has Fobs","282068","2023-03-26","10:12:38",""
"2206349","4.4474","0.0008","4.4474","0.0008","10.73","0.004","90","","90","","90","","212.23","0.1","120","2","120","2","","","","","","","Synthetic","2","I 4/m m m","-I 4 2","139","Strontium tetragallide","Strontium tetragallide","","- Ga4 Sr -","- Ga4 Sr -","- Ga8 Sr2 -","2","0.0625","BR6204","Tobash, Paul H.; Yamasaki, Yuki; Bobev, Svilen","Strontium tetragallide","Acta Crystallographica Section E","2005","61","8","i174","i176","10.1107/S1600536805022439","","","0.71073","MoKα","","0.0189","0.017","","","0.0419","0.0424","","","","","","1.026","","","","has coordinates,has Fobs","282548","2023-04-10","20:38:56",""
"2206350","10.9614","0.0012","16.1352","0.0017","22.026","0.002","98.832","0.002","94.633","0.003","103.5","0.002","3715.4","0.7","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","bis{bis[2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18- triene]potassium(I)} bis(2-thioxo-4,5-dihydro-1,3-dithiole-4,5-dithiolato)zinc(II)","","- C62 H80 K2 O20 S10 Zn -","- C62 H80 K2 O20 S10 Zn -","- C124 H160 K4 O40 S20 Zn2 -","2","1","BR6206","Jie Liu; Jun-Hong Zhang; Da-Qi Wang; Jian-Min Dou","Bis{bis[2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene]potassium(I)} bis(2-thioxo-4,5-dihydro-1,3-dithiole-4,5-dithiolato)zinc(II)","Acta Crystallographica Section E","2005","61","8","m1652","m1654","10.1107/S1600536805023536","","","0.71073","MoKα","","0.153","0.0507","","","0.0543","0.0665","","","","","","0.813","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206351","8.1696","0.0006","12.4578","0.0008","14.8541","0.0009","101.277","0.004","90.134","0.005","96.332","0.005","1473.1","0.17","298","2","298","2","","","","","","","","6","P -1","-P 1","2","Ditalimphos","O,O-Diethyl phthalimidophosphonothioate","","- C12 H14 N O4 P S -","- C12 H14 N O4 P S -","- C48 H56 N4 O16 P4 S4 -","4","2","BT6684","Baughman, Russell G.; Paulos, Chrystal M.","<i>O</i>,<i>O</i>-Diethyl phthalimidophosphonothioate (Ditalimphos)","Acta Crystallographica Section E","2005","61","8","o2352","o2353","10.1107/S1600536805019872","","","0.71073","MoKα","","0.0962","0.0635","","","0.1749","0.2003","","","","","","1.023","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206352","14.4439","0.0011","8.6837","0.0006","14.0031","0.001","90","","111.251","0.009","90","","1636.9","0.2","291","0.3","291","0.3","","","","","","","","4","C 1 2/c 1","-C 2yc","15","6-nitro-2,3-xylidine","2,3-dimethyl-6-nitroaniline","","- C8 H10 N2 O2 -","- C8 H10 N2 O2 -","- C64 H80 N16 O16 -","8","1","BT6688","Kruszynski, Rafal","Stacking and N—H···O interactions in 2,3-dimethyl-6-nitroaniline","Acta Crystallographica Section E","2005","61","8","o2379","o2381","10.1107/S1600536805020684","","","0.71073","MoKα","","0.0639","0.054","","","0.153","0.1634","","","","","","1.167","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206353","12.242","0.006","5.177","0.003","22.376","0.011","90","","105.181","0.007","90","","1368.6","1.2","566","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Benzyl 5-bromo-4-methylsalicylate","","- C15 H13 Br O3 -","- C15 H13 Br O3 -","- C60 H52 Br4 O12 -","4","1","BT6689","Ning-Juan Fan; Yi-Bin Wei; Xiao-Hua Pu; Wei Guo","Benzyl 5-bromo-4-methylsalicylate","Acta Crystallographica Section E","2005","61","8","o2393","o2394","10.1107/S1600536805020696","","","0.71073","MoKα","","0.0684","0.0442","","","0.099","0.1062","","","","","","1.035","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206354","9.9316","0.0007","10.2786","0.0005","14.5778","0.001","75.785","0.004","83.778","0.006","85.529","0.006","1432.05","0.16","150","2","150","2","","","","","","","","4","P -1","-P 1","2","(oxydi-2,1-phenylen)bis(phenylphosphine) oxide","2-(Diphenylphosphino)phenyl 2-(diphenylphosphinoyl)phenyl ether","","- C36 H28 O2 P2 -","- C36 H28 O2 P2 -","- C72 H56 O4 P4 -","2","1","BT6691","Tooke, Duncan M.; Wilting, Jos; Vogt, Dieter; Spek, Anthony L.","2-(Diphenylphosphino)phenyl 2-(diphenylphosphinoyl)phenyl ether","Acta Crystallographica Section E","2005","61","8","o2406","o2407","10.1107/S1600536805020805","","","0.71073","MoKα","","0.0562","0.0389","","","0.0899","0.0983","","","","","","1.037","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206355","24.139","0.002","8.3588","0.0006","11.8747","0.0012","90","","110.014","0.008","90","","2251.3","0.4","296","","296","","","","","","","","","6","C 1 c 1","C -2yc","9","","O,O-Bis(2-tert-butyl-4-methylphenyl) chlorothiophosphonate","","- C22 H30 Cl O2 P S -","- C22 H30 Cl O2 P S -","- C88 H120 Cl4 O8 P4 S4 -","4","1","BT6693","Odabas̨oǧlu, Mustafa; Büyükgüngör, Orhan; Albayrak, Çiǧdem","<i>O</i>,<i>O</i>-Bis(2-<i>tert</i>-butyl-4-methylphenyl) chlorothiophosphonate","Acta Crystallographica Section E","2005","61","8","o2525","o2527","10.1107/S1600536805021859","","","0.71073","MoKα","","0.0683","0.0354","","","0.0799","0.0904","","","","","","0.86","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206356","23.592","0.003","8.3111","0.0006","12.5067","0.0014","90","","105.74","0.009","90","","2360.3","0.4","150","","150","","","","","","","","","6","C 1 c 1","C -2yc","9","","O,O-Bis(2-tert-butyl-4-methoxyphenyl) chlorothiophosphonate","","- C22 H30 Cl O4 P S -","- C22 H30 Cl O4 P S -","- C88 H120 Cl4 O16 P4 S4 -","4","1","BT6694","Odabas̨oǧlu, Mustafa; Büyükgüngör, Orhan; Albayrak, Çiǧdem","<i>O</i>,<i>O</i>-Bis(2-<i>tert</i>-butyl-4-methoxyphenyl) chlorothiophosphonate","Acta Crystallographica Section E","2005","61","8","o2528","o2530","10.1107/S1600536805021860","","","0.71073","MoKα","","0.0303","0.0267","","","0.0716","0.0735","","","","","","1.115","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206357","10.6925","0.0016","14.875","0.002","17.2342","0.0008","90","","94.742","0.007","90","","2731.7","0.6","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","tetra-n-butylammonium (imidazolidine-2-thione-2κS)dioxo-1κ^2^O-di-μ-sulfido-1:2κ^4^S:S- copper(I)tungstate(VI)","","- C19 H42 Cu N3 O2 S3 W -","- C19 H42 Cu N3 O2 S3 W -","- C76 H168 Cu4 N12 O8 S12 W4 -","4","1","BT6695","Beheshti, Azizolla; Clegg, William; Dale, Sophie H.; Solimankhani, Ahmad","N—H···S and N—H···O hydrogen bonding in tetra-<i>n</i>-butylammonium (imidazolidine-2-thione-2κ<i>S</i>)dioxo-1κ^2^<i>O</i>-di-μ-sulfido-1:2κ^4^<i>S</i>:<i>S</i>-copper(I)tungstate(VI)","Acta Crystallographica Section E","2005","61","8","m1509","m1511","10.1107/S1600536805021628","","","0.71073","MoKα","","0.0524","0.0329","","","0.0664","0.0735","","","","","","1.074","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206358","37.007","0.004","7.7558","0.0008","17.214","0.002","90","","105.503","0.002","90","","4761","0.9","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-hydroxy-1-[2-(2-methyl-4-oxo-3,4,6,7,8,9- hexahydro-2H-pyrido[1,2-a]pyrimidin-3-yl)ethyl]piperidine N-oxide","","- C24 H33 F N4 O6 -","- C24 H33 F N4 O6 -","- C192 H264 F8 N32 O48 -","8","1","BT6696","K. Ravikumar; B. Sridhar; S. G. Manjunath; Saji Thomas","Risperidone <i>N</i>-oxide hydrogen peroxide methanol solvate","Acta Crystallographica Section E","2005","61","8","o2515","o2517","10.1107/S1600536805022002","","","0.71073","MoKα","","0.0628","0.054","","","0.1443","0.1564","","","","","","1.076","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206359","12.1813","0.0009","30.862","0.002","7.7875","0.0006","90","","93.4","0.002","90","","2922.5","0.4","130","2","130","2","","","","","","","","5","P 1 21 1","P 2yb","4","brucinium toluene-4-sulfonate trihydrate","2,3-dimethoxy-10-oxostrychnidinium toluene-4-sulfonate trihydrate","","- C30 H40 N2 O10 S -","- C30 H40 N2 O10 S -","- C120 H160 N8 O40 S4 -","4","2","BT6697","Graham Smith; Urs D. Wermuth; Peter C. Healy; David J. Young; Jonathan M. White","Brucinium toluene-4-sulfonate trihydrate at 130 K","Acta Crystallographica Section E","2005","61","8","o2646","o2648","10.1107/S1600536805022695","","","0.71073","MoKα","","0.0765","0.0495","","","0.0804","0.0879","","","","","","0.844","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206360","10.3359","0.0001","13.8339","0.0003","16.2254","0.0004","101.153","0.001","90.934","0.001","108.687","0.001","2148.53","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","10-Benzyl-3,3,6,6,9-pentamethyl-3,4,6,7,9,10-hexahydroacridine- 1,8(2H,5H)-dione","","- C25 H31 N O2 -","- C25 H31 N O2 -","- C100 H124 N4 O8 -","4","2","BT6699","M. Yogavel; D. Velmurugan; P. Murugan; S. Shanmuga Sundara Raj; H.-K. Fun","10-Benzyl-3,3,6,6,9-pentamethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2<i>H</i>,5<i>H</i>)-dione","Acta Crystallographica Section E","2005","61","8","o2761","o2763","10.1107/S1600536805023500","","","0.71073","MoKα","","0.1164","0.065","","","0.1599","0.1968","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206361","9.969","0.002","13.8855","0.0018","10.2272","0.0017","90","","98.704","0.016","90","","1399.4","0.4","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","thiocytosinium chloride","","","- C4 H6 Cl N3 S -","- C4 H6 Cl N3 S -","- C32 H48 Cl8 N24 S8 -","8","2","BT6701","Prugovečki, Biserka; Matković-Čalogović, Dubravka; Sanković, Krešimir","2-Thiocytosinium chloride","Acta Crystallographica Section E","2005","61","8","o2706","o2708","10.1107/S1600536805023445","","","0.71073","MoKα","","0.0574","0.037","","","0.099","0.1073","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206362","9.2565","0.001","11.2224","0.0012","12.0629","0.0013","63.164","0.002","87.485","0.002","83.735","0.002","1111.4","0.2","273","2","273","2","","","","","","","","5","P -1","-P 1","2","Olanzapinium nicotinate","1-methyl-4-(2-methyl-10H-thieno[2,3-b][1,5]benzodiazepin-4- yl)hexahydropyrazin-1-ium nicotinate","","- C23 H25 N5 O2 S -","- C23 H25 N5 O2 S -","- C46 H50 N10 O4 S2 -","2","1","BT6703","K. Ravikumar; G. Y. S. K. Swamy; B. Sridhar; S. Roopa","Olazipinium nicotinate","Acta Crystallographica Section E","2005","61","8","o2720","o2723","10.1107/S160053680502369X","","","0.71073","MoKα","","0.0884","0.0629","","","0.13","0.1407","","","","","","1.062","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206363","10.244","0.005","10.601","0.005","11.404","0.005","64.499","0.005","74.587","0.005","89.556","0.005","1069.5","0.9","296","","296","","","","","","","","","3","P -1","-P 1","2","","1-Benzyl-2-[1-(5-methyl-1H-pyrazol-3-yl)-2-phenylethyl]benzimidazole","","- C26 H24 N4 -","- C26 H24 N4 -","- C52 H48 N8 -","2","1","BT6704","Mehmet Akkurt; Şerife Pınar; Rachid Bouhfid; Ahmed Moussaif; El-Mokhtar Essassi; Orhan Büyükgüngör","1-Benzyl-2-[1-(5-methyl-1<i>H</i>-pyrazol-3-yl)-2-phenylethyl]benzimidazole","Acta Crystallographica, Section E","2005","61","8","o2718","o22719","10.1107/S1600536805023706","","","0.71073","MoKα","","0.0739","0.0461","","","0.1189","0.1303","","","","","","1.034","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2206364","10.1025","0.0006","17.3954","0.0011","20.3856","0.0013","102.267","0.005","103.752","0.005","93.744","0.005","3375","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Lithium‒tetrakis(pentafluorophenyl)borate‒benzene (1/1/2)","","- C36 H12 B F20 Li -","- C35.9995 H12 B F20 Li -","- C143.998 H48 B4 F80 Li4 -","4","2","BV6022","Bolte, Michael; Ruderfer, Ilya; Müller, Thomas","Lithium‒tetrakis(pentafluorophenyl)borate‒benzene (1/1/2)","Acta Crystallographica Section E","2005","61","8","m1581","m1582","10.1107/S1600536805022336","","","0.71073","MoKα","","0.1219","0.0939","","","0.2245","0.2458","","","","","","1.078","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2206365","6.0018","0.0002","8.0384","0.0003","12.4802","0.0003","90","","95.5132","0.0017","90","","599.32","0.03","150","","150","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C5 H8 O3 -","- C5 H8 O3 -","- C20 H32 O12 -","4","1","CF6428","Shallard-Brown, Howard A.; Watkin, David J.; Cowley, Andrew R.","Methyl acetoacetate at 150 K","Acta Crystallographica Section E","2005","61","8","o2422","o2423","10.1107/S1600536805017654","","","0.71073","MoKα","","0.0417","0.0363","","0.0954","0.0924","0.0954","","","","","","1.0074","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206366","8.8118","0.0018","12.43","0.003","18.031","0.004","90","","97.749","0.002","90","","1956.9","0.8","293.2","0.2","293.2","0.2","","","","","","","","4","P 1 21 1","P 2yb","4","","4-{[(2-alanine methyl ester)amino](phenyl)methylidene} -3-methyl-1-phenylpyrazol-5-one","","- C21 H21 N3 O3 -","- C21 H21 N3 O3 -","- C84 H84 N12 O12 -","4","2","CF6431","Zhu, Hualing; Zhang, Xin; Song, Yujing; Xu, Haizhen; Dong, Mei","4-{[1-(Methoxycarbonyl)ethylamino](phenyl)methylidene}-3-methyl-1-phenyl-1<i>H</i>-pyrazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2005","61","8","o2387","o2388","10.1107/S1600536805020349","","","0.71073","MoKα","","0.091","0.042","","","0.0933","0.1098","","","","","","1.057","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206367","17.572","0.003","9.588","0.005","30.126","0.003","90","","96.6","0.02","90","","5042","3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tetrasodium bis[tris(salicylato)titanate(IV)] undecahydrate, Na~4~[Ti(C~7~O~3~H~4~)~3~]~2~.11H~2~O","","- C21 H23 Na2 O14.5 Ti -","- C21 H12 Na2 O14.5 Ti -","- C168 H96 Na16 O116 Ti8 -","8","2","CF6434","Raja Dey; Kakoli Mukharjee; Vratislav Langer; Priyobroto Roychowdhury","A titanium salicylate, Na~4~[Ti(C~7~H~4~O~3~)~3~]~2~·11H~2~O","Acta Crystallographica Section E","2005","61","8","m1495","m1497","10.1107/S1600536805021276","","","0.71073","MoKα","","0.1468","0.0627","","","0.1509","0.17","","","","","","0.934","","","","has coordinates,has Fobs","283803","2023-05-16","08:05:53",""
"2206368","9.263","0.002","10.308","0.003","10.974","0.003","90","","112.872","0.003","90","","965.4","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-benzoyl alanine","","- C10 H11 N O3 -","- C10 H11 N O3 -","- C40 H44 N4 O12 -","4","1","CF6435","Ai-Yun Fu; Da-Qi Wang","<i>N</i>-Benzoylalanine","Acta Crystallographica Section E","2005","61","8","o2336","o2337","10.1107/S1600536805020283","","","0.71073","MoKα","","0.0579","0.0486","","","0.1359","0.1443","","","","","","1.078","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206369","13.624","0.002","10.188","0.001","24.248","0.003","90","","98.53","0.01","90","","3328.4","0.7","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","4'-Hydroxy-4-methylstilbazolium tetraphenylborate dimethyl sulfoxide solvate","4'-Hydroxy-4-methylstilbazolium tetraphenylborate dimethyl sulfoxide solvate","","- C40 H40 B N O2 S -","- C40 H40 B N O2 S -","- C160 H160 B4 N4 O8 S4 -","4","1","CF6436","Wen Yang; Shu-Jin Li; De-Chun Zhang","4'-Hydroxy-4-methylstilbazolium tetraphenylborate dimethyl sulfoxide solvate","Acta Crystallographica Section E","2005","61","8","o2461","o2463","10.1107/S1600536805021446","","","0.71073","MoKα","","0.0856","0.0463","","","0.1092","0.121","","","","","","0.935","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2206370","19.456","0.003","8.2838","0.0009","31.886","0.004","90","","101.212","0.004","90","","5041","1.1","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(R)-2,2'-Bis(diphenylphosphino)-6,6'-bis(tridecafluoro-n-hexyl)-1,1'-binaphthyl","","- C56 H30 F26 P2 -","- C56 H30 F26 P2 -","- C224 H120 F104 P8 -","4","0.5","CF6438","John Fawcett; Eric G. Hope; Alison M. Stuart; Andrew J. West","(<i>R</i>)-2,2'-Bis(diphenylphosphino)-6,6'-bis(tridecafluoro-<i>n</i>-hexyl)-1,1'-binaphthyl","Acta Crystallographica Section E","2005","61","8","o2484","o2485","10.1107/S1600536805021264","","","0.71073","MoKα","","0.0679","0.0582","","","0.1658","0.1736","","","","","","1.034","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206371","11.656","0.003","7.326","0.002","14.012","0.002","90","","109.09","0.01","90","","1130.7","0.