# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-05-20T06:37:26+02:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'I 41/a :2' 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
"1000322","13.455","0.001","13.455","0.001","18.902","0.001","90","","90","","90","","3422","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","Tetragallium tris(phosphate) difluoride dihydroxide dihydrate","","- F2 Ga4 H6 O16 P3 -","- F2 Ga4 H6 O16 P3 -","- F16 Ga32 H48 O128 P24 -","8","0.5","","Loiseau, T; Ferey, G","Oxyfluorinated microporous compounds: III. Synthesis and crystal structure of a new gallophosphate: Ga~4~P~3~O~12~F~2~(OH)~2~(H~2~O)~2~, 0.5 DABCO","European Journal of Solid State Inorganic Chemistry","1993","30","","369","381","","","","","","","0.043","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001406","21.278","0.002","21.278","0.002","4.9209","0.0006","90","","90","","90","","2228","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Potassium molybdenum(III) diphosphate (0.25/1/1)","","- K0.25 Mo O7 P2 -","- K0.25 Mo O7 P2 -","- K4 Mo16 O112 P32 -","16","1","","Leclaire, a; Borel, M M; Grandin, A; Raveau, B","Two Molybdenum Diphosphates with a Tunnel Structure Involving Mo(III): K Mo P~2~ O~7~ and K~.17~ Mo P~2~ O~7~","Journal of Solid State Chemistry","1989","78","","220","226","10.1016/0022-4596(89)90100-X","","","","","","0.063","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001750","5.1625","0.0004","5.1625","0.0004","11.1616","0.0009","90","","90","","90","","297.5","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Cadmium molybdenum tungsten oxide (1/0.5/0.5/4)","","- Cd Mo0.5 O4 W0.5 -","- Cd Mo0.5 O4 W0.5 -","- Cd4 Mo2 O16 W2 -","4","0.25","","Daturi, M; Borel, M M; Leclaire, A; Savary, L; Costentin, G; Lavalley, J C; Raveau, B","Crystallographic and catalytic studies of a new solid solution Cd Mox W1-x O4","Journal de Chimie Physique et de Physico-Chimie Biologique","1996","93","","2043","2053","","","","","","","0.021","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001800","5.156","0.001","5.156","0.001","11.196","0.001","90","","90","","90","","297.6","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Cadmium molybdate","","- Cd Mo O4 -","- Cd Mo O4 -","- Cd4 Mo4 O16 -","4","0.25","","Daturi, M; Busca, G; Borel, M M; Leclaire, A; Piaggio, P","Vibrational and XRD study of the system Cd W O4 - Cd Mo O4","Journal of Physical Chemistry","1997","101","","4358","4369","10.1021/jp963008x","","","","","","0.067","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1001802","5.158","0.001","5.158","0.001","11.187","0.001","90","","90","","90","","297.6","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Cadmium molybdenum tungsten oxide (1/0.75/0.25/4)","","- Cd Mo0.75 O4 W0.25 -","- Cd Mo0.75 O4 W0.25 -","- Cd4 Mo3 O16 W -","4","0.25","","Daturi, M; Busca, G; Borel, M M; Leclaire, A; Piaggio, P","Vibrational and XRD study of the system Cd W O4 - Cd Mo O4","Journal of Physical Chemistry","1997","101","","4358","4369","10.1021/jp963008x","","","","","","0.039","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1004117","7.28296","0.00009","7.28296","0.00009","6.43407","0.0001","90","","90","","90","","341.3","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Europium bismuth vanadate (0.28/0.72/1)","","- Bi0.72 Eu0.28 O4 V -","- Bi0.72 Eu0.28 O4 V -","- Bi2.88 Eu1.12 O16 V4 -","4","0.25","","Blin, J L; Lorriaux-Rubbens, A; Wallart, F; Wignacourt, J P","Synthesis and structural investigation of the Eu1-x Bix V O4 scheelite phase: X-ray diffraction, Raman scattering and Eu(3+) luminescence","Journal of Materials Chemistry","1996","6","3","385","389","10.1039/jm9960600385","","","","","","0.026","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1007106","5.045","","5.045","","11.167","","90","","90","","90","","284.2","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Cerium(IV) germanium oxide","","- Ce Ge O4 -","","","4","0.25","","Bertaut, F; Durif, A","Etude des germanates de zirconium, cerium et thorium.","Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965)","1954","238","","2173","2175","","","","","","","","","","","","","","","","","","","","","","","176729","2020-10-21","18:00:00",""
"1007107","5.14","","5.14","","11.54","","90","","90","","90","","304.9","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Thorium germanium oxide","","- Ge O4 Th -","","","4","0.25","","Bertaut, F; Durif, A","Etude des germanates de zirconium, cerium et thorium.","Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965)","1954","238","","2173","2175","","","","","","","","","","","","","","","","","","","","","","","176729","2020-10-21","18:00:00",""