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(ethanol)(μ~3~-N-salicyclideneglycinato)nickel(II)","","- C11 H13 N Ni O4 -","- C11 H13 N Ni O4 -","- C44 H52 N4 Ni4 O16 -","4","1","CF6439","Yu-Zhou Yuan; Jian Zhou; Dong-Qing Li; Xing Liu; Zhen-Feng Chen; Kai-Bei Yu","The two-dimensional network polymer of (ethanol)(μ~3~-<i>N</i>-salicyclideneglycinato)nickel(II)","Acta Crystallographica Section E","2005","61","8","m1444","m1446","10.1107/S1600536805020593","","","0.71073","MoKα","","0.046","0.0342","","","0.0862","0.0898","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206372","5.9422","0.0002","28.3304","0.001","7.9071","0.0003","90","","90","","90","","1331.12","0.08","120","","120","","","","","","","","","5","P n a 21","P 2c -2n","33","p-bromophenyl p-toluenesulfonate","4-bromophenyl 4-toluenesulfonate","","- C13 H11 Br O3 S -","- C13 H11 Br O3 S -","- C52 H44 Br4 O12 S4 -","4","1","CF6440","Vadivelu Manivannan; Nagarajan Vembu; Maruthai Nallu; Kandasamy Sivakumar; Frank R. Fronczek","4-Bromophenyl 4-toluenesulfonate: supramolecular aggregation through weak C—H···O and C—H···π interactions","Acta Crystallographica Section E","2005","61","8","o2736","o2738","10.1107/S1600536805023810","","","0.71073","MoKα","","0.0366","0.0348","","","0.0926","0.0944","","","","","","1.044","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206373","7.6018","0.0005","7.7685","0.0005","11.6547","0.0007","77.106","0.003","81.047","0.003","64.506","0.003","604.19","0.07","293","2","293","2","","","","","","","","2","P -1","-P 1","2","2,3,3',4'-Tetramethylbiphenyl","2,3,3',4'-Tetramethylbiphenyl","","- C16 H18 -","- C16 H18 -","- C32 H36 -","2","1","CF6441","Andrew J. Robertson; Daniel J. Price","2,3,3',4'-Tetramethylbiphenyl","Acta Crystallographica Section E","2005","61","8","o2610","o2612","10.1107/S1600536805022476","","","0.71073","MoKα","","0.0861","0.0489","","","0.1113","0.1266","","","","","","1.043","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206374","16.043","0.003","10.536","0.002","15.647","0.003","90","","104.31","0.03","90","","2562.7","0.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Dichlorobis[2-(o-tolyliminomethyl)phenolato]copper(II)","","- C28 H26 Cl2 Cu N2 O2 -","- C28 H26 Cl2 Cu N2 O2 -","- C112 H104 Cl8 Cu4 N8 O8 -","4","0.5","CF6444","Yang, Yu-Min","Dichlorobis[2-(<i>o</i>-tolyliminomethyl)phenolato]copper(II)","Acta Crystallographica Section E","2005","61","8","m1616","m1617","10.1107/S1600536805023305","","","0.71073","MoKα","","0.1305","0.0568","","","0.1114","0.1381","","","","","","0.952","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206375","10.323","0.002","10.63","0.002","11.018","0.002","90","","111.71","0.03","90","","1123.3","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(meso-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane)zinc(II) diperchlorate","","- C16 H32 Cl2 N4 O8 Zn -","- C16 H32 Cl2 N4 O8 Zn -","- C32 H64 Cl4 N8 O16 Zn2 -","2","0.5","CF6445","Yang, Yu-Min","(<i>meso</i>-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane)zinc(II) diperchlorate","Acta Crystallographica Section E","2005","61","8","m1618","m1619","10.1107/S1600536805023317","","","0.71073","MoKα","","0.0478","0.0441","","","0.1063","0.1086","","","","","","1.144","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206376","17.2952","0.0002","10.7468","0.0002","20.4914","0.0004","90","","100.786","0.0005","90","","3741.4","0.11","190","","190","","","","","","","","","4","P 1 21 1","P 2yb","4","","Isopropyl 2,5-anhydro-3,4-di-O-tert-butyldiphenylsilyl-L-ribonate","","- C40 H50 O5 Si2 -","- C40 H50 O5 Si2 -","- C160 H200 O20 Si8 -","4","2","CF6446","Andreas F. G. Glawar; David J. Watkin; Gangadhar J. Sanjayan; George E. Tranter; Alison A. Edwards; George W. J. Fleet","Isopropyl 2,5-anhydro-3,4-di-<i>O</i>-<i>tert</i>-butyldiphenylsilyl-<small>L</small>-ribonate","Acta Crystallographica Section E","2005","61","8","o2724","o2726","10.1107/S1600536805023822","","","0.71073","MoKα","","0.05","0.05","","0.096","0.096","0.096","","","","","","0.9663","","","","has coordinates,has disorder,has Fobs","201973","2020-10-21","18:00:00",""
"2206377","10.4312","0.0003","5.4469","0.0001","13.0536","0.0005","90","","93.4825","0.001","90","","740.31","0.04","190","","190","","","","","","","","","4","P 1 21 1","P 2yb","4","","(2R,3S,4S,5R)-Methyl 5-cyano-2,3:4,5-di-O-isopropylidene-2,3,4,5- tetrahydroxypentanoate","","- C13 H19 N O6 -","- C13 H19 N O6 -","- C26 H38 N2 O12 -","2","1","CF6447","Andreas Glawar; Benjamin A. Mayes; David Watkin; George W. J. Fleet","(2<i>R</i>,3<i>S</i>,4<i>S</i>,5<i>R</i>)-Methyl 5-cyano-2,3:4,5-di-<i>O</i>-isopropylidene-2,3,4,5-tetrahydroxypentanoate","Acta Crystallographica Section E","2005","61","8","o2727","o2729","10.1107/S1600536805023834","","","0.71073","MoKα","","0.0318","0.0318","","0.0693","0.0693","0.0693","","","","","","0.9885","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206378","7.691","0.002","14.882","0.004","16.948","0.005","77.2","0.014","77.262","0.014","80.658","0.014","1831.9","0.9","123.1","","","","","","","","","","","4","P -1","-P 1","2","","2-Amino-5-[4-(octylamino)phenyl]cyclohepta-2,4,6-trien-1-one","","- C21 H28 N2 O -","- C21 H28 N2 O -","- C84 H112 N8 O4 -","4","2","CF6449","Kubo, Kanji; Matsumoto, Taisuke; Katahira, Kouki; Mori, Akira","2-Amino-5-[4-(octylamino)phenyl]cyclohepta-2,4,6-trien-1-one","Acta Crystallographica Section E","2005","61","8","o2750","o2752","10.1107/S1600536805023792","","","0.7107","MoKα","","","0.0712","","","","0.2016","","","","","","1","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206379","13.4594","0.001","9.8855","0.0005","14.0878","0.0011","90","","91.08","0.006","90","","1874.1","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-[3-Methyl-3-(2,4,6-trimethylphenyl)cyclobutyl]-2-(thiomorpholin-4-yl)ethanone","","- C20 H29 N O S -","- C20 H29 N O S -","- C80 H116 N4 O4 S4 -","4","1","CI6593","Hanife Saraçoĝlu; Serkan Soylu; Nezihe Çalıs̨kan; Alaaddin Çukurovali; Ibrahim Yilmaz; Cavit Kazaz","1-[3-Methyl-3-(2,4,6-trimethylphenyl)cyclobutyl]-2-(thiomorpholin-4-yl)ethanone","Acta Crystallographica Section E","2005","61","8","o2401","o2402","10.1107/S1600536805020994","","","0.71073","MoKα","","0.0755","0.0489","","","0.1345","0.1463","","","","","","1.173","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206380","12.3572","0.0017","12.6676","0.0011","15.874","0.003","90","","90","","90","","2484.9","0.6","297","2","297","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(9R,13R,14R)-7-(E)-Benzylidene-14-hydroxy-3,4-dimethoxy-17-methylmorphinan-6-one","","- C29 H33 N O4 -","- C29 H33 N O4 -","- C116 H132 N4 O16 -","4","1","CI6602","Parrish, Damon A.; Thatcher, Linn N.; Wu, Hui-Fang; Coop, Andrew; Deschamps, Jeffrey R.","(9<i>R</i>,13<i>R</i>,14<i>R</i>)-7-(<i>E</i>)-Benzylidene-14-hydroxy-3,4-dimethoxy-17-methylmorphinan-6-one","Acta Crystallographica Section E","2005","61","8","o2617","o2618","10.1107/S1600536805019987","","","1.54178","CuKα","","0.0654","0.0533","","","0.1373","0.1475","","","","","","1.043","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206381","8.6283","0.0003","10.6995","0.0004","11.0065","0.0004","100.161","0.001","94.482","0.001","103.168","0.001","966.42","0.06","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","1,4,8,11-Tetrakis(carboxymethyl)-5,5,7,12,12,14-hexamethyl-1,4,8,11- tetraazoniacyclotetradecane tetrachloride octahydrate","","- C24 H64 Cl4 N4 O16 -","- C24 H64 Cl4 N4 O16 -","- C24 H64 Cl4 N4 O16 -","1","0.5","CI6606","Wang, Shi-Fan; Li, Huan-Qiu; Ruan, Ban-Feng; Zhu, Hai-Liang; Ng, Seik Weng","1,4,8,11-Tetrakis(carboxymethyl)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazoniacyclotetradecane tetrachloride octahydrate","Acta Crystallographica Section E","2005","61","8","o2413","o2414","10.1107/S1600536805020817","","","0.71073","MoKα","","0.045","0.044","","","0.12","0.121","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206382","9.1863","0.0006","13.8653","0.0009","19.987","0.001","90","","93.604","0.001","90","","2540.7","0.3","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane-1,8- diacetato)nickel(II) tetrahydrate","","- C20 H46 N4 Ni O8 -","- C20 H46 N4 Ni O8 -","- C80 H184 N16 Ni4 O32 -","4","1","CI6607","Wang, Shi-Fan; Xue, Jia-Yu; Shi, Lei; Zhu, Hai-Liang; Ng, Seik Weng","(5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane-1,8-diacetato)nickel(II) tetrahydrate","Acta Crystallographica Section E","2005","61","8","m1481","m1483","10.1107/S1600536805021033","","","0.71073","MoKα","","0.062","0.055","","","0.135","0.139","","","","","","1.15","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206383","5.6856","0.0008","10.9674","0.001","20.704","0.003","90","","92.306","0.012","90","","1290","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 4-chloro-3-oxo-2-(phenylhydrazono)butyrate","","- C12 H13 Cl N2 O3 -","- C12 H13 Cl N2 O3 -","- C48 H52 Cl4 N8 O12 -","4","1","CI6608","Alpaslan, Gökhan; Özdamar, Özgür; Odabas̨oǧlu, Mustafa; Ersanlı, Cem Cüneyt; Büyükgüngör, Orhan; Erdönmez, Ahmet","Ethyl 4-chloro-3-oxo-2-(phenylhydrazono)butyrate","Acta Crystallographica Section E","2005","61","8","o2428","o2430","10.1107/S1600536805021240","","","0.71073","MoKα","","0.07","0.035","","","0.083","0.092","","","","","","0.82","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2206384","12.34","0.002","8.7775","0.0014","17.678","0.003","90","","104.861","0.003","90","","1850.7","0.5","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(2-chlorophenyl)-N-(2-cyano-4-methyl-2-pentanyl)-5-methylisoxazole- 4-carboxamide","","- C18 H20 Cl N3 O2 -","- C18 H20 Cl N3 O2 -","- C72 H80 Cl4 N12 O8 -","4","1","CI6609","Bin Zhong; Zheng-Ming Li; Hai-Bin Song","3-(2-Chlorophenyl)-<i>N</i>-(2-cyano-4-methyl-2-pentyl)-5-methylisoxazole-4-carboxamide","Acta Crystallographica Section E","2005","61","8","o2621","o2622","10.1107/S1600536805022373","","","0.71073","MoKα","","0.0987","0.0451","","","0.1149","0.1496","","","","","","0.935","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206385","6.5207","0.0017","9.2488","0.0016","13.429","0.004","102.108","0.008","94.112","0.007","101.504","0.008","770.5","0.3","294","2","294","2","","","","","","","","3","P -1","-P 1","2","","1-[4-(4-Methylpyrimidin-2-yl)piperazin-1-ylmethyl]-1H-benzotriazole","","- C16 H19 N7 -","- C16 H19 N7 -","- C32 H38 N14 -","2","1","CI6611","Feng-Qi He; Bao-Lei Wang; Zheng-Ming Li; Hai-Bin Song","1-[4-(4-Methylpyrimidin-2-yl)piperazin-1-ylmethyl]-1<i>H</i>-benzotriazole","Acta Crystallographica Section E","2005","61","8","o2602","o2604","10.1107/S1600536805022208","","","0.71073","MoKα","","0.0774","0.0481","","","0.1169","0.1353","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206386","10.617","0.001","11.399","0.001","13.691","0.001","90","","94.133","0.001","90","","1652.6","0.2","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Methanol[4-nitro-2-(pyridin-2-ylmethyliminomethyl)phenolato](thiocyanato) zinc(II)","","- C15 H14 N4 O4 S Zn -","- C15 H14 N4 O4 S Zn -","- C60 H56 N16 O16 S4 Zn4 -","4","1","CI6613","You, Zhong-Lu","Methanol[4-nitro-2-(pyridin-2-ylmethyliminomethyl)phenolato](thiocyanato)zinc(II)","Acta Crystallographica Section E","2005","61","8","m1571","m1573","10.1107/S160053680502218X","","","0.71073","MoKα","","0.0446","0.0371","","","0.1034","0.1083","","","","","","1.045","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206387","10.371","0.003","16.447","0.004","11.07","0.003","90","","90","","90","","1888.2","0.9","298","2","298","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","[N,N'-Bis(3-methylsalicylidene)propane-1,3-diaminato]nickel(II) methanol solvate","","- C20 H24 N2 Ni O3 -","- C20 H24 N2 Ni O3 -","- C80 H96 N8 Ni4 O12 -","4","0.5","CI6614","You, Zhong-Lu","[<i>N</i>,<i>N</i>'-Bis(3-methylsalicylidene)propane-1,3-diaminato]nickel(II) methanol solvate","Acta Crystallographica Section E","2005","61","8","m1601","m1603","10.1107/S1600536805022956","","","0.71073","MoKα","","0.0721","0.0546","","","0.1499","0.1624","","","","","","1.062","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206388","12.5083","0.0015","6.9995","0.0005","17.885","0.002","90","","96.988","0.01","90","","1554.2","0.3","296","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(4-Chloro-2-nitrophenyl)-N-methyl-N'-(quinolin-4-ylmethylene)hydrazine","","- C17 H13 Cl N4 O2 -","- C17 H13 Cl N4 O2 -","- C68 H52 Cl4 N16 O8 -","4","1","CI6616","Karadayı, Nevzat; Aydemir, Ercan; Kazak, Canan; Kirpi, Erdoğan; Tuğcu, F. Tülay; Gümüs̨, M. Kemal; Kaban, S̨eniz","<i>N</i>-(4-Chloro-2-nitrophenyl)-<i>N</i>-methyl-<i>N</i>'-(quinolin-4-ylmethylene)hydrazine","Acta Crystallographica Section E","2005","61","8","o2671","o2673","10.1107/S1600536805023020","","","0.71073","MoKα","","0.1332","0.0441","","","0.059","0.067","","","","","","0.937","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206389","7.529","0.002","10.399","0.002","21.555","0.003","90","","90","","90","","1687.6","0.6","298","2","298","2","","","","","","","","5","A 21 a m","A -2 2a","36","[N,N'-Bis(3-methylsalicylidene)-1,3-propanediaminato]nickel(II)","{6,6'-Dimethyl-2,2'-[propane-1,3- diylbis(nitrilomethylidyne)]diphenolato}nickel(II)","","- C19 H20 N2 Ni O2 -","- C19 H20 N2 Ni O2 -","- C76 H80 N8 Ni4 O8 -","4","0.5","CI6619","You, Zhong-Lu","[<i>N</i>,<i>N</i>'-Bis(3-methylsalicylidene)-1,3-propanediaminato]nickel(II)","Acta Crystallographica Section E","2005","61","8","m1637","m1638","10.1107/S1600536805023470","","","0.71073","MoKα","","0.0384","0.035","","","0.085","0.0874","","","","","","1.047","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206390","10.045","0.002","10.247","0.002","11.261","0.002","111.134","0.002","112.428","0.003","99.831","0.003","933.3","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","9-(4-Bromophenyl)-3,3,7-trimethyl-3,4-dihydroacridin-1(2H)-one","","- C22 H20 Br N O -","- C22 H20 Br N O -","- C44 H40 Br2 N2 O2 -","2","1","CV6527","Shujiang Tu; Bo Jiang; Xiang Zou; Tuanjie Li","9-(4-Bromophenyl)-3,3,7-trimethyl-3,4-dihydroacridin-1(2<i>H</i>)-one","Acta Crystallographica Section E","2005","61","8","o2570","o2572","10.1107/S1600536805022270","","","0.71073","MoKα","","0.0466","0.0323","","","0.0788","0.0856","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206391","6.8616","0.0006","5.8084","0.0006","25.6901","0.0018","90","","90.733","0.008","90","","1023.79","0.16","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","L-Histidinium Sulfate","L-Histidinium sulfate","","- C6 H11 N3 O6 S -","- C6 H11 N3 O6 S -","- C24 H44 N12 O24 S4 -","4","2","CV6532","R. Praveen Kumar; S. Athimoolam; S. Asath Bahadur; R. K. Rajaram","<small>L</small>-Histidinium sulfate","Acta Crystallographica Section E","2005","61","8","o2419","o2421","10.1107/S1600536805021021","","","0.71073","MoKα","","0.0632","0.0467","","","0.1302","0.1891","","","","","","1.151","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206392","17.7114","0.0013","7.8569","0.0006","14.3048","0.001","90","","110.589","0.001","90","","1863.5","0.2","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-(p-Bromophenyl)-5-tosylperhydropyrrolo[3,4-b]pyrrole","","- C19 H21 Br N2 O2 S -","- C19 H21 Br N2 O2 S -","- C76 H84 Br4 N8 O8 S4 -","4","1","CV6533","S. Selvanayagam; D. Velmurugan; K. Ravikumar; M. Poornachandran; R. Raghunathan","1-(<i>p</i>-Bromophenyl)-5-<i>p</i>-tosylperhydropyrrolo[3,4-<i>b</i>]pyrrole","Acta Crystallographica Section E","2005","61","8","o2493","o2495","10.1107/S1600536805021665","","","0.71073","MoKα","","0.0557","0.0391","","","0.1074","0.1183","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206393","11.777","0.001","13.507","0.003","15.141","0.005","90","","95.81","0.02","90","","2396.1","1","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Di-μ-chloro-bis[bis(cumylcyclopentadienyl)yttrium(III)]","","- C56 H60 Cl2 Y2 -","- C56 H60 Cl2 Y2 -","- C112 H120 Cl4 Y4 -","2","0.5","CV6537","Antonella Caterina Boccia; Fabia Grisi; Roberto Centore; Angela Tuzi","Di-μ-chloro-bis[bis(cumylcyclopentadienyl)yttrium(III)]","Acta Crystallographica Section E","2005","61","8","m1449","m1451","10.1107/S1600536805020556","","","0.71069","MoKα","","0.1178","0.0511","","","0.0787","0.0913","","","","","","1.024","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206394","10.943","0.004","13.777","0.005","7.514","0.003","90","","90","","90","","1132.8","0.7","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","1-(4-Methylphenyl)-3-(1H-1,2,4-triazol-1-yl)propan-1-one","","- C12 H13 N3 O -","- C12 H13 N3 O -","- C48 H52 N12 O4 -","4","1","CV6538","Jun Wan; Chun-Li Li; Xue-Mei Li; Shi-Ying Wang; Shu-Sheng Zhang","1-(4-Methylphenyl)-3-(1<i>H</i>-1,2,4-triazol-1-yl)propan-1-one","Acta Crystallographica Section E","2005","61","8","o2391","o2392","10.1107/S1600536805020568","","","0.71073","MoKα","","0.0581","0.0368","","","0.1041","0.1075","","","","","","1.139","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206395","6.478","0.0001","16.309","0.0002","26.245","0.0005","90","","90","","90","","2772.78","0.08","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(3S,5S,10S,13S,14S,17S)-Methyl l3β-acetyl-25,26,27-trisnorlanost-8-en-24-oate","","- C30 H48 O4 -","- C30 H48 O4 -","- C120 H192 O16 -","4","1","CV6539","Mazoir, N.; Giorgi, M.; Auhmani, A.","(3<i>S</i>,5<i>S</i>,10<i>S</i>,13<i>S</i>,14<i>S</i>,17<i>S</i>)-Methyl 3β-acetyl-25,26,27-trisnorlanost-8-en-24-oate","Acta Crystallographica Section E","2005","61","8","o2382","o2383","10.1107/S1600536805020726","","","0.71073","MoKα","","0.0888","0.0641","","","0.1522","0.1729","","","","","","1.054","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206396","7.8486","0.0013","6.8254","0.0012","28.771","0.005","90","","90","","90","","1541.3","0.5","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","N,N'-dibenzoylpiperazine","","- C18 H18 N2 O2 -","- C18 H18 N2 O2 -","- C72 H72 N8 O8 -","4","0.5","CV6540","Zheng, Peng-Wu; Wang, Wei; Duan, Xue-Min","<i>N</i>,<i>N</i>'-Dibenzoylpiperazine","Acta Crystallographica Section E","2005","61","8","o2513","o2514","10.1107/S160053680502088X","","","0.71073","MoKα","","0.0576","0.0382","","","0.0941","0.1062","","","","","","1.02","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206397","15.043","0.002","4.9119","0.0007","17.1097","0.0017","90","","123.848","0.008","90","","1050","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Acetonyl morpholine-4-carbodithioate","","- C8 H13 N O2 S2 -","- C8 H13 N O2 S2 -","- C32 H52 N4 O8 S8 -","4","1","CV6541","Jun Wan; Chun-Li Li; Xue-Mei Li; Shu-Sheng Zhang","Acetonyl morpholine-4-carbodithioate","Acta Crystallographica Section E","2005","61","8","o2426","o2427","10.1107/S1600536805020891","","","0.71073","MoKα","","0.0378","0.0335","","","0.0951","0.0992","","","","","","1.065","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206398","5.0999","0.0008","4.6273","0.0008","15.0106","0.0019","90","","107.093","0.005","90","","338.58","0.09","298","2","298","2","","","","","","","","4","P 1 c 1","P -2yc","7","","1-(Carboxymethyl)uracil","","- C6 H6 N2 O4 -","- C6 H6 N2 O4 -","- C12 H12 N4 O8 -","2","1","CV6542","Jing Xiong; Miao-Chang Liu; Ji-Xin Yuan","1-(Carboxymethyl)uracil","Acta Crystallographica Section E","2005","61","8","o2665","o2667","10.1107/S1600536805022774","","","0.71073","MoKα","","0.0675","0.0659","","","0.1472","0.1481","","","","","","1.265","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206399","10.9594","0.0012","8.7222","0.0009","11.5783","0.0012","90","","113.136","0.002","90","","1017.76","0.19","292","2","292","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Di-μ-oxo-bis[(histidinato-κ^3^N,N,O)oxomolybdenum(V)] trihydrate","","- C12 H22 Mo2 N6 O11 -","- C12 H22 Mo2 N6 O11 -","- C24 H44 Mo4 N12 O22 -","2","1","CV6543","Ping-Fan Wu; Dong-Sheng Li; Xiang-Gao Meng; Xiao-Lin Zhong; Jiang Chao; Yu-Lin Zhu; Yong-Ge Wei","Di-μ-oxo-bis[(histidinato-κ^3^<i>N</i>,<i>N</i>,<i>O</i>)oxomolybdenum(V)] trihydrate","Acta Crystallographica Section E","2005","61","8","m1553","m1555","10.1107/S1600536805021732","","","0.71073","MoKα","","0.02","0.0198","","","0.0485","0.0486","","","","","","1.126","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206400","9.2334","0.0009","9.3684","0.001","11.3028","0.0012","99.895","0.008","90.607","0.008","95.637","0.008","958.14","0.17","100","","100","","","","","","","","","5","P -1","-P 1","2","","1-Benzyl-3-(2-phenethyl)benzimidazolium bromide monohydrate","","- C22 H22 Br N2 O -","- C22 H22 Br N2 O -","- C44 H44 Br2 N4 O2 -","2","1","CV6545","Mehmet Akkurt; Selvi Karaca; Hasan Küçükbay; Ersin Orhan; Orhan Büyükgüngör","1-Benzyl-3-(2-phenethyl)benzimidazolium bromide monohydrate","Acta Crystallographica Section E","2005","61","8","o2452","o2454","10.1107/S1600536805021653","","","0.71073","MoKα","","0.0394","0.0371","","","0.0981","0.1","","","","","","1.09","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206401","5.133","0.003","5.866","0.003","12.202","0.006","90","","99.779","0.007","90","","362.1","0.3","150","2","150","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","Mercury(I) acetate","Mercury(I) acetate","","- C2 H3 Hg O2 -","- C2 H3 Hg O2 -","- C8 H12 Hg4 O8 -","4","0.5","CV6547","Prior, Timothy J.","A synchrotron study of mercury(I) acetate","Acta Crystallographica Section E","2005","61","8","m1523","m1524","10.1107/S160053680502163X","","","0.8464","synchrotron","","0.0431","0.0428","","","0.1084","0.1086","","","","","","1.101","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206402","11.0623","0.001","10.4086","0.0009","20.2368","0.0015","90","","110.737","0.004","90","","2179.2","0.3","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-(4-Fluorophenyl)-2-(4-methylphenoxy)-5,8,9- trimethylthieno[3',2':5,6]pyrido[4,3-d]pyrimidin-4(3H)-one","","- C25 H20 F N3 O2 S -","- C25 H20 F N3 O2 S -","- C100 H80 F4 N12 O8 S4 -","4","1","CV6548","Zeping Cui; Mingtian Li; Jianchao Liu; Hongwu He","3-(4-Fluorophenyl)-2-(4-methylphenoxy)-5,8,9-trimethylthieno[3',2':5,6]pyrido[4,3-<i>d</i>]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2005","61","8","o2663","o2664","10.1107/S1600536805022968","","","0.71073","MoKα","","0.0883","0.0502","","","0.1028","0.1166","","","","","","0.89","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206403","36.589","0.005","5.3932","0.0007","7.9572","0.0011","90","","96.689","0.002","90","","1559.5","0.4","292","2","292","2","","","","","","","","4","C 1 c 1","C -2yc","9","","N-[4-(Phenylethynyl)phenyl]benzamide","","- C21 H15 N O -","- C21 H15 N O -","- C84 H60 N4 O4 -","4","1","CV6549","Yin, Guodong; Hu, Shengli; Li, Yitao; Wu, Anxin","<i>N</i>-[4-(Phenylethynyl)phenyl]benzamide","Acta Crystallographica Section E","2005","61","8","o2561","o2562","10.1107/S1600536805022105","","","0.71073","MoKα","","0.0604","0.0451","","","0.1086","0.1331","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206404","7.22","0.0014","10.14","0.002","12.08","0.002","93.79","0.03","103.21","0.03","104.21","0.03","827.6","0.3","298","2","293","2","","","","","","","","7","P -1","-P 1","2","","polymeric hexaaquacobalt(II) diaquadioxodi-μ~2~-pyrazine- bis[μ~3~-N-(phosphonomethyl)iminodiacetato]cobaltdivanadium dihydrate","","- C14 H36 Co2 N4 O26 P2 V2 -","- C14 H36 Co2 N4 O26 P2 V2 -","- C14 H36 Co2 N4 O26 P2 V2 -","1","0.5","CV6554","Almeida Paz, Filipe A.; Shi, Fa-Nian; Mafra, Luis; Makal, Anna; Wozniak, Krysztof; Trindade, Tito; Klinowski, Jacek; Rocha, João","[Co(H~2~O)~6~]{[Co(C~4~H~4~N~2~)(H~2~O)~2~][V~2~O~2~(pmida)~2~]}·2H~2~O [H~4~pmida is <i>N</i>-(phosphonomethyl)iminodiacetic acid]: the first two-dimensional hybrid framework containing [V~2~O~2~(pmida)~2~]^4{-^} building blocks","Acta Crystallographica Section E","2005","61","8","m1628","m1632","10.1107/S1600536805023263","","","0.71073","MoKα","","0.0285","0.0248","","","0.0656","0.0676","","","","","","1.078","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206405","11.452","0.003","8.859","0.002","19.352","0.008","90","","90","","90","","1963.3","1.1","296","1","296","1","","","","","","","","4","P n a 21","P 2c -2n","33","","N-(2-Cyanopropan-2-yl)-isobutyramide","","- C8 H14 N2 O -","- C8 H14 N2 O -","- C64 H112 N16 O8 -","8","2","CV6555","Rodríguez, Verónica; Barba, Victor; Bernès, Sylvain; Quintero, Leticia; Sartillo-Piscil, Fernando","<i>N</i>-(2-Cyanopropan-2-yl)isobutyramide","Acta Crystallographica Section E","2005","61","8","o2733","o2735","10.1107/S1600536805023330","","","0.71073","MoKα","","0.0881","0.0519","","","0.1303","0.1515","","","","","","1.015","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206406","18.893","0.004","11.214","0.003","6.573","0.001","90","","90","","90","","1392.6","0.5","298","2","298","2","","","","","","","","4","C m c m","-C 2c 2","63","","tricesium diiron(III) tris(arsenate)","","- As3 Cs3 Fe2 O12 -","- As3 Cs3 Fe2 O12 -","- As12 Cs12 Fe8 O48 -","4","0.25","DN6220","Ouerfelli, Najoua; Zid, Mohamed Faouzi; Jouini, Tahar","Un nouveau diarséniate Cs~3~Fe~2~(AsO~4~)~3~ à environnement exclusivement pentagonal du fer","Acta Crystallographica Section E","2005","61","8","i165","i167","10.1107/S1600536805021616","","","0.71073","MoKα","","0.0316","0.0244","","","0.0675","0.07","","","","","","1.246","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206407","12.524","0.003","13.027","0.002","13.008","0.004","90","","90.47","0.02","90","","2122.2","0.9","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","sodium lithium decavanadate eicosahydrate","","- H40 Li0.78 Na5.22 O48 V10 -","- H40 Li0.78 Na5.22 O48 V10 -","- H80 Li1.56 Na10.44 O96 V20 -","2","0.5","DN6227","Ksiksi, Regaya; Graia, Mohsen; Jouini, Tahar","Sel mixte de lithium et de sodium eicosahydrate, Na~5.22~Li~0.78~[V~10~O~28~]·20H~2~O","Acta Crystallographica Section E","2005","61","8","i177","i179","10.1107/S160053680502060X","","","0.71073","MoKα","","0.0385","0.0286","","","0.0671","0.0709","","","","","","1.071","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206408","16.872","0.008","11.144","0.003","11.266","0.005","90","","128.55","0.03","90","","1656.6","1.4","293","","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(2-amino-5-chloropyridinium) dihydrogenodiphosphate","","- C10 H14 Cl2 N4 O7 P2 -","- C10 H14 Cl2 N4 O7 P2 -","- C40 H56 Cl8 N16 O28 P8 -","4","0.5","DN6233","Akriche, Samah; Rzaigui, Mohamed","Bis(2-amino-5-chloropyridinium) dihydrogendiphosphate","Acta Crystallographica Section E","2005","61","8","o2607","o2609","10.1107/S1600536805022403","","","0.5608","AgKα","","0.0446","0.0377","","","0.1076","0.1122","","","","","","1.131","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206409","9.4153","0.0012","9.8326","0.0014","11.2069","0.0019","90","","96.391","0.012","90","","1031.1","0.3","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","","2-Bromoethyl 2,3,4,6-tetra-O-acetyl-β-D-glucopyranoside","","- C16 H23 Br O10 -","- C16 H23 Br O10 -","- C32 H46 Br2 O20 -","2","1","DN6234","Ivan Halasz; Renata Odžak; Srđanka Tomić; Dubravka Matković-Čalogović","2-Bromoethyl 2,3,4,6-tetra-<i>O</i>-acetyl-β-<small>D</small>-glucopyranoside","Acta Crystallographica Section E","2005","61","8","o2644","o2645","10.1107/S1600536805022555","","","0.71073","MoKα","","0.0624","0.0465","","","0.1191","0.1422","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206410","6.041","0.002","10.875","0.004","12.819","0.005","73.78","0.02","81.29","0.03","82.77","0.03","796.2","0.5","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","4-[(2-Chloro-4-nitrophenyl)diazenyl]phenol dimethylformamide solvate","","- C15 H15 Cl N4 O4 -","- C15 H15 Cl N4 O4 -","- C30 H30 Cl2 N8 O8 -","2","1","DN6235","Xiu-Li You; Yan Zhang; Yong Zhang; De-Chun Zhang","4-[(2-Chloro-4-nitrophenyl)diazenyl]phenol dimethylformamide solvate","Acta Crystallographica Section E","2005","61","8","o2656","o2658","10.1107/S1600536805023093","","","0.7107","MoKα","","0.0844","0.0733","","","0.1631","0.1698","","","","","","1.164","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206411","21.349","0.006","5.2657","0.0014","21.303","0.006","90","","97.6","0.004","90","","2373.8","1.1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3-(1H-Imidazol-1-yl)-1-(4-methoxyphenyl)propan-1-one","","- C13 H14 N2 O2 -","- C13 H14 N2 O2 -","- C104 H112 N16 O16 -","8","1","DN6236","Jun Wan; Zheng-Zhong Peng; Xue-Mei Li; Ping-Kai Ouyang; Shu-Sheng Zhang","3-(1<i>H</i>-Imidazol-1-yl)-1-(4-methoxyphenyl)propan-1-one","Acta Crystallographica Section E","2005","61","8","o2585","o2586","10.1107/S1600536805022385","","","0.71073","MoKα","","0.0571","0.0449","","","0.1134","0.1238","","","","","","1.024","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206412","6.6684","0.0002","9.8585","0.0003","12.9149","0.0004","87.046","0.002","78.017","0.002","70.872","0.002","784.55","0.04","123","2","123","2","","","","","","","","6","P -1","-P 1","2","Hydrochlorothiazide‒1,4-dioxane (1/1)","6-chloro-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide‒1,4-dioxane (1/1)","","- C11 H16 Cl N3 O6 S2 -","- C11 H16 Cl N3 O6 S2 -","- C22 H32 Cl2 N6 O12 S4 -","2","1","DN6237","Johnston, Andrea; Florence, Alastair J.; Kennedy, Alan R.","Hydrochlorothiazide‒1,4-dioxane (1/1)","Acta Crystallographica Section E","2005","61","8","o2573","o2575","10.1107/S1600536805022464","","","0.71073","MoKα","","0.0432","0.0311","","","0.0728","0.0782","","","","","","1.031","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206413","10.4902","0.0009","8.1611","0.0007","13.8691","0.0012","90","","107.252","0.001","90","","1133.94","0.17","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-(4-Chlorophenyl)-3-(1H-imidazol-1-yl)propan-1-one","","- C12 H11 Cl N2 O -","- C12 H11 Cl N2 O -","- C48 H44 Cl4 N8 O4 -","4","1","DN6238","Jun Wan; Zheng-Zhong Peng; Xue-Mei Li; Ping-Kai Ouyang; Shu-Sheng Zhang","1-(4-Chlorophenyl)-3-(1<i>H</i>-imidazol-1-yl)propan-1-one","Acta Crystallographica Section E","2005","61","8","o2659","o2660","10.1107/S160053680502310X","","","0.71073","MoKα","","0.0493","0.0411","","","0.1057","0.1118","","","","","","1.053","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206414","3.623","0.0003","11.975","0.0002","20.2509","0.0002","90","","91.484","0.003","90","","878.3","0.07","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","cytosinium oxalate monohydrate","cytosinium oxalate monohydrate","","- C6 H9 N3 O6 -","- C6 H9 N3 O6 -","- C24 H36 N12 O24 -","4","1","DN6240","Karim Bouchouit; Nourredine Benali-Cherif; Dahaoui, Slimane; Bendeif, El-Eulmi; Lecomte, Claude","Cytosinium oxalate monohydrate","Acta Crystallographica Section E","2005","61","8","o2755","o2757","10.1107/S1600536805023494","","","0.71073","MoKα","","0.0817","0.05","","","0.1054","0.1202","","","","","","1.029","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206415","6.487","0.0005","6.656","0.0004","11.5588","0.0008","81.227","0.004","76.733","0.003","65.037","0.005","439.5","0.06","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","5-tert-butyl-4-nitro-1H-pyrazol-3-ol","","- C7 H11 N3 O3 -","- C7 H11 N3 O3 -","- C14 H22 N6 O6 -","2","1","ER6016","Daniel E. Lynch; Ian McClenaghan","5-<i>tert</i>-Butyl-4-nitro-1<i>H</i>-pyrazol-3-ol","Acta Crystallographica Section E","2005","61","8","o2347","o2348","10.1107/S1600536805020544","","","0.71073","MoKα","","0.067","0.0587","","","0.1476","0.1532","","","","","","1.191","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206416","14.206","0.004","14.015","0.004","22.639","0.006","90","","90","","90","","4507","2","298","","298","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Hexacarbonyl-bis(μ~2~-2-methoxyphenylthiolato)diiron(I)(Fe—Fe)","","- C20 H14 Fe2 O8 S2 -","- C20 H14 Fe2 O8 S2 -","- C160 H112 Fe16 O64 S16 -","8","1","ER6017","Si, You-Tao; Ma, Cheng-Bing; Hu, Ming-Qiang; Chen, Chang-Neng","Hexacarbonylbis(μ~2~-2-methoxyphenylthiolato)diiron(I)(<i>Fe</i>—<i>Fe</i>)","Acta Crystallographica Section E","2005","61","8","m1447","m1448","10.1107/S1600536805020313","","","0.71073","MoKα","","","0.032","","","0.0858","0.0877","","","","","","1.05","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206417","11.1","0.04","12.38","0.03","15.88","0.04","90.08","0.05","102.24","0.05","113.59","0.06","1945","10","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","Bis[hydrotris(4-chloro-3,5-dimethylpyrazolyl)borato]nickel(II)","","- C30 H38 B2 Cl6 N12 Ni -","- C30 H38 B2 Cl6 N12 Ni -","- C60 H76 B4 Cl12 N24 Ni2 -","2","1","FL6170","Desrochers, Patrick J.; Brown, Josh R.; Arvin, Michael E.; Jones, Gavin D.; Vicic, David A.","Bis[hydrotris(4-chloro-3,5-dimethylpyrazolyl)borato]nickel(II)","Acta Crystallographica Section E","2005","61","8","m1455","m1458","10.1107/S160053680502012X","","","0.7107","MoKα","","0.0628","0.0486","","","0.1106","0.1186","","","","","","1.101","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206418","10.7715","0.0004","11.0565","0.0004","20.9841","0.0007","90","","101.121","0.002","90","","2452.18","0.15","105","2","300","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,6-Bis(2-methylphenyl)-1-nitroso-3,5-diphenylpiperidin-4-one","","- C31 H28 N2 O2 -","- C31 H28 N2 O2 -","- C124 H112 N8 O8 -","4","1","FL6171","J. Suresh; V. P. Alex