"1010067","5.8","","5.8","","13.17","","90","","90","","90","","443","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Rubidium rhenate","","- O4 Rb Re -","","","4","0.25","","Jaeger, F M; Beintema, J","The crystalstructure of cesium-, thallium- and rubidiumperrhenates","Proceedings of the Koninklijke Nederlandse Academie van Wetenschappen","1933","36","","523","528","","","","","","","","","","","","","","","","","","","","","","","176729","2020-10-21","18:00:00",""
"1010835","5.35","0.03","5.35","0.03","11.92","0.03","90","","90","","90","","341.2","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Silver rhenate","","- Ag O4 Re -","","","4","0.25","","Buschendorf, F","Die Kristallstruktur des Silberperrhenats.","Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie","1933","20","","237","244","","","","","","","","","","","","","","","","","","","","","","","176729","2020-10-21","18:00:00",""
"1100455","8.263","0.002","8.263","0.002","34.909","0.007","90","","90","","90","","2383.49","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C6 H18 As2 Br N -","- C12 As4 Br N -","- C96 As32 Br8 N8 -","8","0.5","","Hillwig, R.; Harms, K.; Dehnicke, K.; Müller, U.","Elementorganisch substituierte Ammonium-Salze. Die Kristallstrukturen von [HN(SnMe~3~)~3~]I, [H~2~N(SnMe~3~)~2~][SnMe~3~Cl~2~] und [N(AsMe~3~)~2~]Br","Zeitschrift fuer Anorganische und Allgemeine Chemie","1997","623","1-6","676","682","10.1002/zaac.199762301107","","","","","","","","","","","","","","","","","","","","","has coordinates","177947","2020-10-21","18:00:00",""
"1100547","28.454","0.003","28.454","0.003","11.167","0.002","90","","90","","90","","9041.14","","","","","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C80 H128 N4 P4 Si4 Zn4 -","- C236 H416 N16 P16 Si16 Zn16 -","- C944 H1664 N64 P64 Si64 Zn64 -","4","0.25","","Krieger, M.; Gould, R. O.; Neumüller, B.; Harms, K.; Dehnicke, K.","Phosphaniminato-Komplexe des Zinks mit Hydrido-, Alkinylo-, Alkenylo- und Amido-Liganden","Zeitschrift fuer Anorganische und Allgemeine Chemie","1998","624","9","1434","1442","10.1002/(sici)1521-3749(199809)624:9<1434::aid-zaac1434>3.0.co;2-7","","","","","","","","","","","","","","","","","","","","","has coordinates","177952","2020-10-21","18:00:00",""
"1100660","26.0133","0.0006","26.0133","0.0006","15.898","0.0008","90","","90","","90","","10758","0.6","293.1","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C26 H41 N3 O5 -","- C26 H41 N3 O5 -","- C416 H656 N48 O80 -","16","1","","Akimoto, Toshio; Hirayama, Noriaki","Crystal Structure of Ciclopirox Olamine","Analytical Sciences: X-ray Structure Analysis Online","2003","19","","x21","x22","10.2116/analscix.19.x21","","","1.5419","CuKα","","","0.068","","","","0.141","","","","","","1.293","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1100752","17.5832","0.0004","17.5832","0.0004","12.1881","0.0006","90","","90","","90","","3768.2","0.2","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C10 H10 Cl5 Cu5 N2 S2 -","- C10 H10 Cl5 Cu5 N2 S2 -","- C80 H80 Cl40 Cu40 N16 S16 -","8","0.5","","Jian-Kai Cheng; Yu-Biao Chen; Ling Wu; Jian Zhang; Yi-Hang Wen; Zhao-Ji Li; Yuan-Gen Yao","A 3-D Noninterpenetrating Diamondoid Network of a Decanuclear Copper(I) Complex","Inorganic Chemistry","2005","44","","3386","3388","10.1021/ic050301f","","","0.71073","MoKα","","","0.0559","","","0.1001","0.1216","","","","","","1.063","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1100847","33.5236","0.001","33.5236","0.001","8.7943","0.0004","90","","90","","90","","9883.3","0.6","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H38 B4 Cl2 Ru2 -","- C20 H38 B4 Cl2 Ru2 -","- C320 H608 B64 Cl32 Ru32 -","16","1","","Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C.","Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and closo-2,3-(η^5^-C~5~Me~5~Ru)~2~B~6~H~3~Cl~3~","Organometallics","2005","24","10","2473","2480","10.1021/om050083y","","","0.71073","MoKα","","0.026","0.0241","","","0.0576","0.0586","","","","","","1.132","","","","has coordinates","211332","2020-10-21","18:00:00",""
"1501467","5.63","","5.63","","12.867","","90","","90","","90","","407.844","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- K O4 Tc -","- K O4 Tc -","- K4 O16 Tc4 -","4","0.25","","Errico, Leonardo; Darriba, German; Renteria, Mario; Zhengning, Tang; Emmerich, Heike; Cottenier, Stefaan","Nuclear quadrupole moment of the 99Tc ground state","Physical Review B","2008","77","","195118","","10.1103/PhysRevB.77.195118","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1501468","5.758","","5.758","","13.54","","90","","90","","90","","448.913","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- O4 Rb Tc -","- O4 Rb Tc -","- O16 Rb4 Tc4 -","4","0.25","","Errico, Leonardo; Darriba, German; Renteria, Mario; Zhengning, Tang; Emmerich, Heike; Cottenier, Stefaan","Nuclear quadrupole moment of the 99Tc ground state","Physical Review B","2008","77","","195118","","10.1103/PhysRevB.77.195118","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1501624","23.0674","0.0006","23.0674","0.0006","16.1892","0.0006","90","","90","","90","","8614.4","0.4","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C85 