Raja; R. V. Krishnakumar; S. Natarajan; S. Perumal; A. Mostad","2,6-Bis(2-methylphenyl)-1-nitroso-3,5-diphenylpiperidin-4-one","Acta Crystallographica Section E","2005","61","8","o2458","o2460","10.1107/S1600536805021112","","","0.71073","MoKα","","0.0413","0.0381","","","0.098","0.1011","","","","","","1.026","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206419","24.3956","0.0016","12.04","0.0008","14.7848","0.001","90","","93.529","0.001","90","","4334.4","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[2-(benz(othia/oxa)zol-2-yl)phenolato-κ^2^N,O]beryllium(II)","","- C26 H16 Be N2 O2.53 S1.47 -","- C26 H16 Be N2 O2.532 S1.468 -","- C208 H128 Be8 N16 O20.256 S11.744 -","8","1","FL6172","Tong, Yi-Ping","Bis[2-(benz(othia/oxa)zol-2-yl)phenolato-κ^2^<i>N</i>,<i>O</i>]beryllium(II)","Acta Crystallographica Section E","2005","61","8","m1472","m1474","10.1107/S1600536805020933","","","0.71073","MoKα","","0.0585","0.0468","","","0.1213","0.1299","","","","","","1.041","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206420","10.4009","0.0015","11.3173","0.0018","15.353","0.003","90","","103.427","0.005","90","","1757.8","0.5","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-(4-Nitrobenzoyloxy)-N-methyl-2-nitro-1-phenylpropan-1-amine","","- C17 H17 N3 O6 -","- C17 H17 N3 O6 -","- C68 H68 N12 O24 -","4","1","FL6174","Chu, Ji-Cheng; Li, Wei; Liu, Dong-Zhi","<i>N</i>-Methyl-2-nitro-<i>N</i>-(4-nitrobenzoyloxy)-1-phenylpropan-1-amine","Acta Crystallographica Section E","2005","61","8","o2661","o2662","10.1107/S1600536805022701","","","0.71073","MoKα","","0.0767","0.0381","","","0.0868","0.106","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206421","13.9313","0.0002","10.9888","0.0002","18.128","0.0004","90","","108.065","0.0008","90","","2638.38","0.09","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H25 Cl2 N5 O8 -","- C24 H25 Cl2 N5 O8 -","- C96 H100 Cl8 N20 O32 -","4","1","FL6176","L. Mihiri D. Ariyananda; Richard E. Norman","2-{[<i>N</i>-(Pyridinium-2-ylmethyl)-<i>N</i>-(pyridin-2-ylmethyl)amino]methyl}-1-(pyridin-2-ylmethyl)pyridinium diperchlorate","Acta Crystallographica Section E","2005","61","8","o2679","o2681","10.1107/S1600536805022828","","","0.71073","MoKα","","0.0938","0.0733","","0.2029","","0.1606","","","0.93605","","","1.0343","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206422","10.716","0.003","10.979","0.003","13.307","0.004","75.67","0.01","71.87","0.01","77.49","0.01","1424.9","0.7","299","2","299","2","","","","","","","","6","P -1","-P 1","2","","(Hydridotripyrazolylborato)iodo{(1,2,5,6-η)-1-[(Z)-1-iodo-2- phenylethenyl]cycloocta-1,5-diene}ruthenium(II)‒diiodine (2/1)","","- C25 H27 B I3 N6 Ru -","- C25 H27 B I3 N6 Ru -","- C50 H54 B2 I6 N12 Ru2 -","2","1","FL6177","Slugovc, Christian; Kirchner, Karl; Mereiter, Kurt","(Hydridotripyrazolylborato)iodo{(1,2,5,6-η)-1-[(<i>Z</i>)-1-iodo-2-phenylethenyl]cycloocta-1,5-diene}ruthenium(II)‒diiodine (2/1)","Acta Crystallographica Section E","2005","61","8","m1646","m1648","10.1107/S1600536805022944","","","0.71073","MoKα","","0.0389","0.0299","","","0.0674","0.0718","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206423","11.287","0.006","11.606","0.006","9.864","0.006","90","","112.39","0.07","90","","1194.7","1.3","300","2","300","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","O-Ethyl S-(3-oxoindan-1-yl) dithiocarbonate","","- C12 H12 O2 S2 -","- C12 H12 O2 S2 -","- C48 H48 O8 S8 -","4","1","FL6178","Hartung, Jens; Daniel, Kristina; Svoboda, Ingrid; Fuess, Hartmut","<i>O</i>-Ethyl <i>S</i>-(3-oxoindan-1-yl) dithiocarbonate","Acta Crystallographica Section E","2005","61","8","o2768","o2769","10.1107/S1600536805023901","","","0.71073","MoKα","","0.0733","0.0466","","","0.1259","0.1449","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206424","9.41","0.001","12.605","0.001","23.229","0.002","90","","90","","90","","2755.3","0.4","303","2","303","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","3-trans-Bromo-5-cis-fluoro-2,6,6-trimethyl-2-phenyltetrahydropyran","","- C14 H18 Br F O -","- C14 H18 Br F O -","- C112 H144 Br8 F8 O8 -","8","1","FL6180","Hartung, Jens; Greb, Marco; Svoboda, Ingrid; Fuess, Hartmut","3-<i>trans</i>-Bromo-5-<i>cis</i>-fluoro-2,6,6-trimethyl-2-phenyltetrahydropyran","Acta Crystallographica Section E","2005","61","8","o2770","o2771","10.1107/S1600536805023913","","","0.71073","MoKα","","0.1133","0.0733","","","0.1661","0.1878","","","","","","1.197","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206425","19.06","0.003","6.6887","0.0011","9.3752","0.0016","90","","90","","90","","1195.2","0.3","293","2","293","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","","(1S,3aR,4S,6aR)-1-(4-Hydroxy-3-methoxyphenyl)-4-(4-hydroxy-3- methylphenyl)perhydrofuro[3,4-c]furan-3a,6a-diol hexahydrate","","- C20 H34 O14 -","- C20 H26 O14 -","- C40 H52 O28 -","2","0.5","GH6022","Ying-Qian Xu; Bing Zhao; Li-Xin Yang","(1<i>S</i>,3a<i>R</i>,4<i>S</i>,6a<i>R</i>)-1-(4-Hydroxy-3-methoxyphenyl)-4-(4-hydroxy-3-methylphenyl)perhydrofuro[3,4-<i>c</i>]furan-3a,6a-diol hexahydrate","Acta Crystallographica Section E","2005","61","8","o2559","o2560","10.1107/S1600536805022117","","","0.71073","MoKα","","0.0618","0.0428","","","0.1182","0.1287","","","","","","1.037","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206426","7.0515","0.0009","10.2953","0.0012","11.0039","0.0013","113.247","0.002","91.839","0.002","92.225","0.002","732.46","0.15","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","3-(4,6-Dimethylpyrimidin-2-yl)-2-methylchromen-4-one","","- C16 H14 N2 O2 S -","- C16 H14 N2 O2 S -","- C32 H28 N4 O4 S2 -","2","1","GH6025","Wei Huang; Deyou Teng; Zhongzhen Zhou; Guangfu Yang","3-(4,6-Dimethylpyrimidin-2-yl)-2-methylchromen-4-one","Acta Crystallographica Section E","2005","61","8","o2510","o2512","10.1107/S1600536805021938","","","0.71073","MoKα","","0.0743","0.056","","","0.1661","0.1921","","","","","","1.075","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206427","5.7593","0.0001","10.6881","0.0001","12.3122","0.0001","98.857","0.001","100.208","0.001","95.51","0.001","731.05","0.016","84","1","84","1","","","","","","","","3","P -1","-P 1","2","","5,8'-Dimethoxy-3H-1-benzofuran-2-spiro-2'-chroman","","- C18 H18 O4 -","- C18 H18 O4 -","- C36 H36 O8 -","2","1","GH6027","George R. Clark; Kit Yee Tsang; Margaret A. Brimble","5,8'-Dimethoxy-3<i>H</i>-1-benzofuran-2-spiro-2'-chroman","Acta Crystallographica Section E","2005","61","8","o2748","o2749","10.1107/S1600536805023731","","","0.71073","MoKα","","0.0512","0.0404","","","0.0996","0.1074","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206428","24.9892","0.0015","16.622","0.0009","30.8299","0.0019","90","","110.506","0.003","90","","11994.4","1.2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Diethanolaminium cyclo-octa-μ~2~-fluoro-hexadeca-μ~2~-trimethylacetato-κ^2^O:O'- heptachromium(III)nickel(II) ethyl acetate 0.5-solvate","","- C86 H160 Cr7 F8 N Ni O35 -","- C85.488 H155.47 Cr8 F8 N0.997 O35.494 -","- C341.952 H621.88 Cr32 F32 N3.988 O141.976 -","4","1","HB6196","Larsen, Finn K.; Muryn, Christopher A.; Overgaard, Jacob; Timco, Grigore A.; Winpenny, Richard E. P.","Diethanolaminium <i>cyclo</i>-octa-μ~2~-fluoro-hexadeca-μ~2~-trimethylacetato-κ^32^<i>O</i>:<i>O</i>'-heptachromium(III)nickel(II) ethyl acetate 0.5-solvate","Acta Crystallographica Section E","2005","61","8","m1525","m1527","10.1107/S1600536805019562","","","0.71073","MoKα","","0.1209","0.0907","","","0.2378","0.2577","","","","","","1.038","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2206429","20.566","0.005","20.174","0.005","14.243","0.003","90","","108.614","0.003","90","","5600","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetrakis(3,5-diphenyl-4-amino-4H-1,2,4-triazole-κN^1^)zinc(II) bis(perchlorate)","","- C56 H48 Cl2 N16 O8 Zn -","- C56 H48 Cl2 N16 O8 Zn -","- C224 H192 Cl8 N64 O32 Zn4 -","4","1","HB6215","Yuan-Yuan Liu","Tetrakis(3,5-diphenyl-4-amino-4<i>H</i>-1,2,4-triazole-κ<i>N</i>^1^)zinc(II) bis(perchlorate)","Acta Crystallographica Section E","2005","61","8","m1486","m1488","10.1107/S1600536805020714","","","0.71073","MoKα","","0.1298","0.0554","","","0.1205","0.149","","","","","","1.005","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206430","10.8491","0.0003","14.2301","0.0003","13.3928","0.0003","90","","94.671","0.001","90","","2060.76","0.09","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","tetraaquabis(2-hydroxy-3,5-dinitrobenzoic acid)bis(2-oxido-3,5- dinitrobenzoato)tricopper‒diaquabis(2-hydroxy-3,5-dinitrobenzoato)copper‒water (0.54/0.92/4)","","- C28 H26.92 Cu2.54 N8 O36 -","- C28 H26.92 Cu2.54 N8 O36 -","- C56 H53.84 Cu5.08 N16 O72 -","2","0.5","HB6222","Jian-Rong Su; Duan-Jun Xu","The co-crystal tetraaquabis(2-oxido-3,5-dinitrobenzoato)bis(2-oxido-3,5-dinitrobenzoic acid)tricopper‒diaquabis(2-hydroxy-3,5-dinitrobenzoato)(2-oxido-3,5-dinitrobenzoic acid)copper‒water (0.54/0.92/4): a reformulation?","Acta Crystallographica Section E","2005","61","8","m1503","m1505","10.1107/S1600536805021069","","","0.71073","MoKα","","0.043","0.039","","","0.095","0.097","","","","","","1.199","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206431","24.463","0.004","14.818","0.002","15.911","0.003","90","","121.138","0.002","90","","4936.6","1.4","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Fe^III^(Salpn)(μ~2~-Salpn)Fe^III^(Salpn)","μ~2~-bis(salicylidene)propane-1,3-diaminato-bis{[bis(salicylidene)propane- 1,3-diaminato]iron(III)}","","- C51 H48 Fe2 N6 O6 -","- C51 H48 Fe2 N6 O6 -","- C204 H192 Fe8 N24 O24 -","4","0.5","HB6225","Bakir, Mohammed; Dasgupta, Tara P.; Dutta, Sujit K.; Ngah, Nurziana; Yamin, Bohari M.","Porous solvent-free μ~2~-bis(salicylidene)propane-1,3-diaminato-bis{[bis(salicylidene)propane-1,3-diaminato]iron(III)}","Acta Crystallographica Section E","2005","61","8","m1464","m1466","10.1107/S1600536805020611","","","0.71073","MoKα","","0.0572","0.0395","","","0.0945","0.1021","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206432","10.4595","0.0004","12.5105","0.0005","13.6969","0.0006","81.169","0.001","77.571","0.001","83.037","0.001","1722.3","0.12","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","Dichlorobis[2-(3,5-dimethylpyrazolyl-1-carbonyl)furan]palladium(II) bis[tris(pentafluorophenyl)borane] tetrahydrate dichloromethane disolvate","","- C58 H32 B2 Cl6 F30 N4 O8 Pd -","- C56 H28 B2 Cl2 F30 N4 O8 Pd -","- C56 H28 B2 Cl2 F30 N4 O8 Pd -","1","0.5","HB6228","Ilia A. Guzei; Stephen O. Ojwach; James Darkwa","Dichlorobis[2-(3,5-dimethylpyrazolyl-1-carbonyl)furan]palladium(II) bis[aquatris(pentafluorophenyl)boron] dihydrate dichloromethane disolvate","Acta Crystallographica Section E","2005","61","8","m1492","m1494","10.1107/S1600536805020520","","","0.71073","MoKα","","0.0321","0.0298","","","0.083","0.0849","","","","","","1.071","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206433","19.6755","0.0016","9.7855","0.0008","9.9593","0.0008","90","","101.498","0.001","90","","1879","0.3","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","dirubidium tricadmium tetrakis(sulfate) pentahydrate","","- Cd3 H10 O21 Rb2 S4 -","- Cd3 H10 O21 Rb2 S4 -","- Cd12 H40 O84 Rb8 S16 -","4","1","HB6229","Swain, Diptikanta; Guru Row, T. N.","Dirubidium tricadmium tetrakis(sulfate) pentahydrate","Acta Crystallographica Section E","2005","61","8","i163","i164","10.1107/S1600536805021252","","","0.71073","MoKα","","0.023","0.0219","","","0.0586","0.0591","","","","","","1.096","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206434","15.0179","0.0005","16.2881","0.0005","18.5719","0.0007","90","","102.964","0.0013","90","","4427.1","0.3","150","1","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","poly[[diperchloratocopper(II)]-bis[μ~2~-1,3-bis(4-pyridyl)propane]]","","- C26 H28 Cl2 Cu N4 O8 -","- C26 H28 Cl2 Cu N4 O8 -","- C156 H168 Cl12 Cu6 N24 O48 -","6","1.5","HB6230","Ryu, Ji Young; Kim, Cheal; Park, Dae Won; Park, Lae Ok; Kim, Youngmee; Lough, Alan J.","The two-dimensional structure of poly[[diperchloratocopper(II)]-bis[μ~2~-1,3-bis(4-pyridyl)propane]]","Acta Crystallographica Section E","2005","61","8","m1489","m1491","10.1107/S1600536805020878","","","0.71073","MoKα","","0.0943","0.0569","","","0.1342","0.1585","","","","","","1.026","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206435","8.07","0.005","9.644","0.005","18.125","0.005","100.28","0.05","96.2","0.05","112.12","0.05","1261.8","1.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","(2,2'-Bipyridyl-κ^2^N,N')nitrato(triphenylphosphine-κP)silver(I)","","- C28 H23 Ag N3 O3 P -","- C28 H23 Ag N3 O3 P -","- C56 H46 Ag2 N6 O6 P2 -","2","1","HB6231","Amirnasr, Mehdi; Welter, Richard; Khalaji, Aliakbar Dehno","(2,2'-Bipyridyl-κ^2^<i>N</i>,<i>N</i>')nitrato(triphenylphosphine-κ<i>P</i>)silver(I)","Acta Crystallographica Section E","2005","61","8","m1452","m1454","10.1107/S160053680502057X","","","0.71069","MoKα","","0.0423","0.0315","","","0.0829","0.0946","","","","","","1.064","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206436","9.1896","0.0006","13.8731","0.0009","20.001","0.001","90","","93.641","0.001","90","","2544.7","0.3","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane-1,8- diacetato)cobalt(II) tetrahydrate","","- C20 H46 Co N4 O8 -","- C20 H46 Co N4 O8 -","- C80 H184 Co4 N16 O32 -","4","1","HB6232","Wang, Shi-Fan; Ruan, Ban-Feng; Li, Huang-Qiu; Zhu, Hai-Liang; Ng, Seik Weng","(5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane-1,8-diacetato)cobalt(II) tetrahydrate","Acta Crystallographica Section E","2005","61","8","m1484","m1485","10.1107/S1600536805020532","","","0.71073","MoKα","","0.0723","0.0624","","","0.1435","0.1485","","","","","","1.176","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206437","5.5931","0.0006","8.8605","0.001","14.0427","0.0015","90.206","0.002","96.662","0.002","96.181","0.002","687.11","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[dibromozinc(II)]-μ-1,2-bis(4-pyridyl)ethane]","","- C12 H12 Br2 N2 Zn -","- C12 H12 Br2 N2 Zn -","- C24 H24 Br4 N4 Zn2 -","2","1","HB6233","Hong, Sung Jin; Lee, Jung Hwan; Lee, Eun Yong; Kim, Cheal; Kim, Youngmee; Kim, Sung-Jin","<i>catena</i>-Poly[[dibromozinc(II)]-μ-1,2-bis(4-pyridyl)ethane], a one-dimensional coordination polymer","Acta Crystallographica Section E","2005","61","8","m1561","m1562","10.1107/S1600536805022026","","","0.71073","MoKα","","0.0577","0.0555","","","0.1443","0.1461","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206438","7.1352","0.0004","8.7869","0.0005","13.186","0.0007","88.659","0.001","85.782","0.001","88.145","0.001","823.86","0.08","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[bis(ethane-1,2-diaminium) [ferrate(III)-μ-hydroxo-κ^2^O:O-di-μ-sulfato-κ^4^O:O']] sulfate monohydrate]","","- C4 H23 Fe N4 O14 S3 -","- C4 H23 Fe N4 O14 S3 -","- C8 H46 Fe2 N8 O28 S6 -","2","1","HB6234","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","<i>catena</i>-Poly[[bis(ethane-1,2-diaminium) [ferrate(III)-μ-hydroxo-κ^2^<i>O</i>:<i>O</i>-di-μ-sulfato-κ^4^<i>O</i>:<i>O</i>']] sulfate monohydrate]","Acta Crystallographica Section E","2005","61","8","m1478","m1480","10.1107/S1600536805020866","","","0.71073","MoKα","","0.032","0.028","","","0.079","0.081","","","","","","1.04","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206439","12.7839","0.0005","12.9973","0.0006","18.0683","0.0008","100.725","0.002","98.363","0.002","90.364","0.002","2916.6","0.