H116 N24 O12 -","- C85 H116 N24 O12 -","- C340 H464 N96 O48 -","4","0.25","","Philippe Brunet; Eric Demers; Thierry Maris; Gary D. Enright; James D. Wuest","Designing Permeable Molecular Crystals That React with External Agents To Give Crystalline Products","Angewandte Chemie International Edition","2003","42","","5303","5306","10.1002/anie.200352252","","","0.71073","MoKα","","0.0974","0.0795","","","0.2306","0.2493","","","","","","1.076","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1501625","20.988","0.002","20.988","0.002","16.816","0.003","90","","90","","90","","7407.4","1.7","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C64.2 H80.8 N24 S3.2 -","- C71.2488 H80.4192 N24 S3.1048 -","- C284.995 H321.677 N96 S12.4192 -","4","0.25","","Philippe Brunet; Eric Demers; Thierry Maris; Gary D. Enright; James D. Wuest","Designing Permeable Molecular Crystals That React with External Agents To Give Crystalline Products","Angewandte Chemie International Edition","2003","42","","5303","5306","10.1002/anie.200352252","","","0.71073","MoKα","","0.2324","0.121","","","0.333","0.3894","","","","","","1.306","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1501626","23.233","0.016","23.233","0.016","16.274","0.017","90","","90","","90","","8784","13","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C46 H30 N12 S -","- C36.6 H32.54 N12 S0.94 -","- C292.8 H260.32 N96 S7.52 -","8","0.5","","Philippe Brunet; Eric Demers; Thierry Maris; Gary D. Enright; James D. Wuest","Designing Permeable Molecular Crystals That React with External Agents To Give Crystalline Products","Angewandte Chemie International Edition","2003","42","","5303","5306","10.1002/anie.200352252","","","0.71073","MoKα","","0.2278","0.1888","","","0.4321","0.4611","","","","","","1.766","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1503564","13.9875","0.0018","13.9875","0.0018","31.44","0.007","90","","90","","90","","6151.2","1.8","293","2","293","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C18 H22 N2 -","- C18 H22 N2 -","- C288 H352 N32 -","16","1","","Mahanta, Sanjeev P.; Kumar, B. Sathish; Baskaran, Sambath; Sivasankar, Chinnappan; Panda, Pradeepta K.","Colorimetric sensing of fluoride ion by new expanded calix[4]pyrrole through anion-π interaction.","Organic letters","2012","14","2","548","551","10.1021/ol203165x","","","0.71073","MoKα","","0.2735","0.0933","","","0.1229","0.1742","","","","","","1.013","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1503744","20.435","0.0013","20.435","","28.385","0.0019","90","","90","","90","","11853.3","1.1","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C32 H33 N O6 -","- C32 H29 N O6 -","- C512 H464 N16 O96 -","16","1","","Cheng, Xin; Liang, Fushun; Shi, Fan; Zhang, Lei; Liu, Qun","One-pot tandem double-aldol reaction/aza-addition of acetylacetamides and o-phthalaldehyde leading to spiroindan-2,2'-pyrrolidines.","Organic letters","2009","11","1","93","96","10.1021/ol802507y","","","0.71069","MoKα","","0.1066","0.0739","","","0.1783","0.2001","","","","","","1.124","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1503998","28.2866","0.0003","28.2866","0.0003","14.7993","0.0003","90","","90","","90","","11841.4","0.3","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C54 H74 Cl6 O4 Se4 -","- C54 H74 Cl6 O4 Se4 -","- C432 H592 Cl48 O32 Se32 -","8","0.5","","Thomas, Joice; Maes, Wouter; Robeyns, Koen; Ovaere, Margriet; Van Meervelt, Luc; Smet, Mario; Dehaen, Wim","Homoselenacalix[n]arenes.","Organic letters","2009","11","14","3040","3043","10.1021/ol901044m","","","1.54178","CuKα","","0.0451","0.0357","","","0.0931","0.1017","","","","","","1.008","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1504006","16.9796","0.0004","16.9796","0.0004","11.4331","0.0003","90","","90","","90","","3296.24","0.14","296","2","296","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C9 H9 N3 -","- C9 H9 N3 -","- C144 H144 N48 -","16","1","","Liang, Lei; Li, Zhengkai; Zhou, Xiangge","Pyridine N-oxides as ligands in Cu-catalyzed N-arylation of imidazoles in water.","Organic letters","2009","11","15","3294","3297","10.1021/ol9010773","","","0.71073","MoKα","","0.0956","0.0391","","","0.0649","0.0717","","","","","","0.992","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1504439","34.2576","0.0006","34.2576","0.0006","13.1525","0.0005","90","","90","","90","","15435.6","0.7","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C36 H23 B F20 O4 -","- C36 H23 B F20 O4 -","- C576 H368 B16 F320 O64 -","16","1","","Zhang, Yuetao; Chen, Eugene Y.