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","Chloro[η^5^-1-(dimethylaminoethyl)indenyl](triphenylphosphine)nickel(II) diethyl ether hemisolvate","","- C33 H36 Cl N Ni O0.5 P -","- C33 H36 Cl N Ni O0.5 P -","- C132 H144 Cl4 N4 Ni4 O2 P4 -","4","2","HB6236","Castonguay, Annie; Beauchamp, André L.; Vachon, Jason; Zargarian, Davit","Chloro[η^5^-1-(dimethylaminoethyl)indenyl](triphenylphosphine)nickel(II) diethyl ether hemisolvate","Acta Crystallographica Section E","2005","61","8","m1512","m1513","10.1107/S160053680502129X","","","1.54178","CuKα","","0.0836","0.048","","","0.1064","0.1184","","","","","","0.947","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206440","9.9384","0.0004","9.9384","0.0004","9.9384","0.0004","90","","90","","90","","981.63","0.07","295","2","295","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","ammonium oxonium dititanium(III,IV) tris(phosphate)","","- H7 N O13 P3 Ti2 -","- H7 N O13 P3 Ti2 -","- H28 N4 O52 P12 Ti8 -","4","0.333333","HB6237","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","Langbeinite-type mixed-valence (NH~4~)(H~3~O)Ti^III^Ti^IV^(PO~4~)~3~","Acta Crystallographica Section E","2005","61","8","i158","i159","10.1107/S1600536805021392","","","0.71073","MoKα","","0.022","0.022","","","0.065","0.065","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206441","11.355","0.001","17.568","0.002","16.102","0.002","90","","90","","90","","3212.1","0.6","295","2","295","2","","","","","","","","6","C m c 21","C 2c -2","36","","Tetrapyridinium tetrasulfatozirconate(IV) monohydrate","","- C20 H26 N4 O17 S4 Zr -","- C20 H26 N4 O17 S4 Zr -","- C80 H104 N16 O68 S16 Zr4 -","4","0.5","HB6238","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","Tetrapyridinium tetrasulfatozirconate(IV) monohydrate","Acta Crystallographica Section E","2005","61","8","m1520","m1522","10.1107/S1600536805021409","","","0.71073","MoKα","","0.075","0.055","","","0.131","0.143","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206442","13.684","0.0004","13.684","0.0004","21.4734","0.0008","90","","90","","90","","4020.9","0.2","150","2","120","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","5-tert-Butyl-4-bromo-1,2-dihydro-1H-pyrazol-3(2H)-one monohydrate","","- C7 H13 Br N2 O2 -","- C7 H13 Br N2 O2 -","- C112 H208 Br16 N32 O32 -","16","1","HG6180","Daniel E. Lynch; Ian McClenaghan","5-<i>tert</i>-Butyl-4-bromo-1,2-dihydro-1<i>H</i>-pyrazol-3(2<i>H</i>)-one monohydrate","Acta Crystallographica Section E","2005","61","8","o2349","o2351","10.1107/S1600536805012791","","","0.71073","MoKα","","0.0419","0.0301","","","0.0641","0.0692","","","","","","1.016","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206443","7.2196","0.0005","12.9481","0.0009","15.1436","0.0009","90","","90","","90","","1415.63","0.16","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(1R,2R,5R)-(+)-2α-Hydroxypinan-3-one ketimine","(1R,2R,5R)-2-hydroxy-2,6,6-trimethyl-3-[(3- pyridyl)methylimino]bicyclo[3.1.1]heptane","","- C16 H22 N2 O -","- C16 H22 N2 O -","- C64 H88 N8 O4 -","4","1","HG6205","Ayers, Joshua T.; Sonar, Vijayakumar N.; Parkin, Sean; Dwoskin, Linda P.; Crooks, Peter A.","(1<i>R</i>,2<i>R</i>,5<i>R</i>)-(+)-2α-Hydroxypinan-3-one ketimine","Acta Crystallographica, Section E","2005","61","8","2682","o2684","10.1107/S1600536805023287","","","0.71073","MoKα","","0.0771","0.0474","","","0.097","0.1089","","","","","","1.018","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2206444","8.1321","0.0002","10.6922","0.0003","26.8033","0.0007","90","","90","","90","","2330.55","0.11","295","1","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","6-Acetoxymethyl-2-(2-methoxyphenoxy)tetrahydropyran-3,4,5-triyl triacetate","","- C21 H26 O11 -","- C21 H26 O11 -","- C84 H104 O44 -","4","1","HG6206","Zhou, Feng-Yan; Zhong, Jian-Hua","6-Acetoxymethyl-2-(2-methoxyphenoxy)tetrahydropyran-3,4,5-triyl triacetate","Acta Crystallographica, Section E: Structure Reports Online","2005","61","8","o2701","o2703","10.1107/S1600536805022804","","","0.7107","MoKα","","","0.04","","","","0.118","","","","","","1.012","","","","has coordinates,has Fobs","209472","2020-10-21","18:00:00",""
"2206445","11.9054","0.0008","10.8101","0.0006","13.6064","0.0009","90","","112.957","0.007","90","","1612.4","0.2","173","","173","1","","","","","","","","5","P 1 21 1","P 2yb","4","","(3R)-Methyl 6-tert-butoxycarbonylamino-5-oxo- 2,3-dihydro-5H-1,3-thiazolo[3,2-a]pyridine-3-carboxylate","","- C14 H18 N2 O5 S -","- C14 H18 N2 O5 S -","- C56 H72 N8 O20 S4 -","4","2","HG6207","Seger, Harald; Stempfhuber, Sabine; Zabel, Manfred; Marsch, Michael; Geyer, Armin; Harms, Klaus","(3<i>R</i>)-Methyl 6-<i>tert</i>-butoxycarbonylamino-5-oxo-2,3-dihydro-5<i>H</i>-1,3-thiazolo[3,2-<i>a</i>]pyridine-3-carboxylate","Acta Crystallographica Section E","2005","61","8","o2576","o2578","10.1107/S1600536805022245","","","0.71073","MoKα","","0.0345","0.0338","","","0.0852","0.0856","","","","","","1.07","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206446","7.624","0.005","10.436","0.006","12.791","0.008","99.096","0.007","98.257","0.007","98.981","0.007","977.7","1.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-{(2-chlorophenyl)[(4-methylphenyl)imino]methyl}ferrocene","","- C24 H20 Cl Fe N -","- C24 H20 Cl Fe N -","- C48 H40 Cl2 Fe2 N2 -","2","1","HG6208","Hong-Xing Wang; Hui-Chao Zhou; Hong-Fei Wu","1-{(2-Chlorophenyl)[(4-methylphenyl)imino]methyl}ferrocene","Acta Crystallographica Section E","2005","61","8","m1623","m1624","10.1107/S1600536805023299","","","0.71073","MoKα","","0.0333","0.0289","","","0.0778","0.08","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206447","18.159","0.002","7.8122","0.0009","21.777","0.003","90","","106.724","0.002","90","","2958.7","0.6","100","2","100","2","","","","","","","","4","C 1 2 1","C 2y","5","","Bis(triphenylsilyl)selenide","","- C36 H30 Se Si2 -","- C36 H30 Se Si2 -","- C144 H120 Se4 Si8 -","4","1","HG6210","Medina, Iliana; Mague, Joel T.; Donahue, James P.; Fink, Mark J.","Bis(triphenylsilyl)selenide","Acta Crystallographica Section E","2005","61","8","o2687","o2688","10.1107/S1600536805023275","","","0.71073","MoKα","","0.027","0.0255","","","0.0592","0.0597","","","","","","1.021","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206448","8.7101","0.0006","11.8947","0.0008","15.1194","0.001","109.92","0.001","102.599","0.001","98.444","0.001","1394.87","0.16","143","2","143","2","","","","","","","","5","P -1","-P 1","2","","Diaquatetrakis(1H-imidazole)copper(II) bis[tris(1H-imidazole)(pyridine-2,4,6-tricarboxylato- κ^3^N,O^2^:O^6^)cuprate(II)] dihydrate","","- C46 H52 Cu3 N22 O16 -","- C46 H52 Cu3 N22 O16 -","- C46 H52 Cu3 N22 O16 -","1","0.5","HG6216","Houser, Robert P.; Cheng, Deping","Diaquatetrakis(1<i>H</i>-imidazole)copper(II) bis[tris(1<i>H</i>-imidazole)(pyridine-2,4,6-tricarboxylato-κ^3^<i>N</i>,<i>O</i>^2^:<i>O</i>^6^)cuprate(II)] dihydrate","Acta Crystallographica Section E","2005","61","8","m1649","m1651","10.1107/S1600536805023780","","","0.71073","MoKα","","0.0257","0.025","","","0.0692","0.0696","","","","","","1.052","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206449","7.5449","0.0019","9.187","0.002","9.5884","0.0019","79.358","0.003","78.13","0.002","70.887","0.003","609.6","0.2","298","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis[3-dimethylamino-l-(2-pyridyl)prop-2-enonato]diperchloratozinc(II)","","- C20 H24 Cl2 N4 O10 Zn -","- C20 H24 Cl2 N4 O10 Zn -","- C20 H24 Cl2 N4 O10 Zn -","1","0.5","HK6010","Wang, Ping; Xu, Xiao-Nan; Zheng, Lan-Fang; Bao, Yan-Qing","Bis[3-dimethylamino-1-(2-pyridyl)prop-2-enonato]diperchloratozinc(II)","Acta Crystallographica Section E","2005","61","8","m1462","m1463","10.1107/S1600536805020623","","","0.71073","MoKα","","0.037","0.0343","","","0.0988","0.1012","","","","","","1.124","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206450","7.1327","0.0002","16.8046","0.0006","7.9402","0.0002","90","","113.253","0.002","90","","874.42","0.05","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Propane-1,3-diaminium hydrogenarsenate monohydrate","","- C3 H15 As N2 O5 -","- C3 H15 As N2 O5 -","- C12 H60 As4 N8 O20 -","4","1","HK6019","Todd, Malcolm J.; Harrison, William T. A.","Propane-1,3-diaminium hydrogenarsenate monohydrate","Acta Crystallographica Section E","2005","61","8","m1459","m1461","10.1107/S1600536805020702","","","0.71073","MoKα","","0.0273","0.0223","","","0.0534","0.0552","","","","","","1.052","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206451","12.959","0.005","10.908","0.005","23.797","0.005","90","","90","","90","","3364","2","100","","100","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","6-Methyl-N-(3-oxo-1-thia-4-azaspiro[4.4]non-4-yl)imidazo[2,1-b][1,3]thiazole- 5-carboxamide monohydrate","","- C14 H18 N4 O3 S2 -","- C14 H18 N4 O3 S2 -","- C112 H144 N32 O24 S16 -","8","1","HK6020","Sema Öztürk Yıldırım; Mehmet Akkurt; Fusun Ur; Zafer Cesur; Nesrin Cesur; Frank W. Heinemann","6-Methyl-<i>N</i>-(3-oxo-1-thia-4-azaspiro[4.4]non-4-yl)imidazo[2,1-<i>b</i>][1,3]thiazole-5-carboxamide monohydrate","Acta Crystallographica Section E","2005","61","8","o2357","o2359","10.1107/S1600536805020088","","","0.71069","MoKα","","0.052","0.0345","","","0.0702","0.0762","","","","","","1.036","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206452","11.648","0.006","5.777","0.003","15.852","0.008","90","","100.74","0.009","90","","1048","0.9","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-(1,4-Phenylenedivinylene)diquinolin-8-ol","","- C28 H20 N2 O2 -","- C28 H20 N2 O2 -","- C56 H40 N4 O4 -","2","0.5","HK6021","Cui, Jian-Zhong; Zhang, Dan; Hai-Bin Song; Tang, Xiang-Yang","2,2'-(1,4-Phenylenedivinylene)diquinolin-8-ol","Acta Crystallographica Section E","2005","61","8","o2372","o2373","10.1107/S1600536805020672","","","0.71073","MoKα","","0.0832","0.0444","","","0.0975","0.1184","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206453","12.8335","0.0013","13.217","0.002","14.148","0.003","90","","94.239","0.011","90","","2393.2","0.7","299","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetra-n-butylammonium di-μ-hydroxo-bis[dinitratodioxouranium(VI)]","","- C32 H74 N6 O18 U2 -","- C32 H74 N6 O18 U2 -","- C64 H148 N12 O36 U4 -","2","0.5","HK6022","Andreas Fischer; Giuseppe Palladino","Tetra-<i>n</i>-butylammonium di-μ-hydroxo-bis[dinitratodioxouranate(VI)]","Acta Crystallographica Section E","2005","61","8","m1542","m1544","10.1107/S1600536805021045","","","0.71073","MoKα","","0.094","0.052","","","0.084","0.101","","","","","","1.27","","","","has coordinates,has Fobs","189213","2020-10-21","18:00:00",""
"2206454","12.0665","0.0011","10.305","0.001","17.4969","0.0017","90","","108.371","0.002","90","","2064.8","0.3","292","2","292","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diethyl 6,9-dibromo-1,4-dioxo-1,2,3,4,5,10-hexahydro-2,3,4a,10a-tetraazabenzo[g] cyclopenta[cd]azulene-2a,10b-dicarboxylate","","- C18 H18 Br2 N4 O6 -","- C18 H18 Br2 N4 O6 -","- C72 H72 Br8 N16 O24 -","4","1","HK6024","Nengfang She; Huizhen Guo; Zhiguo Wang; Anxin Wu","Diethyl 6,9-dibromo-1,4-dioxo-1,2,3,4,5,10-hexahydro-2,3,4a,10a-tetraazabenzo[<i>g</i>]cyclopenta[<i>cd</i>]azulene-2a,10b-dicarboxylate","Acta Crystallographica Section E","2005","61","8","o2549","o2550","10.1107/S1600536805022075","","","0.71073","MoKα","","0.0714","0.0575","","","0.1452","0.1571","","","","","","1.03","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206455","9.7757","0.0003","10.5004","0.0003","15.6093","0.0004","90","","91.692","0.002","90","","1601.58","0.08","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","hydrochlorothiazide aniline solvate","Hydrochlorothiazide‒aniline (1/1)","","- C13 H15 Cl N4 O4 S2 -","- C13 H15 Cl N4 O4 S2 -","- C52 H60 Cl4 N16 O16 S8 -","4","1","HK6025","Johnston, Andrea; Florence, Alastair J.; Kennedy, Alan R.","Hydrochlorothiazide‒aniline (1/1)","Acta Crystallographica Section E","2005","61","8","o2520","o2522","10.1107/S1600536805021914","","","0.71073","MoKα","","0.0514","0.0335","","","0.0767","0.0836","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206456","8.633","0.002","10.924","0.003","13.296","0.004","109.334","0.004","90.305","0.005","111.828","0.004","1086.5","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","cis-(Carbonato-κ^2^O,O')(rac-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane-κ^4^N)chromium(III) bromide monohydrate","","- C17 H38 Br Cr N4 O4 -","- C17 H38 Br Cr N4 O4 -","- C34 H76 Br2 Cr2 N8 O8 -","2","1","HK6026","Liliana Dobrzańska","<i>cis</i>-(Carbonato-κ^2^<i>O</i>,<i>O</i>')(<i>rac</i>-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>)chromium(III) bromide monohydrate","Acta Crystallographica Section E","2005","61","8","m1625","m1627","10.1107/S1600536805023172","","","0.71073","MoKα","","0.0719","0.0502","","","0.108","0.1174","","","","","","1.019","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206457","7.318","0.002","9.736","0.003","15.433","0.005","90","","98.178","0.005","90","","1088.4","0.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","9,10-Bis[(phenylthio)methyl]anthracene '","","- C28 H22 S2 -","- C28 H22 S2 -","- C56 H44 S4 -","2","0.5","HK6027","Chunbo Liu; Guangbo Che; Chuanbi Li; Yuncheng Cui","9,10-Bis[(phenylsulfanyl)methyl]anthracene","Acta Crystallographica Section E","2005","61","8","o2537","o2538","10.1107/S160053680502204X","","","0.71073","MoKα","","0.0709","0.0404","","","0.0882","0.0995","","","","","","1.021","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206458","11.7991","0.0009","10.0206","0.0008","18.423","0.001","90","","101.352","0.002","90","","2135.6","0.3","294","2","294","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","bis(quinolinium) tetrachlorozincate dihydrate","","- C18 H20 Cl4 N2 O2 Zn -","- C18 H20 Cl4 N2 O2 Zn -","- C72 H80 Cl16 N8 O8 Zn4 -","4","0.5","HK6028","Valdés Martínez, Jesús; Muñoz, Orneli; Toscano, Rubén A.","π‒π Stacking in bis(quinolinium) tetrachlorozincate dihydrate","Acta Crystallographica Section E","2005","61","8","m1590","m1592","10.1107/S1600536805022506","","","0.71073","MoKα","","0.0831","0.0487","","","0.0789","0.0873","","","","","","1.006","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206459","9.9906","0.0008","7.2954","0.0006","10.2946","0.0009","90","","91.893","0.001","90","","749.92","0.11","292","2","292","2","","","","","","","","5","P 1 21 1","P 2yb","4","[Zn(phen)(mal)(H~2~O)]~n~","catena-Poly[[aqua(1,10-phenanthroline)zinc(II)]-μ-maleate-κ^3^O,O,O']","","- C16 H12 N2 O5 Zn -","- C16 H12 N2 O5 Zn -","- C32 H24 N4 O10 Zn2 -","2","1","IS6086","Li, Ming-Tian; Fu, Xu-Cheng; Wang, Cheng-Gang","<i>catena</i>-Poly[[aqua(1,10-phenanthroline)zinc(II)]-μ-maleato-κ^3^<i>O</i>,<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","8","m1436","m1438","10.1107/S1600536805020271","","","0.71073","MoKα","","0.0229","0.0223","","","0.0645","0.0648","","","","","","1.103","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206460","7.4111","0.0016","8.7821","0.0019","15.545","0.003","75.292","0.003","84.626","0.002","78.163","0.003","956.9","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","{2-[2-(1H-1,3-Benzimidazol-2-yl)ethyliminomethyl]-4- bromophenolato}thiocyanatocopper(II) methanol solvate","","- C18 H17 Br Cu N4 O2 S -","- C18 H17 Br Cu N4 O2 S -","- C36 H34 Br2 Cu2 N8 O4 S2 -","2","1","IS6091","Xiao-Hang Qiu; Xiao-lan Tong","{2-[2-(1<i>H</i>-1,3-Benzimidazol-2-yl)ethyliminomethyl]-4-bromophenolato}thiocyanatocopper(II) methanol solvate","Acta Crystallographica Section E","2005","61","8","m1470","m1471","10.1107/S1600536805020477","","","0.71073","MoKα","","0.043","0.034","","","0.092","0.098","","","","","","1.06","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206461","7.7453","0.0009","16.2325","0.0019","7.3667","0.0009","90","","98.908","0.002","90","","915.01","0.19","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","o-(2-Bromoethoxy)benzaldehyde","","- C9 H9 Br O2 -","- C9 H9 Br O2 -","- C36 H36 Br4 O8 -","4","1","IS6092","Bang-Tun Zhao; Jian-Ge Wang; Pu-Zhou Hu; Lu-Fang Ma; Li-Ya Wang","<i>o</i>-(2-Bromoethoxy)benzaldehyde","Acta Crystallographica Section E","2005","61","8","o2398","o2400","10.1107/S1600536805020799","","","0.71073","MoKα","","0.0432","0.0383","","","0.0967","0.1001","","","","","","1.045","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206462","12.1705","0.0017","11.0375","0.0015","15.078","0.002","90","","107.232","0.003","90","","1934.5","0.5","292","2","292","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(5-Benzyloxy-2,4-dichlorophenyl)-4,5,6,7-tetrahydro -isoindole-1,3-dione","","- C21 H17 Cl2 N O3 -","- C21 H17 Cl2 N O3 -","- C84 H68 Cl8 N4 O12 -","4","1","IS6093","Neng-Xue Wang; Yan-Ping Luo; Qiong Chen; Guang-Fu Yang","2-(5-Benzyloxy-2,4-dichlorophenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione","Acta Crystallographica Section E","2005","61","8","o2332","o2333","10.1107/S1600536805020246","","","0.71073","MoKα","","0.0822","0.0484","","","0.1134","0.1293","","","","","","1.045","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206463","5.8384","0.0001","9.6253","0.0002","25.7216","0.0004","90","","93.421","0.001","90","","1442.88","0.04","293","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,1',3,3'-Tetrabenzyl-2,2'-biimidazolidine","","- C34 H38 N4 -","- C34 H38 N4 -","- C68 H76 N8 -","2","0.5","IS6094","Yliana López; Rosa Santillan; M. Eugenia Ochoa; Norberto Farfán; Efrén V. García-Báez; Itzia I. Padilla-Martínez","1,1',3,3'-Tetrabenzyl-2,2'-biimidazolidine","Acta Crystallographica Section E","2005","61","8","o2464","o2466","10.1107/S1600536805021136","","","0.71073","MoKα","","0.074","0.0482","","","0.1246","0.1396","","","","","","1.029","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206464","10.257","0.004","23.04","0.008","7.424","0.003","90","","127.771","0.004","90","","1386.8","0.9","294","2","294","2","","","","","","","","4","C 1 c 1","C -2yc","9","","N-Ethyl-5-(pyrrol-1-yl)-1,8-naphthalimide","","- C18 H14 N2 O2 -","- C18 H14 N2 O2 -","- C72 H56 N8 O8 -","4","1","IS6096","Yu-Quan Shi; Dan Xu; Ming-Jian Cai; Bin Chen","<i>N</i>-Ethyl-5-(pyrrol-1-yl)-1,8-naphthalimide","Acta Crystallographica Section E","2005","61","8","o2436","o2437","10.1107/S1600536805021185","","","0.71073","MoKα","","0.0406","0.0328","","","0.0821","0.089","","","","","","1.059","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206465","19.064","0.004","7.6978","0.0016","24.864","0.005","90","","98.261","0.004","90","","3611","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetra-μ-phenoxyacetato-bis[(acetonitrile)copper(II)](Cu—Cu)","","- C36 H34 Cu2 N2 O12 -","- C36 H34 Cu2 N2 O12 -","- C144 H136 Cu8 N8 O48 -","4","0.5","IS6097","Jiang, Guo-Qing; Li, Yi-Zhi; Wang, Su-Na; Li, Fei-Fei; Bai, Jun-Feng","Tetra-μ-phenoxyacetato-bis[(acetonitrile)copper(II)](<i>Cu</i>—<i>Cu</i>)","Acta Crystallographica Section E","2005","61","8","m1517","m1519","10.1107/S1600536805021197","","","0.71073","MoKα","","0.0858","0.0534","","","0.1071","0.1144","","","","","","1.051","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206466","33.126","0.009","5.7499","0.0015","9.258","0.003","90","","90.305","0.005","90","","1763.4","0.9","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3,6-Bis(4-methoxybenzyloxy)pyridazine","","- C20 H20 N2 O4 -","- C20 H20 N2 O4 -","- C80 H80 N8 O16 -","4","0.5","IS6098","Fang-Zhong Hu; Min Zhang; Hai-Bin Song; Xiao-Mao Zou; Hua-Zheng Yang","3,6-Bis(4-methoxybenzyloxy)pyridazine","Acta Crystallographica Section E","2005","61","8","o2486","o2488","10.1107/S1600536805021173","","","0.71073","MoKα","","0.0846","0.04","","","0.0948","0.1146","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206467","5.482","0.003","5.381","0.002","43.859","0.002","90","","93.07","0.02","90","","1291.9","0.9","296","1","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,24-Dibromotetracosane","","- C24 H48 Br2 -","- C24 H48 Br2 -","- C48 H96 Br4 -","2","0.5","IS6099","Naotake Nakamura; Akira Ohishi","1,24-Dibromotetracosane","Acta Crystallographica Section E","2005","61","8","o2447","o2449","10.1107/S1600536805021379","","","1.5418","CuKα","","","0.056","","","","0.108","","","","","","1","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206468","9.0195","0.0018","10.402","0.002","20.289","0.004","90","","97.477","0.003","90","","1887.3","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-[2-({[(4-methoxybenzoyl)amino]carbonothioyl}amino)ethyl]morpholin-4-ium thiocyanate","","- C16 H22 N4 O3 S2 -","- C16 H22 N4 O3 S2 -","- C64 H88 N16 O12 S8 -","4","1","IS6100","Yusof, M. Sukeri M.; Yamin, Bohari M.","<i>N</i>-(4-Methoxybenzoyl)-<i>N</i>'-[2-(morpholinium-1-yl)ethyl]thiourea thiocyanate","Acta Crystallographica Section E","2005","61","8","o2433","o2435","10.1107/S1600536805021124","","","0.71073","MoKα","","0.063","0.054","","","0.12","0.125","","","","","","1.17","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206469","13.0125","0.0012","8.5957","0.0006","15.4586","0.0012","90","","112.655","0.006","90","","1595.7","0.2","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,2-Bis[5-oxo-3-(n-propyl)-4,5-dihydro-3H-1,2,4-triazol-4-yl]ethane dihydrate","","- C12 H24 N6 O4 -","- C12 H24 N6 O4 -","- C48 H96 N24 O16 -","4","0.5","IS6101","Gonca Özdemir; Şamil I şık; Kemal Sancak; Selami Şaşmaz; Nazmi Turan Okumuşoğlu","1,2-Bis[5-oxo-3-(<i>n</i>-propyl)-4,5-dihydro-3<i>H</i>-1,2,4-triazol-4-yl]ethane dihydrate","Acta Crystallographica Section E","2005","61","8","o2699","o2700","10.1107/S1600536805022853","","","0.71073","MoKα","","0.0588","0.0464","","","0.1126","0.1195","","","","","","1.039","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206470","9.7963","0.0007","11.3007","0.0008","24.0399","0.0017","90","","93.922","0.001","90","","2655.1","0.3","292","2","292","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","N,N'-Bis(N,N-dimethyl-p-toluidine)bis(ethoxycarbonyl)glycoluril","Diethyl 4,8-dioxo-2,6-di-p-tolyl-1,3,5,7-tetrahydro-2,3a,4a,6,7a,8a- hexaazacyclopenta[def]fluorene-8b,8c-dicarboxylate","","- C28 H32 N6 O6 -","- C28 H32 N6 O6 -","- C112 H128 N24 O24 -","4","1","IS6102","Yin, Guo-Dong; Zhou, Bao-Han; Chen, Yun-Feng; Wu, An-Xin","<i>N</i>,<i>N</i>'-Bis(<i>N</i>,<i>N</i>-dimethyl-<i>p</i>-toluidine)bis(ethoxycarbonyl)glycoluril","Acta Crystallographica Section E","2005","61","8","o2632","o2634","10.1107/S1600536805022725","","","0.71073","MoKα","","0.072","0.0479","","","0.1194","0.1321","","","","","","1.025","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206471","15.1182","0.001","14.0027","0.0009","17.3551","0.0012","90","","107.173","0.002","90","","3510.2","0.4","291","2","291","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","mer-Bis(2,3-dimethyl-5-oxo-1-phenyl-2,5-dihydro-1H-pyrazole-4-carbaldehyde 4,4-dimethylthiosemicarbazonato-κ^3^S,N,O)cobalt(III) tetrafluoroborate","","- C30 H36 B Co F4 N10 O2 S2 -","- C30 H36 B Co F4 N10 O2 S2 -","- C120 H144 B4 Co4 F16 N40 O8 S8 -","4","1","IS6103","Valdés Martínez, Jesús; Hernández-Ortega, Simón; West, Douglas X.; El-Sawaf, Ayman K.; El-Bahanasawy, Ramadan M.; El-Saied, Fathy A.","<i>mer</i>-Bis(2,3-dimethyl-5-oxo-1-phenyl-2,5-dihydro-1<i>H</i>-pyrazole-4-carbaldehyde 4,4-dimethylthiosemicarbazonato-κ^3^<i>S</i>,<i>N</i>,<i>O</i>)cobalt(III) tetrafluoroborate","Acta Crystallographica Section E","2005","61","8","m1593","m1594","10.1107/S1600536805022488","","","0.71073","MoKα","","0.0581","0.0432","","","0.1048","0.1089","","","","","","0.94","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206472","14.3102","0.0008","7.6342","0.0004","18.5783","0.001","90","","107.637","0.001","90","","1934.22","0.18","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[cis-diaqua(1,10-phenanthroline-κ^2^N,N')cobalt(II)]- μ~2~-5-sulfonatosalicylato-κ^2^O:O']","","- C19 H16 Co N2 O8 S -","- C19 H16 Co N2 O8 S -","- C76 H64 Co4 N8 O32 S4 -","4","1","IS6104","Fan, Sai-Rong; Zhu, Long-Guan","<i>catena</i>-Poly[[<i>cis</i>-diaqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II)]-μ~2~-5-sulfonatosalicylato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2005","61","8","m1598","m1600","10.1107/S1600536805022920","","","0.71073","MoKα","","0.0693","0.0667","","","0.1348","0.1359","","","","","","1.302","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206473","17.543","0.001","9.0676","0.0006","13.7592","0.0009","90","","96.67","0.001","90","","2173.9","0.2","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","4,4'-Bipyridinium(2+) hexaaquairon(II) disulfate dihydrate","","- C10 H26 Fe N2 O16 S2 -","- C10 H26 Fe N2 O16 S2 -","- C40 H104 Fe4 N8 O64 S8 -","4","0.5","IS6106","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","4,4'-Bipyridinium(2+) hexaaquairon(II) disulfate dihydrate","Acta Crystallographica Section E","2005","61","8","m1639","m1640","10.1107/S1600536805023391","","","0.71073","MoKα","","0.059","0.054","","","0.126","0.13","","","","","","1.21","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206474","7.0983","0.0006","10.469","0.0009","10.5212","0.0009","60.421","0.001","76.616","0.001","76.797","0.002","655.44","0.1","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[piperazinium(2+) [ferrate(III)-μ-hydroxo-κ^2^O:O-di-μ-sulfato-κ^4^O:O'] dihydrate]","","- C4 H17 Fe N2 O11 S2 -","- C4 H17 Fe N2 O11 S2 -","- C8 H34 Fe2 N4 O22 S4 -","2","1","IS6107","Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng","<i>catena</i>-Poly[piperazinium(2+) [ferrate(III)-μ-hydroxo-κ^2^<i>O</i>:<i>O</i>-di-μ-sulfato-κ^4^<i>O</i>:<i>O</i>'] dihydrate]","Acta Crystallographica Section E","2005","61","8","m1641","m1643","10.1107/S1600536805023408","","","0.71073","MoKα","","0.042","0.035","","","0.107","0.134","","","","","","1.22","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206475","8.52","0.002","12.646","0.003","12.917","0.003","90","","90","","90","","1391.7","0.6","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","(1R,4R)-(+)-3-benzoylcamphor","(+)-(1R,4R)-3-(hydroxy-benzylidene)-1,7,7-trimethyl- bicyclo[2.2.1]heptan-2-one","","- C17 H20 O2 -","- C17 H20 O2 -","- C68 H80 O8 -","4","1","JH6011","Niemeyer, Mark; Gan, Min","The enol form of (+)-(1<i>R</i>,4<i>R</i>)-3-benzoylcamphor","Acta Crystallographica Section E","2005","61","8","o2363","o2365","10.1107/S1600536805020404","","","0.71073","MoKα","","0.04","0.035","","","0.089","0.092","","","","","","1.04","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206476","24.5562","0.001","9.2464","0.0004","11.9764","0.0005","90","","91.559","0.002","90","","2718.3","0.2","150","","150","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","2-[(Dimethylamino)(phenyl)methyl]benzoic acid","[(2-carboxylatophenyl)(phenyl)methyl]-N,N-dimethylammonium","","- C16 H17 N O2 -","- C16 H17 N O2 -","- C128 H136 N8 O16 -","8","1","JH6012","Yvette L. Dann; Andrew R. Cowley; Harry L. Anderson","2-[(Dimethylamino)(phenyl)methyl]benzoic acid","Acta Crystallographica Section E","2005","61","8","o2502","o2503","10.1107/S1600536805021215","","","0.71073","MoKα","","0.1117","0.0505","","0.1188","0.0582","0.0582","","","","","","1.1413","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206477","10.2783","0.0011","11.4013","0.0011","11.593","0.0012","90","","90","","90","","1358.5","0.2","292","2","292","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(E)-3-Isopropyl-5,5-dimethyl-2-(phenylimino)imidazolidin-4-one","","- C14 H19 N3 O -","- C14 H19 N3 O -","- C56 H76 N12 O4 -","4","1","KP6052","Ju-Zhen Yuan; Yang-Gen Hu; Jia-Jia Wei; Ming-Wu Ding","(<i>E</i>)-3-Isopropyl-5,5-dimethyl-2-(phenylimino)imidazolidin-4-one","Acta Crystallographica Section E","2005","61","8","o2640","o2641","10.1107/S1600536805022749","","","0.71073","MoKα","","0.0428","0.0389","","","0.1002","0.1027","","","","","","1.09","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206478","9.7926","0.0004","14.6633","0.0007","11.6359","0.0004","90","","100.576","0.002","90","","1642.44","0.12","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(E)-3-Methoxyacetophenone 2,4,6-trinitrophenylhydrazone","","- C15 H13 N5 O7 -","- C15 H13 N5 O7 -","- C60 H52 N20 O28 -","4","1","KP6053","Zheng Fan; Shang Shan; Duan-Jun Xu","(<i>E</i>)-3-Methoxyacetophenone 2,4,6-trinitrophenylhydrazone","Acta Crystallographica Section E","2005","61","8","o2758","o2760","10.1107/S1600536805023949","","","0.71073","MoKα","","0.087","0.052","","","0.121","0.134","","","","","","1.025","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206479","9.713","0.002","12.025","0.003","35.703","0.003","90","","94.23","0.03","90","","4158.7","1.4","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Trimethoprim dipicolinate pentahydrate","(2,4-diamino-5-(3',4',5'-trimethoxybenzyl)pyrimidinium dipicolinate pentahydrate","","- C35 H51 N9 O15 -","- C35 H51 N9 O15 -","- C140 H204 N36 O60 -","4","1","LH6416","Madhukar Hemamalini; Packianathan Thomas Muthiah; Gabriele Bocelli; Andrea Cantoni","Hydrogen-bonding patterns in bis(trimethoprim) dipicolinate pentahydrate","Acta Crystallographica Section E","2005","61","8","o2368","o2371","10.1107/S1600536805020167","","","0.71069","MoKa","","0.1425","0.0574","","","0.1294","0.1595","","","","","","0.958","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206480","10.212","0.003","10.051","0.002","16.611","0.003","90","","90","","90","","1705","0.7","298","2","298","2","","","","","","","","4","P n a 21","P 2c -2n","33","","Propyl 3,6-diphenyl-1,4-dihydro-1,2,4,5-tetrazine-1-carboxylate","","- C18 H18 N4 O2 -","- C18 H18 N4 O2 -","- C72 H72 N16 O8 -","4","1","LH6426","Guo-Wu Rao; Wei-Xiao Hu","Propyl 3,6-diphenyl-1,4-dihydro-1,2,4,5-tetrazine-1-carboxylate","Acta Crystallographica Section E","2005","61","8","o2431","o2432","10.1107/S1600536805019653","","","0.71073","MoKα","","0.0835","0.0356","","","0.0895","0.1055","","","","","","1.047","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206481","14.4162","0.0016","8.5691","0.001","17.0016","0.0019","90","","105.365","0.001","90","","2025.2","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","5-Azido-3,3-dimethyl-2-oxo-1-thia-4,6-diazaindan 1,1-dioxide","","- C7 H7 N5 O3 S -","- C7 H7 N5 O3 S -","- C56 H56 N40 O24 S8 -","8","1","LH6452","Li Tian; Da-Xiang Wang","5-Azido-3,3-dimethyl-2-oxo-1-thia-4,6-diazaindan 1,1-dioxide","Acta Crystallographica Section E","2005","61","8","o2518","o2519","10.1107/S1600536805021781","","","0.71073","MoKα","","0.0336","0.0297","","","0.0838","0.0871","","","","","","1.06","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206482","5.57","0.002","7.943","0.003","22.953","0.007","82.82","0.03","85.05","0.03","89.55","0.03","1003.8","0.6","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","1,10-Bis(phenylthio)decane","","- C22 H30 S2 -","- C22 H30 S2 -","- C44 H60 S4 -","2","1","LH6453","Awaleh, Mohamed Osman; Badia, Antonnella; Brisse, François","1,10-Bis(phenylsulfanyl)decane","Acta Crystallographica Section E","2005","61","8","o2473","o2475","10.1107/S1600536805020180","","","1.54178","CuKα","","0.0701","0.0499","","","0.1374","0.1465","","","","","","0.914","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206483","6.7577","0.0019","8.799","0.003","9.89","0.004","83.17","0.04","76.17","0.03","71.1","0.03","539.7","0.3","193","2","193","2","","","","","","","","3","P -1","-P 1","2","","3-[(Z)-1-hydroxy-3-oxobutenyl]-2H-chromen-2-one","","- C13 H10 O4 -","- C13 H10 O4 -","- C26 H20 O8 -","2","1","LH6456","Xiangshan Wang; Zhaosen Zeng; Yuling Li; Daqing Shi","Redetermination of 3-[(<i>Z</i>)-1-hydroxy-3-oxobutenyl]-2<i>H</i>-chromen-2-one at 193 K","Acta Crystallographica Section E","2005","61","8","o2599","o2601","10.1107/S1600536805022361","","","0.7107","MoKα","","0.0776","0.0583","","","0.1526","0.1703","","","","","","1.078","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206484","5.8654","0.0001","7.5638","0.0001","14.0472","0.0002","90","","97.6","0.001","90","","617.726","0.016","220","2","220","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,2-Bis(phenylthio)ethane","","- C14 H14 S2 -","- C14 H14 S2 -","- C28 H28 S4 -","2","0.5","LH6460","Awaleh, Mohamed Osman; Badia, Antonnella; Brisse, François","1,2-Bis(phenylsulfanyl)ethane","Acta Crystallographica Section E","2005","61","8","o2479","o2481","10.1107/S1600536805020192","","","1.54178","CuKα","","0.0379","0.0361","","","0.1055","0.1074","","","","","","1.027","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206485","5.627","0.002","7.862","0.003","18.486","0.006","94.55","0.03","91.36","0.03","90.46","0.03","815","0.5","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","1,6-Bis(phenylsulfanyl)hexane","","- C18 H22 S2 -","- C18 H22 S2 -","- C36 H44 S4 -","2","1","LH6461","Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François","1,6-Bis(phenylsulfanyl)hexane","Acta Crystallographica Section E","2005","61","8","o2476","o2478","10.1107/S1600536805020465","","","1.54178","CuKα","","0.1076","0.0359","","","0.0584","0.0684","","","","","","0.663","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206486","4.783","0.0005","21.54","0.002","7.7599","0.0008","90","","105.911","0.002","90","","768.84","0.13","150","2","150","2","","","","","","","","3","P 1 21 1","P 2yb","4","α-lactose monohydrate","α-4-O-(β-D-galactopyranosido)-D-glucopyranose","","- C12 H24 O12 -","- C12 H24 O12 -","- C24 H48 O24 -","2","1","LH6465","Smith, Joanne H.; Dann, Sandra E.; Elsegood, Mark R. J.; Dale, Sophie H.; Blatchford, Chris. G","α-Lactose monohydrate: a redetermination at 150 K","Acta Crystallographica Section