-X.","Structure−Reactivity Relationships in Bimolecular-Activated Monomer Polymerization of (Meth)acrylates Using Oxidatively Activated Group 14 Ketene Acetals","Macromolecules","2008","41","17","6353","","10.1021/ma801125y","","","0.71073","MoKα","","0.1011","0.0544","","","0.1221","0.1358","","","","","","1.09","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505576","34.7389","0.0005","34.7389","0.0005","14.3489","0.0002","90","","90","","90","","17316.1","0.4","295","2","295","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C80 H104 Cl2 N2 Na2 O26 -","- C80 H104 Cl2 N2 Na2 O26 -","- C640 H832 Cl16 N16 Na16 O208 -","8","0.5","","Hsueh, Sheng-Yao; Lai, Chien-Chen; Liu, Yi-Hung; Wang, Yu; Peng, Shie-Ming; Chiu, Sheng-Hsien","Protecting a squaraine near-IR dye through its incorporation in a slippage-derived [2]rotaxane.","Organic letters","2007","9","22","4523","4526","10.1021/ol702050w","","","0.71073","MoKα","","0.1578","0.0838","","","0.2386","0.2796","","","","","","1.291","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505672","30.683","0.005","30.683","0.005","8.352","0.002","90","","90","","90","","7863","3","193","2","193","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C16 H29 Cl N4 O4 -","- C16 H29 Cl N4 O4 -","- C256 H464 Cl16 N64 O64 -","16","1","","Barkalow, Jufang H.; Breting, Jeffrey; Gaede, Bruce J.; Haight, Anthony R.; Henry, Rodger; Kotecki, Brian; Mei, Jianzhang; Pearl, Kurt B.; Tedrow, Jason S.; Viswanath, Shekhar K.","Process Development for ABT-472, a Benzimidazole PARP Inhibitor","Organic Process Research & Development","2007","11","4","693","","10.1021/op7000194","","","0.71073","MoKα","","0.0658","0.0563","","","0.152","0.1617","","","","","","1.059","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505785","25.548","0.0001","25.548","0.0001","18.319","0.0001","90","","90","","90","","11956.8","0.09","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C30 H40 N2 O4 Ti -","- C30 H40 N2 O4 Ti -","- C480 H640 N32 O64 Ti16 -","16","1","","Chmura, Amanda J.; Davidson, Matthew G.; Jones, Matthew D.; Lunn, Matthew D.; Mahon, Mary F.; Johnson, Anthony F.; Khunkamchoo, Prasert; Roberts, Sian L.; Wong, Stephen S. F.","Group 4 Complexes with Aminebisphenolate Ligands and Their Application for the Ring Opening Polymerization of Cyclic Esters","Macromolecules","2006","39","21","7250","","10.1021/ma061028j","","","0.71073","MoKα","","0.0621","0.0484","","","0.1287","0.1476","","","","","","1.045","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505944","18.011","0.005","18.011","0.005","14.279","0.008","90","","90","","90","","4632","3","193","2","193","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C12 H15 N O2 -","- C12 H15 N O2 -","- C192 H240 N16 O32 -","16","1","","Evans, David A.; Aye, Yimon; Wu, Jimmy","Asymmetric, anti-selective scandium-catalyzed Sakurai additions to glyoxyamide. Applications to the syntheses of N-boc D-alloisoleucine and D-isoleucine.","Organic letters","2006","8","10","2071","2073","10.1021/ol0604771","","","0.71073","MoKα","","0.0518","0.036","","","0.0835","0.0925","","","","","","1.019","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506891","31.901","0.0019","31.901","0.0019","15.8767","0.0009","90","","90","","90","","16157.3","1.6","143","1","143","1","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C31.25 H29.25 Cl8.75 N5 O4 Ru S2 -","- C31.0613 H28.865 Cl8.184 N5 O4 Ru S2 -","- C496.98 H461.84 Cl130.944 N80 O64 Ru16 S32 -","16","1","","Zhang, Lilu; Carroll, Patrick; Meggers, Eric","Ruthenium complexes as protein kinase inhibitors.","Organic letters","2004","6","4","521","523","10.1021/ol036283s","","","0.71069","MoKα","","0.071","0.0606","","","0.1594","0.1749","","","","","","1.049","","","","has coordinates","198632","2020-10-21","18:00:00",""
"1507392","22.812","0.003","22.812","0.003","11.423","0.003","90","","90","","90","","5944.4","1.9","223","2","223","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C36 H28 N4 O2 Zn -","- C36 H28 N4 O2 Zn -","- C288 H224 N32 O16 Zn8 -","8","0.5","","Teo, Tang-Lin; Vetrichelvan, Muthalagu; Lai, Yee-Hing","Infinite three-dimensional polymeric metalloporphyrin network via six-coordinate Zn(II) and two axial oxygen donors.","Organic letters","2003","5","22","4207","4210","10.1021/ol035665v","","","0.71073","MoKα","","0.1022","0.0593","","","0.1184","0.1338","","","","","","1.02","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1507685","31.319","0.003","31.319","0.003","13.7184","0.0019","90","","90","","90","","13456","3","223","2","223","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C32 H44 B N5 O2 -","- C32 H44 B N5 O2 -","- C512 H704 B16 N80 O32 -","16","1","","Merling, Everett; Lamm, Vladimir; Geib, Steven J.; Lacôte, Emmanuel; Curran, Dennis P.","[3 + 2]-dipolar cycloaddition reactions of an N-heterocyclic carbene boryl azide.","Organic letters","2012","14","11","2690","2693","10.1021/ol300851m","","","0.71073","MoKα","","0.0858","0.053","","","0.1345","0.1502","","","","","","0.987","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1507854","22.319","0.004","22.319","0.004","8.5732","0.0013","90","","90","","90","","4270.6","1.3","150","2","150","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C12 H20 O -","- C12 H20 O -","- C192 H320 O16 -","16","1","","Gao, Peng; Cook, Silas P.","A reductive-Heck approach to the hydroazulene ring system: a formal synthesis of the englerins.","Organic letters","2012","14","13","3340","3343","10.1021/ol3013167","","","0.71073","MoKα","","0.0723","0.056","","","0.1222","0.132","","","","","","1.051","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1507946","20.5155","0.0015","20.5155","0.0015","15.0907","0.0013","90","","90","","90","","6351.5","0.9","294.1","","294.1","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C56 H48.2 Mn2 N24 Nb O8.2 -","- C56 H48 Mn2 N24 Nb O8.2 -","- C224 H192 Mn8 N96 Nb4 O32.8 -","4","0.25","","Ohkoshi, Shin-Ichi; Imoto, Kenta; Tsunobuchi, Yoshihide; Takano, Shinjiro; Tokoro, Hiroko","Light-induced spin-crossover magnet.","Nature chemistry","2011","3","7","564","569","10.1038/nchem.1067","","","0.71075","MoKα","","","0.0454","","","","0.1497","","","","","","1.239","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1507947","20.2001","0.0004","20.2001","0.0004","14.9565","0.0005","90","","90","","90","","6102.9","0.3","","","293","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C56 Fe2 N24 Nb O10 -","- C56 Fe2 N24 Nb O10 -","- C224 Fe8 N96 Nb4 O40 -","4","0.25","","Ohkoshi, Shin-Ichi; Imoto, Kenta; Tsunobuchi, Yoshihide; Takano, Shinjiro; Tokoro, Hiroko","Light-induced spin-crossover magnet.","Nature chemistry","2011","3","7","564","569","10.1038/nchem.1067","powder diffraction","","1.54059","CuKα~1~","","","","","","","","","0.025","2.23","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1508074","31.4069","0.0019","31.4069","0.0019","23.029","0.003","90","","90","","90","","22716","4","140","1","140","1","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C26 H48 N2 Si2 U -","- C26 H48 N2 Si2 U -","- C832 H1536 N64 Si64 U32 -","32","2","","Thomson, Robert K.; Cantat, Thibault; Scott, Brian L.; Morris, David E.; Batista, Enrique R.; Kiplinger, Jaqueline L.","Uranium azide photolysis results in C-H bond activation and provides evidence for a terminal uranium nitride.","Nature chemistry","2010","2","9","723","729","10.1038/nchem.705","","","0.71073","MoKα","","0.0478","0.0294","","","0.067","0.0737","","","","","","1.014","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1508099","27.886","0.004","27.886","0.004","30.086","0.004","90","","90","","90","","23396","6","90","2","90","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C132 H160 N48 O36 Pd6 S16 -","- C132 H160 N48 O36 Pd6 S16 -","- C528 H640 N192 O144 Pd24 S64 -","4","0.25","","Inokuma, Yasuhide; Arai, Tatsuhiko; Fujita, Makoto","Networked molecular cages as crystalline sponges for fullerenes and other guests.","Nature chemistry","2010","2","9","780","783","10.1038/nchem.742","","","0.71073","MoKα","","0.0633","0.0535","","","0.138","0.1457","","","","","","1.077","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1508194","38.9676","0.0003","38.9676","0.0003","14.2661","0.0001","90","","90","","90","","21662.7","0.3","90","","90","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C60.25 H99 Ge O2 -","- C60.25 H99 Ge O2 -","- C964 H1584 Ge16 O32 -","16","1","","Li, Liangchun; Fukawa, Tomohide; Matsuo, Tsukasa; Hashizume, Daisuke; Fueno, Hiroyuki; Tanaka, Kazuyoshi; Tamao, Kohei","A stable germanone as the first isolated heavy ketone with a terminal oxygen atom.","Nature chemistry","2012","4","5","361","365","10.1038/nchem.1305","","","0.71073","MoKα","","0.0587","0.0376","","","0.0901","0.0999","","","","","","1.016","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1508472","23.6138","0.0003","23.6138","0.0003","18.8371","0.0004","90","","90","","90","","10503.8","0.3","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C7 H8 B Br3 F4 N2 -","- C7 H8 B Br3 F4 N2 -","- C224 H256 B32 Br96 F128 N64 -","32","2","","Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig","Halogen Interactions in 2,4,5-Tribromoimidazolium Salts","Crystals","2012","2","3","1017","1033","10.3390/cryst2031017","","","0.71073","MoKα","","0.0597","0.0427","","","0.0974","0.1053","","","","","","1.041","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1508475","23.4674","0.0004","23.4674","0.0004","18.6531","0.0004","90","","90","","90","","10272.6","0.3","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C7 H6 B Br3 F4 N2 -","- C7 H6 B Br3 F4 N2 -","- C224 H192 B32 Br96 F128 N64 -","32","2","","Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig","Halogen Interactions in 2,4,5-Tribromoimidazolium Salts","Crystals","2012","2","3","1017","1033","10.3390/cryst2031017","","","0.71073","MoKα","","0.057","0.0436","","","0.1031","0.1096","","","","","","1.067","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1509390","5.379","","5.379","","12.037","","90","","90","","90","","348.274","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Ag (I O4)","","- Ag I O4 -","- Ag I O4 -","- Ag4 I4 O16 -","4","0.25","","Birkenbach, L.; Buschendorf, F.","Darstellung und Krystallstruktur des normalen (meta-) Silverperjodats","Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie","1932","16","","102","112","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510361","6.4297","","6.4297","","10.251","","90","","90","","90","","423.787","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Ba (Au2 O4)","","- Au2 Ba O4 -","- Au2 Ba O4 -","- Au8 Ba4 O16 -","4","0.25","","Kraemer, G.; Jansen, M.","M Au2 O4 (M=Sr, Ba), die ersten Oxoaurate(III) mit dreidimensional vernetzter anionischer Teilstruktur","Journal of Solid State Chemistry","1995","118","","247","253","10.1006/jssc.1995.1340","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510452","6.1823","","6.1823","","10.1704","","90","","90","","90","","388.721","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Sr (Au2 O4)","","- Au2 O4 Sr -","- Au2 O4 Sr -","- Au8 O16 Sr4 -","4","0.25","","Jansen, M.; Kraemer, G.","M Au2 O4 (M=Sr, Ba), die ersten Oxoaurate(III) mit dreidimensional vernetzter anionischer Teilstruktur","Journal of Solid State Chemistry","1995","118","","247","253","10.1006/jssc.1995.1340","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510828","16.086","","16.086","","30.488","","90","","90","","90","","7889.06","","","","","","","","","","","","","2","I 41/a :2","-I 4ad","88","","","","- B2 S3 -","- B2 S3 -","- B200 S300 -","100","6.25","","Sasaki, T.; Uheda, K.; Endo, T.; Yamashita, T.; Takizawa, H.","High-pressure synthesis and crystal structure of B2 S3","Journal of Solid State Chemistry","2002","166","","164","170","10.1006/jssc.2002.9575","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1511369","6.4118","","6.4118","","27.551","","90","","90","","90","","1132.65","","","","","","","","","","","","","2","I 41/a :2","-I 4ad","88","","","","- B10 F12 -","- B10 F12 -","- B40 F48 -","4","0.25","","Timms, P.L.; Pardoe, J.A.J.; Norman, N.C.; Rankin, D.W.H.; Parsons, S.; Mackie, I.; Pulham, C.R.","The surprising structures of B8 F12 and B10 F12","Angew. Chem. Int. ed.","2003","42","","571","573","10.1002/anie.200390164","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1512299","20.591","0.002","20.591","0.002","18.738","0.004","90","","90","","90","","7945","2","200","2","200","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C25 H22 N O2.5 -","- C25 H22 N O2.5 -","- C400 H352 N16 O40 -","16","1","","Somai Magar, Krishna Bahadur; Lee, Yong Rok","Synthesis of Diverse Indene Derivatives from 1-Diazonaphthalen-2(1H)-ones via Thermal Cascade Reactions.","Organic letters","2013","15","17","4288","4291","10.1021/ol4019908","","","0.71073","MoKα","","0.1712","0.0618","","","0.1621","0.2101","","","","","","0.936","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1512640","20.9614","0.0003","20.9614","0.0003","16.1294","0.0005","90","","90","","90","","7086.9","0.3","173","2","173","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C63 H76 Co N4 Na O25 S4 -","- C44 H28 Co N4 Na O18 S4 -","- C176 H112 Co4 N16 Na4 O72 S16 -","4","0.25","","Sadhna Mathura; Alvaro S. de Sousa; Manuel A. Fernandes; Helder M. Marques","5,10,15,20-Tetra-p-phenylsulfonyporphinatocobalt(III), a water-soluble Co(III) porphyrin","Inorganica Chimica Acta","2012","392","","108","111","10.1016/j.ica.2012.05.021","","","0.71073","MoKα","","0.086","0.0661","","","0.185","0.1955","","","","","","1.093","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512998","22.447","0.002","22.447","0.002","9.628","0.001","90","","90","","90","","4851.2","0.8","173","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C40 H56 Ni4 O20 -","- C40 H56 Ni4 O20 -","- C160 H224 Ni16 O80 -","4","0.25","","Shu-Hua Zhang; Yi Dong Zhang; Hua Hong Zou; Jing Jing Guo; He Ping Li; You Song; Hong Liang","A family of cubane cobalt and nickel clusters: Syntheses, structures and magnetic properties","Inorganica Chimica Acta","2013","396","","119","125","10.1016/j.ica.2012.10.032","","","0.71073","MoKα","","0.0617","0.0358","","","0.08","0.0934","","","","","","1.069","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1513000","22.105","0.002","22.105","0.002","9.754","0.002","90","","90","","90","","4766.1","1.2","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C40 H56 Co4 O20 -","- C40 H56 Co4 O20 -","- C160 H224 Co16 O80 -","4","0.25","","Shu-Hua Zhang; Yi Dong Zhang; Hua Hong Zou; Jing Jing Guo; He Ping Li; You Song; Hong Liang","A family of cubane cobalt and nickel clusters: Syntheses, structures and magnetic properties","Inorganica Chimica Acta","2013","396","","119","125","10.1016/j.ica.2012.10.032","","","0.71073","MoKα","","0.073","0.0538","","","0.1331","0.1478","","","","","","1.058","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513577","26.127","0.009","26.127","0.009","3.7926","0.0009","90","","90","","90","","2588.9","1.4","150","2","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","3,4-dichlorophenol","","","- C6 H4 Cl2 O -","- C6 H4 Cl2 O -","- C96 H64 Cl32 O16 -","16","1","","Mukherjee, Arijit; Desiraju, Gautam R.","Halogen bonds in some dihalogenated phenols: applications to crystal engineering","IUCrJ","2014","1","1","49","60","10.1107/S2052252513025657","","","0.71073","MoKα","","0.0544","0.0409","","","0.0896","0.0956","","","","","","1.076","","","","has coordinates,has Fobs","176729","2020-10-21","18:00:00",""