E","2005","61","8","o2499","o2501","10.1107/S1600536805021367","","","0.71073","MoKα","","0.0385","0.0332","","","0.0762","0.0788","","","","","","1.104","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206487","21.6122","0.0008","5.0393","0.0002","12.7868","0.0005","90","","90","","90","","1392.61","0.09","120","2","120","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","2-Nitrobenzaldehyde 2-iodobenzoylhydrazone","","- C14 H10 I N3 O3 -","- C14 H10 I N3 O3 -","- C56 H40 I4 N12 O12 -","4","1","LH6467","Glidewell, Christopher; Low, John N.; Wardell, James L.","2-Nitrobenzaldehyde 2-iodobenzoylhydrazone","Acta Crystallographica Section E","2005","61","8","o2438","o2440","10.1107/S1600536805021355","","","0.71073","MoKα","","0.0306","0.0257","","","0.0514","0.0535","","","","","","1.053","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206488","8.6831","0.0004","9.8249","0.0005","9.6824","0.0005","90","","110.766","0.002","90","","772.35","0.07","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1,2,3-Tri-O-acetyl-5-deoxy-5-methylthio-β-D-ribofuranose","","- C12 H18 O7 S -","- C12 H18 O7 S -","- C24 H36 O14 S2 -","2","1","LH6468","Jeckelmann, Jean-Marc; Lüthi Nyffeler, Therese; Altmann, Michael; Bürgi, Hans-Beat; Renaud, Philippe; Hauser, Jürg","1,2,3-Tri-<i>O</i>-acetyl-5-deoxy-5-methylthio-β-<small>D</small>-ribofuranose","Acta Crystallographica Section E","2005","61","8","o2689","o2690","10.1107/S1600536805022683","","","0.71073","MoKα","","0.0516","0.0351","","","0.0802","0.0866","","","","","","1.038","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206489","6.748","0.0013","6.9559","0.0013","23.45","0.004","90","","90","","90","","1100.7","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Synepherine hydrochloride","2-hydroxy-2-(4-hydroxyphenyl)-N-methylethanaminium chloride","","- C9 H14 Cl N O2 -","- C9 H14 Cl N O2 -","- C36 H56 Cl4 N4 O8 -","4","1","LH6469","Muhammad Sajid; M. Iqbal Choudhary; Atta-ur-Rahman; Masood Parvez; Ietidal Eltahir Mohamed; Shazia Anjum","Absolute configuration of (<i>R</i>)-synephrine hydrochloride","Acta Crystallographica Section E","2005","61","8","o2534","o2536","10.1107/S160053680502180X","","","0.71073","MoKα","","0.097","0.067","","","0.109","0.12","","","","","","1.02","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206490","8.256","0.003","10.219","0.005","11.053","0.005","90","","111.09","0.002","90","","870.1","0.7","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","tert-Butylamidodichlorophosphine oxide","tert-Butylamidodichlorophosphine oxide","","- C4 H10 Cl2 N O P -","- C4 H10 Cl2 N O P -","- C16 H40 Cl8 N4 O4 P4 -","4","1","LH6470","Chivers, Tristram; Grebinski, James; Parvez, Masood; Fu, Zhiyong","<i>tert</i>-Butylamidodichlorophosphine oxide","Acta Crystallographica Section E","2005","61","8","o2491","o2492","10.1107/S1600536805021495","","","0.71073","MoKα","","0.078","0.059","","","0.155","0.165","","","","","","1.08","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206491","9.5877","0.0005","9.8541","0.0005","11.705","0.0004","105.982","0.002","103.57","0.002","108.433","0.002","943.75","0.08","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","3-tert-butyl-4-(4-nitrophenyl)-1-phenyl-1H-pyrazolo[3,4-b]pyridine","","- C22 H20 N4 O2 -","- C22 H20 N4 O2 -","- C44 H40 N8 O4 -","2","1","LH6471","Abonia, Rodrigo; Rengifo, Emerson; Cobo, Justo; Low, John N.; Glidewell, Christopher","3-<i>tert</i>-Butyl-4-(4-nitrophenyl)-1-phenyl-1<i>H</i>-pyrazolo[3,4-<i>b</i>]pyridine","Acta Crystallographica Section E","2005","61","8","o2625","o2627","10.1107/S160053680502177X","","","0.71073","MoKα","","0.1093","0.0572","","","0.1176","0.1368","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206492","7.7798","0.0001","11.0645","0.0002","15.4006","0.0003","85.256","0.001","82.988","0.001","88.068","0.001","1310.88","0.04","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","trans-Dichlorobis[(phenylsulfanyl)methane-κS]palladium(II)","","- C26 H24 Cl2 Pd S4 -","- C26 H24 Cl2 Pd S4 -","- C52 H48 Cl4 Pd2 S8 -","2","1","LH6472","Awaleh, Mohamed Osman; Badia, Antonnella; Brisse, François","<i>trans</i>-Dichlorobis[(phenylsulfanyl)methane-κ<i>S</i>]palladium(II)","Acta Crystallographica Section E","2005","61","8","m1586","m1587","10.1107/S160053680502235X","","","1.54178","CuKα","","0.0428","0.0399","","","0.1045","0.1061","","","","","","1.072","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206493","10.4449","0.0004","10.912","0.0005","20.9707","0.0009","81.311","0.001","80.278","0.001","73.004","0.001","2239.76","0.17","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Poly[[bis[(dimethyl sulfoxide)zinc(II)]-di-μ~4~-benzene-1,4-dicarboxylato] dimethyl sulfoxide pentasolvate]","","- C30 H50 O15 S7 Zn2 -","- C30 H50 O15 S7 Zn2 -","- C60 H100 O30 S14 Zn4 -","2","1","LH6473","Yang, Shi-Yao; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng","Poly[[bis[(dimethyl sulfoxide)zinc(II)]-di-μ~4~-benzene-1,4-dicarboxylato] dimethyl sulfoxide pentasolvate]","Acta Crystallographica Section E","2005","61","8","m1671","m1673","10.1107/S1600536805023986","","","0.71073","MoKα","","0.049","0.045","","","0.118","0.121","","","","","","1","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206495","3.605","0.002","9.445","0.004","9.653","0.004","90","","90","","90","","328.7","0.3","297","1","297","1","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Al2 O5 Ti -","- Al2 O5 Ti -","- Al8 O20 Ti4 -","4","0.25","MG6041","Stefan T. Norberg; Nobuo Ishizawa; Stefan Hoffmann; Masahiro Yoshimura","Redetermination of β-Al~2~TiO~5~ obtained by melt casting","Acta Crystallographica Section E","2005","61","8","i160","i162","10.1107/S1600536805021331","","","0.71073","MoKα","","0.03","0.028","","0.029","0.028","0.028","","","1.093","","","1.112","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206496","18.012","0.005","5.356","0.005","12.937","0.005","90","","108.786","0.005","90","","1181.6","1.2","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H12 N4 O5 -","- C9 H12 N4 O5 -","- C36 H48 N16 O20 -","4","1","NC6036","Joussef, Antonio C.; Silva, Liuz Everson da; Bortoluzzi, Adailton J.; Foro, Sabine","2,2-Dimethyl-5-(4<i>H</i>-1,2,4-triazol-4-ylaminomethylene)-1,3-dioxane-4,6-dione monohydrate","Acta Crystallographica Section E","2005","61","8","o2642","o2643","10.1107/S1600536805022750","","","0.71069","MoKα","","0.0689","0.0379","","","0.0908","0.1029","","","","","","1.027","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206497","18.363","0.004","5.2852","0.0014","12.509","0.002","90","","90","","90","","1214","0.5","173","2","173","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","(2-Chloroanilino)acetophenone","","- C14 H12 Cl N O -","- C14 H12 Cl N O -","- C56 H48 Cl4 N4 O4 -","4","1","NC6038","Anilkumar, Haleyur G.; Yathirajan, Hemmige S.; Nagaraja, Padmarajaiah; Bolte, Michael","(2-Chloroanilino)acetophenone","Acta Crystallographica Section E","2005","61","8","o2551","o2552","10.1107/S1600536805022051","","","0.71073","MoKα","","0.0615","0.05","","","0.1341","0.1457","","","","","","1.036","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206498","6.9881","0.0006","8.9148","0.0006","16.6251","0.001","98.91","0.005","95.882","0.006","112.244","0.006","932.24","0.13","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","N,N'-Dimethylpiperazinium(2+) bis[methylenehydrogendiphosphonate(1-)]","","- C8 H26 N2 O12 P4 -","- C8 H26 N2 O12 P4 -","- C16 H52 N4 O24 P8 -","2","1","NC6040","Yuan, Zhan-Hui; Clegg, William","<i>N</i>,<i>N</i>'-Dimethylpiperazinium(2+) bis[methylenehydrogendiphosphonate(1{-})]","Acta Crystallographica Section E","2005","61","8","o2635","o2637","10.1107/S1600536805022737","","","0.71073","MoKα","","0.0344","0.0276","","","0.0711","0.0746","","","","","","1.057","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206499","8.7063","0.0012","14.7402","0.0016","24.965","0.002","90","","90","","90","","3203.8","0.6","292","1","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","catena-Poly[[[(acetonitrile-κN)silver(I)]-μ-[bis(pyrimidin-2- ylsulfanyl)methane-κ^2^N^1^:N^1'^] tetrafluoroborate]","","- C11 H11 Ag B F4 N5 S2 -","- C11 H11 Ag B F4 N5 S2 -","- C88 H88 Ag8 B8 F32 N40 S16 -","8","1","NG6148","Hou, Bao-Hong; Zhou, Li-Na; Wei, Hong-Yuan; Wang, Jing-Kang; Chen, Wei","<i>catena</i>-Poly[[[(acetonitrile-κ<i>N</i>)silver(I)]-μ-bis(pyrimidin-2-ylsulfanyl)methane-κ^2^<i>N</i>^1^:<i>N</i>^1'^] tetrafluoroborate]","Acta Crystallographica Section E","2005","61","8","m1658","m1659","10.1107/S1600536805019288","","","0.71073","MoKα","","0.0696","0.0431","","","0.1059","0.1273","","","","","","1.181","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206500","6.5799","0.0006","27.775","0.003","7.0321","0.0006","90","","103.19","0.004","90","","1251.3","0.2","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","μ-N,N'-bis(pyridin-4-ylmethylene)hydrazine- bis[diaqua(iminodiacetato)copper(II)]","","- C20 H28 Cu2 N6 O12 -","- C20 H28 Cu2 N6 O12 -","- C40 H56 Cu4 N12 O24 -","2","0.5","NG6155","Kundu, Nabanita; Chatterjee, Pabitra Baran; Chaudhury, Muktimoy; Tiekink, Edward R. T.","A binuclear iminodiacetato‒copper(II) complex with the <i>N</i>,<i>N</i>'-bis(pyridin-4-ylmethylene)hydrazine ligand as spacer","Acta Crystallographica Section E","2005","61","8","m1583","m1585","10.1107/S1600536805021549","","","0.71069","MoKα","","0.076","0.047","","","0.105","0.116","","","","","","1.01","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206501","10.328","0.001","7.732","0.001","23.656","0.002","90","","114.38","0.01","90","","1720.6","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[N,N'-Bis(3-methylsalicylidene)propane-1,3-diaminato]copper(II)","","- C19 H20 Cu N2 O2 -","- C19 H20 Cu N2 O2 -","- C76 H80 Cu4 N8 O8 -","4","1","NG6159","You, Zhong-Lu","[<i>N</i>,<i>N</i>'-Bis(3-methylsalicylidene)propane-1,3-diaminato]copper(II)","Acta Crystallographica Section E","2005","61","8","m1559","m1560","10.1107/S1600536805021823","","","0.71073","MoKα","","0.1257","0.0666","","","0.1453","0.1749","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206502","8.2351","0.0003","25.3931","0.0008","8.654","0.0003","90","","104.851","0.001","90","","1749.23","0.1","295","3","295","3","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Tris(1H-imidazole-κN^3^)(thiodiacetato-κ^3^O,S,O')nickel(II) monohydrate","","- C13 H18 N6 Ni O5 S -","- C13 H18 N6 Ni O5 S -","- C52 H72 N24 Ni4 O20 S4 -","4","1","NG6161","Tian-Tian Pan; Jian-Rong Su; Duan-Jun Xu","Tris(1<i>H</i>-imidazole-κ<i>N</i>^3^)(thiodiacetato-κ^3^<i>O</i>,<i>S</i>,<i>O</i>')nickel(II) monohydrate","Acta Crystallographica Section E","2005","61","8","m1576","m1578","10.1107/S160053680502194X","","","0.71073","MoKα","","0.06","0.049","","","0.107","0.111","","","","","","1.177","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206503","15.0412","0.0001","12.5376","0.0001","23.243","0.0002","90","","103.191","0.001","90","","4267.53","0.06","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Nonacarbonyl-μ~3~N,N-diethyldithiocarbamato-κ^3^S:S:S'-μ-hydrido- triosmium(3 Os—Os)","","- C14 H11 N O9 Os3 S2 -","- C14 H11 N O9 Os3 S2 -","- C112 H88 N8 O72 Os24 S16 -","8","2","NG6168","Garcia-Orozco, Ivan; Pastor, Cesar J.; Souto, Beatriz; Delgado, Esther; Hernández, Elisa; Alvarez-Toledano, Cecilio","Nonacarbonyl-μ~3~-<i>N</i>,<i>N</i>-diethyldithiocarbamato-κ^3^<i>S</i>:<i>S</i>:<i>S</i>'-μ-hydrido-triosmium(3 <i>Os</i>—<i>Os</i>)","Acta Crystallographica Section E","2005","61","8","m1644","m1645","10.1107/S160053680502338X","","","1.54178","CuKα","","0.0298","0.0283","","","0.0658","0.0668","","","","","","1.18","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206504","5.7135","0.0005","12.6191","0.001","17.1549","0.0014","90","","90","","90","","1236.86","0.18","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-Methylphenyl benzyl sulfone","","- C14 H14 O2 S -","- C14 H14 O2 S -","- C56 H56 O8 S4 -","4","1","OB6530","Yong-Shu Li; Wei-Ke Su","4-Methylphenyl benzyl sulfone","Acta Crystallographica Section E","2005","61","8","o2450","o2451","10.1107/S1600536805021434","","","0.71073","MoKα","","0.0348","0.0332","","","0.0847","0.0857","","","","","","1.063","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206505","8.652","0.002","19.808","0.009","20.934","0.004","90","","90","","90","","3588","2","295","2","295","2","","","","","","","","5","F 2 d d","F -2d 2","43","","","","- C5 H11 N O5 S -","- C5 H11 N O5 S -","- C80 H176 N16 O80 S16 -","16","1","OB6532","Wei Zhou; Chun-Nian Xia; Wen Feng; Wei-Xiao Hu","2-Methyl-2-nitropropyl methanesulfonate","Acta Crystallographica Section E","2005","61","8","o2523","o2524","10.1107/S160053680501799X","","","0.71073","MoKα","","0.0319","0.027","","","0.0747","0.0781","","","","","","1.143","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206506","4.01","0.001","14.829","0.005","6.111","0.002","90","","93.274","0.002","90","","362.79","0.19","123.1","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C7 H4 Br2 O -","- C7 H4 Br2 O -","- C14 H8 Br4 O2 -","2","0.5","OB6539","Kubo, Kanji; Matsumoto, Taisuke; Mori, Akira","2,7-Dibromo-2,4,6-cycloheptatrien-1-one (2,7-dibromotropone)","Acta Crystallographica Section E","2005","61","8","o2542","o2544","10.1107/S1600536805020210","","","0.7107","MoKα","","","0.019","","","","0.047","","","","","","1.04","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2206507","17.9107","0.0008","11.2522","0.0003","18.9011","0.0007","90","","121.181","0.001","90","","3258.9","0.2","295","1","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C17 H19 N5 -","- C17 H19 N5 -","- C136 H152 N40 -","8","1","OB6540","Tang, Gu-Ping; Gu, Jian-Ming","2-[3-(2-Cyano-2-propyl)-5-(1,2,4-triazol-1-yl)phenyl]-2-methylpropiononitrile","Acta Crystallographica Section E","2005","61","8","o2330","o2331","10.1107/S1600536805020143","","","0.7107","MoKα","","","0.063","","","","0.203","","","","","","1.004","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206508","8.3372","0.0008","9.0754","0.0008","10.1261","0.0009","99.709","0.001","114.142","0.001","104.871","0.001","642.4","0.1","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Tetrakis(2-thiopyridone)platinum(II) dichloride","","- C20 H20 Cl2 N4 Pt S4 -","- C20 H20 Cl2 N4 Pt S4 -","- C20 H20 Cl2 N4 Pt S4 -","1","0.5","OB6541","Mizota, Mina; Yokoyama, Yoshimi; Sakai, Ken","Tetrakis[pyridine-2(1<i>H</i>)-thione-κ<i>S</i>]platinum(II) dichloride","Acta Crystallographica Section E","2005","61","8","m1433","m1435","10.1107/S1600536805020209","","","0.71073","MoKα","","0.0192","0.0186","","","0.0407","0.0408","","","","","","1.022","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206509","9.9393","0.0011","12.778","0.0014","13.989","0.0015","64.306","0.008","80.219","0.009","87.01","0.009","1577.3","0.3","93.1","","","","","","","","","","","4","P -1","-P 1","2","","n-Propyl gallate‒chloroform (3/0.5)","","- C30.5 H36.5 Cl1.5 O15 -","- C30.5 H36.5 Cl1.5 O15 -","- C61 H73 Cl3 O30 -","2","1","OB6542","Iwata, Shohei; Hitachi, Akio; Makino, Takashi; Mizuguchi, Jin","<i>n</i>-Propyl gallate‒chloroform (3/0.5)","Acta Crystallographica Section E","2005","61","8","o2587","o2589","10.1107/S1600536805022154","","","1.5418","CuKα","","","0.063","","","","0.201","","","","","","1.428","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2206510","8.5884","0.0011","11.3727","0.0013","12.553","0.0014","67.648","0.009","74.069","0.01","81.488","0.011","1089.1","0.2","93.1","","","","","","","","","","","4","P -1","-P 1","2","","n-Propyl gallate‒acetonitrile (2/1)","","- C22 H27 N O10 -","- C22 H27 N O10 -","- C44 H54 N2 O20 -","2","1","OB6543","Mizuguchi, Jin; Hitachi, Akio; Iwata, Shohei; Makino, Takashi","<i>n</i>-Propyl gallate‒acetonitrile (2/1)","Acta Crystallographica Section E","2005","61","8","o2593","o2595","10.1107/S1600536805022166","","","1.5418","CuKα","","","0.0471","","","","0.1339","","","","","","1.888","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206511","9.9439","0.0012","12.8538","0.0016","13.841","0.0017","63.311","0.01","80.168","0.011","86.706","0.011","1557","0.4","93.1","","","","","","","","","","","4","P -1","-P 1","2","","n-Propyl gallate‒dichloromethane (3/0.5)","","- C30.5 H37 Cl O15 -","- C30.5 H37 Cl O15 -","- C61 H74 Cl2 O30 -","2","1","OB6544","Hitachi, Akio; Makino, Takashi; Iwata, Shohei; Mizuguchi, Jin","<i>n</i>-Propyl gallate‒dichloromethane (3/0.5)","Acta Crystallographica Section E","2005","61","8","o2590","o2592","10.1107/S1600536805022178","","","1.5418","CuKα","","","0.045","","","","0.134","","","","","","1.051","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2206512","20.843","0.003","11.964","0.001","9.983","0.001","90","","90","","90","","2489.4","0.5","293","2","293","2","","","","","","","","5","P n n a","-P 2a 2bc","52","","catena-Poly[[[tripyridinecopper(II)]-μ-m-phenylenedioxydiacetato] monohydrate]","","- C25 H25 Cu N3 O7 -","- C25 H25 Cu N3 O7 -","- C100 H100 Cu4 N12 O28 -","4","0.5","OB6545","Hong, Xian-Lan; Li, Yi-Zhi; Jiang, Guo-Qing; Bai, Jun-Feng","<i>catena</i>-Poly[[[tripyridinecopper(II)]-μ-<i>m</i>-phenylenedioxydiacetato] monohydrate]","Acta Crystallographica Section E","2005","61","8","m1556","m1558","10.1107/S1600536805021550","","","0.71073","MoKα","","0.0762","0.0507","","","0.128","0.1318","","","","","","1.046","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206513","9.605","0.0019","10.767","0.002","13.374","0.003","90","","104.36","0.03","90","","1339.9","0.5","288","2","288","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Benzoylmethylene-1-methyl-3,4-dihydroquinoxalin-2(1H)-one","","- C17 H14 N2 O2 -","- C17 H14 N2 O2 -","- C68 H56 N8 O8 -","4","1","OB6546","Yun Liu; Zhi-Feng Lu; Yong-Miao Shen; Jian-Hua Xu","3-Benzoylmethylene-1-methyl-3,4-dihydroquinoxalin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2005","61","8","o2753","o2754","10.1107/S1600536805023664","","","0.71073","MoKα","","0.1004","0.0457","","","0.0958","0.1074","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206514","3.7819","0.0011","5.8314","0.0016","16.754","0.004","94.956","0.016","95.136","0.017","90.66","0.018","366.56","0.17","93.1","","","","","","","","","","","5","P -1","-P 1","2","","2,9-Dichloro-5,12-dihydroquino[2,3-b]acridine-7,14-dione","","- C20 H10 Cl2 N2 O2 -","- C20 H10 Cl2 N2 O2 -","- C20 H10 Cl2 N2 O2 -","1","0.5","OB6549","Senju, Takatoshi; Nishimura, Naoko; Hoki, Tomonori; Mizuguchi, Jin","2,9-Dichloro-5,12-dihydroquino[2,3-<i>b</i>]acridine-7,14-dione (red phase)","Acta Crystallographica Section E","2005","61","8","o2596","o2598","10.1107/S1600536805022257","","","1.5418","CuKα","","","0.0564","","","","0.1784","","","","","","1.141","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206515","9.8855","0.0007","9.8856","0.0007","20.3477","0.0014","90","","90","","90","","1988.5","0.2","292","2","292","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(1R,2R,2'S)-2-(4-Methylphenylsulfonamido)-1-(pyrrolidine-2'- carboxamido)cyclohexane","","- C18 H27 N3 O3 S -","- C18 H27 N3 O3 S -","- C72 H108 N12 O12 S4 -","4","1","OB6551","Xinyong Li; Jiarong Chen; Xianggao Meng; Wenjing Xiao","(1<i>R</i>,2<i>R</i>,2'<i>S</i>)-2-(4-Methylphenylsulfonamido)-1-(pyrrolidine-2'-carboxamido)cyclohexane","Acta Crystallographica Section E","2005","61","8","o2730","o2732","10.1107/S1600536805023718","","","0.71073","MoKα","","0.0829","0.0562","","","0.0891","0.1006","","","","","","0.945","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206516","8.1512","0.0005","12.4991","0.0006","18.928","0.001","100.708","0.001","96.0057","0.0008","94.896","0.003","1873.59","0.18","295","1","","","","","","","","","","5","P -1","-P 1","2","","4-[4-Dimethylamino-1-(4-fluorophenyl)-1-hydroxybutyl]-3- (hydroxymethyl)benzonitrile","","- C20 H23 F N2 O2 -","- C20 H23 F N2 O2 -","- C80 H92 F4 N8 O8 -","4","2","OB6553","Jian-Ming Gu; Yun-Wu Wang; Xiu-Rong Hu","4-[4-Dimethylamino-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)benzonitrile","Acta Crystallographica Section E","2005","61","8","o2691","o2693","10.1107/S1600536805023032","","","0.7107","MoKα","","","0.056","","","","0.169","","","","","","1.002","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2206517","9.0105","0.0009","12.633","0.003","13.717","0.003","64.45","0.03","73.85","0.03","88.61","0.03","1344.8","0.6","293","","293","","","","","","","","","5","P -1","-P 1","2","","N,N'-Butanedioylbis(5-ferrocenyl-3-methyl-1H-pyrazole)","","- C32 H30 Fe2 N4 O2 -","- C32 H30 Fe2 N4 O2 -","- C64 H60 Fe4 N8 O4 -","2","1","OM6240","Yao-Cheng Shi; Chun-Xia Sui; Hong-Jian Cheng","<i>N</i>,<i>N</i>'-Butanedioylbis(5-ferrocenyl-3-methyl-1<i>H</i>-pyrazole)","Acta Crystallographica Section E","2005","61","8","m1563","m1565","10.1107/S1600536805021768","","","0.71073","MoKα","","0.0772","0.0614","","","0.194","0.2068","","","","","","0.928","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206518","9.58","0.003","10.015","0.001","10.67","0.002","77.38","0.01","85.68","0.02","73.55","0.01","958","0.4","299","2","299","2","","","","","","","","3","P -1","-P 1","2","","trans-4-Phenyl-3-tetrahydropyranol","","- C11 H14 O2 -","- C11 H14 O2 -","- C44 H56 O8 -","4","2","OM6243","Hartung, Jens; Svoboda, Ingrid; Schmidt, Philipp; Fuess, Hartmut","Racemic <i>trans</i>-4-phenylperhydropyran-3-ol","Acta Crystallographica Section E","2005","61","8","o2395","o2397","10.1107/S1600536805020222","","","0.71073","MoKα","","0.1647","0.0616","","","0.1506","0.2084","","","","","","0.903","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206519","8.5227","0.0007","33.412","0.003","12.2415","0.001","90","","93.702","0.002","90","","3478.6","0.5","292","2","292","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H38 Cl2 Cu2 F2 N6 O13 -","- C25 H38 Cl2 Cu2 F2 N6 O13 -","- C100 H152 Cl8 Cu8 F8 N24 O52 -","4","1","OM6245","Lei Chen; Hong Zhou; Zhiquan Pan; Xuelei Hu; Bo Liu","Bis[μ-4-fluoro-6-hydroxymethyl-2-(2,5,8-triazaoct-1-enyl)phenolato]dicopper(II) bis(perchlorate) methanol solvate","Acta Crystallographica Section E","2005","61","8","m1467","m1469","10.1107/S1600536805020234","","","0.71073","MoKα","","0.0679","0.0466","","","0.0975","0.1037","","","","","","1.014","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206520","25.317","0.005","13.762","0.003","11.542","0.002","90","","114.26","0.03","90","","3666.3","1.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","trans-(Isothiocyanato-κN)phenylbis(triphenylphosphine-κP)platinum(II)","","- C43 H35 N P2 Pt S -","- C43 H35 N P2 Pt S -","- C172 H140 N4 P8 Pt4 S4 -","4","0.5","OM6249","Otto, Stefanus; Roodt, Andreas","<i>trans</i>-(Isothiocyanato-κ<i>N</i>)phenylbis(triphenylphosphine-κ<i>P</i>)platinum(II)","Acta Crystallographica Section E","2005","61","8","m1545","m1547","10.1107/S1600536805021756","","","0.71073","MoKα","","0.0983","0.0389","","","0.0682","0.0789","","","","","","0.873","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2206521","13.878","0.001","13.878","0.001","60.239","0.007","90","","90","","120","","10047.6","1.6","100","2","100","2","","","","","","","","5","R -3 :H","-R 3","148","","Tetra-μ~3~iodo-tetrakis[(tri-tert-butylphosphine)copper(I)]","","- C48 H108 Cu4 I4 P4 -","- C48 H108 Cu4 I4 P4 -","- C288 H648 Cu24 I24 P24 -","6","0.333333","OM6250","Medina, Iliana; Mague, Joel T.; Fink, Mark J.","Tetra-μ~3~-iodo-tetrakis[(tri-<i>tert</i>-butylphosphine)copper(I)]","Acta Crystallographica Section E","2005","61","8","m1550","m1552","10.1107/S1600536805021744","","","0.71073","MoKα","","0.0318","0.027","","","0.0551","0.0566","","","","","","1.105","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206522","11.7224","0.0009","15.1064","0.0012","15.2183","0.0011","117.583","0.001","95.397","0.002","103.732","0.001","2254.3","0.3","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","Diaqua-κ^2^O-tris(1,10-phenanthroline)-1κ^2^N,N';2κ^4^N,N'- μ-5-sulfonatoisophthalato-1:2κ^4^O^1^,O^1'^:O^3^,O^3'^-dicopper(II) perchlorate trihydrate","","- C44 H37 Cl Cu2 N6 O16 S -","- C44 H37 Cl Cu2 N6 O16 S -","- C88 H74 Cl2 Cu4 N12 O32 S2 -","2","1","RN6053","Wei-Dong Wang; Xin-Hua Li","Diaqua-κ^2^<i>O</i>-tris(1,10-phenanthroline)-1κ^2^<i>N</i>,<i>N</i>';2κ^4^<i>N</i>,<i>N</i>'-μ-5-sulfonatoisophthalato-1:2κ^4^<i>O</i>^1^,<i>O</i>^1'^:<i>O</i>^3^,<i>O</i>^3'^-dicopper(II) perchlorate trihydrate","Acta Crystallographica Section E","2005","61","8","m1534","m1536","10.1107/S1600536805021641","","","0.71073","MoKα","","0.0854","0.0651","","","0.1469","0.1583","","","","","","1.058","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2206523","8.3481","0.0015","17.667","0.003","9.9401","0.0018","90","","108.86","0.003","90","","1387.3","0.4","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(4-Chloro-6-morpholino-1,3,5-triazin-2-yl)aniline","","- C13 H14 Cl N5 O -","- C13 H14 Cl N5 O -","- C52 H56 Cl4 N20 O4 -","4","1","RN6054","Li, Yang; Ding, Li; Zeng, Tao; Li, Jiang-Sheng; Dong, Chuan-Ming; Yan, Xi-Long","<i>N</i>-(4-Chloro-6-morpholino-1,3,5-triazin-2-yl)aniline","Acta Crystallographica Section E","2005","61","8","o2345","o2346","10.1107/S1600536805020040","","","0.71073","MoKα","","0.0742","0.0387","","","0.0875","0.104","","","","","","1.007","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206524","8.1306","0.0009","9.7446","0.0011","15.7357","0.0018","90","","90","","90","","1246.7","0.2","292","2","292","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1-(2-Methylpropyl)-1H-imidazo[4,5-c]quinolin-4-amine","","- C14 H16 N4 -","- C14 H16 N4 -","- C56 H64 N16 -","4","1","RN6056","Jing Cheng; Zuming liu; Guangfu Yang","1-(2-Methylpropyl)-1<i>H</i>-imidazo[4,5-<i>c</i>]quinolin-4-amine","Acta Crystallographica Section E","2005","61","8","o2638","o2639","10.1107/S1600536805022579","","","0.71073","MoKα","","0.0558","0.0467","","","0.1094","0.1149","","","","","","1.011","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206525","12.924","0.004","8.644","0.003","21.25","0.005","90","","103.25","0.02","90","","2310.7","1.2","173.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H21 Cl4 N3 O6 S2 -","- C16 H21 Cl4 N3 O6 S2 -","- C64 H84 Cl16 N12 O24 S8 -","4","1","RZ6063","Lee, Jianchao; Takahashi, Hiroki; Matsui, Yoshihiko; Hori, Toshitaka","Iminodiethylenediaminium bis(2,5-dichlorobenzenesulfonate)","Acta Crystallographica Section E","2005","61","8","o2403","o2405","10.1107/S1600536805013711","","","0.71073","MoKα","","0.0382","0.0315","","","0.0319","0.0337","","","","","","1.033","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206526","11.838","0.003","14.976","0.003","10.611","0.003","90","","95.996","0.004","90","","1870.9","0.8","294","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(5-((1H-1,2,4-Triazol-1-yl)methyl)-4-phenyl-4H-1,2,4-triazol-3-ylthio)-1-(4- fluorophenyl)ethanone","","- C19 H15 F N6 O S -","- C19 H15 F N6 O S -","- C76 H60 F4 N24 O4 S4 -","4","1","RZ6095","Xu, Liang-Zhong; Li, Kai; Liu, Jin-Hong; Zhou, Kai; Li, Wei-Hua; Hou, Bao-Rong","1-(4-Fluorophenyl)-2-{4-phenyl-5-[(1<i>H</i>-1,2,4-triazol-1-yl)methyl]-4<i>H</i>-1,2,4-triazol-3-ylsulfanyl}ethanone","Acta Crystallographica Section E","2005","61","8","o2338","o2339","10.1107/S1600536805020301","","","0.71073","MoKα","","0.1004","0.0415","","","0.0813","0.1023","","","","","","1.003","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206527","9.4761","0.0006","10.0886","0.0006","10.5018","0.0006","90","","111.697","0.006","90","","932.85","0.1","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(S)-(+)-2-(2-biphenyl-2-yl-1-methylethyl)-4,5-dihydro-1H-imidazolium hydrogen oxalate","","- C20 H22 N2 O4 -","- C20 H22 N2 O4 -","- C40 H44 N4 O8 -","2","1","RZ6096","Giannella, Mario; Gentili, Francesco; Bruni, Bruno; Messori, Luigi; Di Vaira, Massimo","(<i>S</i>)-(+)-2-[2-(Biphenyl-2-yl)-1-methylethyl]-4,5-dihydro-1<i>H</i>-imidazolium hydrogen oxalate","Acta Crystallographica Section E","2005","61","8","o2376","o2378","10.1107/S1600536805020398","","","1.5418","CuKα","","0.0366","0.0346","","","0.0823","0.083","","","","","","0.993","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206528","15.6032","0.0007","15.9227","0.0007","16.3694","0.0007","90","","90","","90","","4066.9","0.3","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","2,5-Dimethyl-7-phenylsulfonyl-5,6-dihydroindolo[2,3-c]benzazepin-12-one","","- C24 H20 N2 O3 S -","- C24 H20 N2 O3 S -","- C192 H160 N16 O24 S8 -","8","2","RZ6097","T. Ravishankar; K. Chinnakali; N. Arumugam; P. C. Srinivasan; Anwar Usman; Hoong-Kun Fun","2,5-Dimethyl-7-phenylsulfonyl-5,6-dihydroindolo[2,3-<i>c</i>]benzazepin-12-one","Acta Crystallographica Section E","2005","61","8","o2410","o2412","10.1107/S1600536805020842","","","0.71073","MoKα","","0.0855","0.0506","","","0.1079","0.1231","","","","","","1.085","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206529","33.177","0.002","9.085","0.0006","16.1712","0.001","90","","111.802","0.001","90","","4525.6","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","3-Bromo-2-(4-bromo-2,5-dimethoxybenzyl)-1-phenylsulfonyl-1H-indole","","- C23 H19 Br2 N O4 S -","- C23 H19 Br2 N O4 S -","- C184 H152 Br16 N8 O32 S8 -","8","1","RZ6098","T. Ravishankar; K. Chinnakali; N. Arumugam; P. C. Srinivasan; Anwar Usman; Hoong-Kun Fun","3-Bromo-2-(4-bromo-2,5-dimethoxybenzyl)-1-phenylsulfonyl-1<i>H</i>-indole","Acta Crystallographica Section E","2005","61","8","o2455","o2457","10.1107/S1600536805021574","","","0.71073","MoKα","","0.0995","0.0443","","","0.0952","0.1162","","","","","","1.008","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206530","9.826","0.004","13.596","0.002","11.99","0.005","90","","102.06","0.04","90","","1566.4","1","303","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(Acetylsulfanyl)pyridine N-oxide","","- C7 H7 N O3 S -","- C7 H7 N O3 S -","- C56 H56 N8 O24 S8 -","8","2","RZ6099","Samuel Robinson Jebas; Thailampillai Balasubramanian; Balasingh Ravidurai; Sudalaiandi Kumaresan","2-(Acetylsulfanyl)pyridine <i>N</i>-oxide","Acta Crystallographica Section E","2005","61","8","o2677","o2678","10.1107/S1600536805022415","","","0.71073","MoKα","","","0.052","","","","0.1496","","","","","","1.019","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206531","6.7834","0.0014","17.953","0.004","15.247","0.003","90","","92.53","0.03","90","","1855","0.7","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,6-Bis(3,4,5-trimethylpyrazol-1-ylmethyl)pyridine","","- C19 H25 N5 -","- C19 H25 N5 -","- C76 H100 N20 -","4","1","RZ6100","Giuseppe Agrifoglio; Arquímedes R. Karam; Edgar L. Catarí; Teresa González; Reinaldo Atencio","2,6-Bis(3,4,5-trimethylpyrazol-1-ylmethyl)pyridine","Acta Crystallographica Section E","2005","61","8","o2613","o2616","10.1107/S1600536805022427","","","0.71073","MoKα","","0.2352","0.0938","","","0.2122","0.2954","","","","","","0.988","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206532","11.002","0.002","15.3","0.003","14.309","0.003","90","","94.28","0.03","90","","2401.9","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diisothiocyanatotetrakis(1-methyl-1H-imidazole-κN^3^)nickel(II)","","- C18 H24 N10 Ni S2 -","- C18 H24 N10 Ni S2 -","- C72 H96 N40 Ni4 S8 -","4","1","RZ6101","Fa-Qian Liu; Fang-Fang Jian; Guang-Ye Liu; Lu-De Lu; Xu-Jie Yang; Xin Wang","Diisothiocyanatotetrakis(1-methyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)nickel(II)","Acta Crystallographica Section E","2005","61","8","m1568","m1570","10.1107/S1600536805021987","","","0.71073","MoKα","","0.1188","0.0515","","","0.1369","0.1623","","","","","","1.075","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206533","8.3497","0.0001","23.039","0.0002","21.3683","0.0002","90","","93.342","0.001","90","","4103.6","0.07","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[silver(I)-μ~2~-1,1'-dimethyl-2,2'-biimidazole-κN^3^:N^3'^] nitrate 1.167-hydrate methanol 0.33-solvate]","","- C8.33 H13.33 Ag N3 O4.5 -","- C8.33333 H13.3333 Ag N5 O4.5 -","- C100 H160 Ag12 N60 O54 -","12","3","RZ6102","Letitia M. Gruia; Fernande D. Rochon; André L. Beauchamp","<i>catena</i>-Poly[[silver(I)-μ~2~-1,1'-dimethyl-2,2'-biimidazole-κ<i>N</i>^3^:<i>N</i>^3'^] nitrate 1.167-hydrate methanol 0.33-solvate]","Acta Crystallographica Section E","2005","61","8","m1604","m1606","10.1107/S1600536805023044","","","1.54178","CuKα","","0.0635","0.047","","","0.135","0.1447","","","","","","1.018","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2206534","7.181","0.005","8.069","0.005","13.015","0.005","90","","90","","90","","754.1","0.8","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","4,5-Dimethoxycyclopent-4-ene-1,2,3-trione","","- C7 H6 O5 -","- C7 H6 O5 -","- C28 H24 O20 -","4","1","RZ6103","Chen, Hong-Yu; Fang, Qi; Xue, Gang; Yu, Wen-Tao"