"1513578","26.186","0.008","26.186","0.008","3.8144","0.0008","90","","90","","90","","2615.6","1.3","200","2","200","2","","","","","","","","4","I 41/a :2","-I 4ad","88","3,4-dichlorophenol","","","- C6 H4 Cl2 O -","- C6 H4 Cl2 O -","- C96 H64 Cl32 O16 -","16","1","","Mukherjee, Arijit; Desiraju, Gautam R.","Halogen bonds in some dihalogenated phenols: applications to crystal engineering","IUCrJ","2014","1","1","49","60","10.1107/S2052252513025657","","","0.71073","MoKα","","0.0583","0.0416","","","0.0991","0.1072","","","","","","1.058","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513579","26.251","0.01","26.251","0.01","3.8524","0.0011","90","","90","","90","","2654.7","1.6","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","3,4-dichlorophenol","","","- C6 H4 Cl2 O -","- C6 H4 Cl2 O -","- C96 H64 Cl32 O16 -","16","1","","Mukherjee, Arijit; Desiraju, Gautam R.","Halogen bonds in some dihalogenated phenols: applications to crystal engineering","IUCrJ","2014","1","1","49","60","10.1107/S2052252513025657","","","0.71073","MoKα","","0.0902","0.0504","","","0.1186","0.1402","","","","","","0.994","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513580","26.419","0.005","26.419","0.005","3.8824","0.0006","90","","90","","90","","2709.8","0.8","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","4-bromo-3-chlorophenol","","","- C6 H4 Br Cl O -","- C6 H4 Br Cl O -","- C96 H64 Br16 Cl16 O16 -","16","1","","Mukherjee, Arijit; Desiraju, Gautam R.","Halogen bonds in some dihalogenated phenols: applications to crystal engineering","IUCrJ","2014","1","1","49","60","10.1107/S2052252513025657","","","0.71073","MoKα","","0.0423","0.0319","","","0.0596","0.0623","","","","","","1.153","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513581","26.465","0.005","26.465","0.005","3.9017","0.0006","90","","90","","90","","2732.7","0.8","200","2","200","2","","","","","","","","5","I 41/a :2","-I 4ad","88","4-bromo-3-chlorophenol","","","- C6 H4 Br Cl O -","- C6 H4 Br Cl O -","- C96 H64 Br16 Cl16 O16 -","16","1","","Mukherjee, Arijit; Desiraju, Gautam R.","Halogen bonds in some dihalogenated phenols: applications to crystal engineering","IUCrJ","2014","1","1","49","60","10.1107/S2052252513025657","","","0.71073","MoKα","","0.0481","0.0342","","","0.0671","0.071","","","","","","1.09","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513582","26.65","0.03","26.65","0.03","3.965","0.003","90","","90","","90","","2816","5","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","4-bromo-3-chlorophenol","","","- C6 H4 Br Cl O -","- C6 H4 Br Cl O -","- C96 H64 Br16 Cl16 O16 -","16","1","","Mukherjee, Arijit; Desiraju, Gautam R.","Halogen bonds in some dihalogenated phenols: applications to crystal engineering","IUCrJ","2014","1","1","49","60","10.1107/S2052252513025657","","","0.71073","MoKα","","0.0755","0.0407","","","0.0727","0.0828","","","","","","1.056","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513896","19.894","0.003","19.894","0.003","13.562","0.002","90","","90","","90","","5367.4","1.4","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C26 H28 Cu F2 N4 O2 S2 -","- C26 H28 Cu F2 N4 O2 S2 -","- C208 H224 Cu8 F16 N32 O16 S16 -","8","0.5","","Liu, Huanhuan; Yang, Wen; Zhou, Weiqun; Xu, Yunlong; Xie, Juan; Li, Mengying","Crystal structures and antimicrobial activities of copper(II) complexes of fluorine-containing thioureido ligands","Inorganica Chimica Acta","2013","405","","387","394","10.1016/j.ica.2013.06.029","","","0.7107","MoKα","","0.1062","0.0764","","","0.1448","0.1601","","","","","","1.004","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1514187","21.452","0.005","21.452","0.005","13.2","0.003","90","","90","","90","","6074","2","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C20 H14 N2 O -","- C20 H14 N2 O -","- C320 H224 N32 O16 -","16","1","","Barilli, Amelia; Atzeri, Corrado; Bassanetti, Irene; Ingoglia, Filippo; Dall'asta, Valeria; Bussolati, Ovidio; Maffini, Monica; Mucchino, Claudio; Marchio, Luciano","Oxidative stress induced by copper and iron complexes with 8-hydroxyquinoline derivatives causes paraptotic death of HeLa cancer cells.","Molecular pharmaceutics","2014","11","4","1151","","10.1021/mp400592n","","","0.71073","MoKα","","0.0923","0.0522","","","0.1108","0.1305","","","","","","1.002","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1514433","17.243","0.003","17.243","0.003","20.157","0.006","90","","90","","90","","5993","2","273","2","273","2","","","","","","","","5","I 41/a :2","-I 4ad","88","bio-MOF-12","","","- C11 H16 Co N6 O3 -","- C11 H16 Co N6 O3 -","- C176 H256 Co16 N96 O48 -","16","1","","Li, Tao; Chen, De-Li; Sullivan, Jeanne E.; Kozlowski, Mark T.; Johnson, J. Karl; Rosi, Nathaniel L.","Systematic modulation and enhancement of CO2 : N2 selectivity and water stability in an isoreticular series of bio-MOF-11 analogues","Chemical Science","2013","4","4","1746","","10.1039/c3sc22207a","","","0.71073","MoKα","","0.0899","0.0474","","","0.0855","0.0985","","","","","","1.032","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1514434","15.7869","0.001","15.7869","0.001","22.328","0.003","90","","90","","90","","5564.7","0.9","273","2","273","2","","","","","","","","5","I 41/a :2","-I 4ad","88","bio-MOF-13","","","- C9 H15 Co N5 O3 -","- C9 H10 Co N5 O3 -","- C144 H160 Co16 N80 O48 -","16","1","","Li, Tao; Chen, De-Li; Sullivan, Jeanne E.; Kozlowski, Mark T.; Johnson, J. Karl; Rosi, Nathaniel L.","Systematic modulation and enhancement of CO2 : N2 selectivity and water stability in an isoreticular series of bio-MOF-11 analogues","Chemical Science","2013","4","4","1746","","10.1039/c3sc22207a","","","0.71073","MoKα","","0.0687","0.0541","","","0.1677","0.1836","","","","","","1.04","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1514435","15.852","0.003","15.852","0.003","22.346","0.008","90","","90","","90","","5615","3","273","2","273","2","","","","","","","","5","I 41/a :2","-I 4ad","88","bio-MOF-14","","","- C10 H14 Co N5 O2.5 -","- C10 H13 Co N5 O2.5 -","- C160 H208 Co16 N80 O40 -","16","1","","Li, Tao; Chen, De-Li; Sullivan, Jeanne E.; Kozlowski, Mark T.; Johnson, J. Karl; Rosi, Nathaniel L.","Systematic modulation and enhancement of CO2 : N2 selectivity and water stability in an isoreticular series of bio-MOF-11 analogues","Chemical Science","2013","4","4","1746","","10.1039/c3sc22207a","","","0.71073","MoKα","","0.1442","0.0658","","","0.1834","0.2298","","","","","","1.029","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1514869","25.3878","0.0003","25.3878","0.0003","72.3758","0.0011","90","","90","","90","","46649.1","1.1","100","2","100","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C190 H130 Ag16 Cl4 F27.89 O0.13 P8 S14 -","- C190 H130 Ag16 Cl4 F27.918 O6 P8 S14 -","- C1520 H1040 Ag128 Cl32 F223.344 O48 P64 S112 -","8","0.5","","Yang, Huayan; Wang, Yu; Zheng, Nanfeng","Stabilizing subnanometer Ag(0) nanoclusters by thiolate and diphosphine ligands and their crystal structures.","Nanoscale","2013","5","7","2674","2677","10.1039/c3nr34328f","","","1.54184","CuKα","","0.0978","0.0694","","","0.1999","0.231","","","","","","1.042","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1514960","13.7494","0.0019","13.7494","0.0019","35.336","0.003","90","","90","","90","","6680.1","1.4","150","2","150","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","Bis[2,6-bis(5-methylpyrazol-3-yl)pyridine]iron(II) ditetrafluoroborate dihydrate","","- C26 H30 B2 F8 Fe N10 O2 -","- C26 H30 B2 F8 Fe N10 O2 -","- C208 H240 B16 F64 Fe8 N80 O16 -","8","0.5","","Roberts, Thomas D.; Tuna, Floriana; Malkin, Tamsin L.; Kilner, Colin A.; Halcrow, Malcolm A.","An iron(ii) complex exhibiting five anhydrous phases, two of which interconvert by spin-crossover with wide hysteresis","Chemical Science","2012","3","2","349","","10.1039/c1sc00584g","","","0.71073","MoKα","","0.0771","0.0428","","","0.1034","0.1211","","","","","","1.009","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1515415","29.2158","0.0005","29.2158","0.0005","7.5897","0.0002","90","","90","","90","","6478.3","0.2","120","2","120","2","","","","","","","Calley Haynes","4","I 41/a :2","-I 4ad","88","","","","- C14 H19 N3 S -","- C14 H19 N3 S -","- C224 H304 N48 S16 -","16","1","","Andrews, Natalie J.; Haynes, Cally J. E.; Light, Mark E.; Moore, Stephen J.; Tong, Christine C.; Davis, Jeffery T.; Harrell Jr., William A.; Gale, Philip A.","Structurally simple lipid bilayer transport agents for chloride and bicarbonate","Chemical Science","2011","2","2","256","","10.1039/c0sc00503g","","","0.71073","MoKα","","0.106","0.0815","","","0.1815","0.193","","","","","","1.059","","","","has coordinates","288505","2023-12-22","15:12:00",""
"1515930","18.241","0.003","18.241","0.003","35.422","0.007","90","","90","","90","","11786","4","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C96 H136 Br4 Cu4 N24 O23 -","- C96 H124 Br4 Cu4 N24 O23 -","- C384 H496 Br16 Cu16 N96 O92 -","4","0.25","","Piepenbrock, Marc-Oliver M.; Clarke, Nigel; Steed, Jonathan W.","Shear induced gelation in a copper(ii) metallogel: new aspects of ion-tunable rheology and gel-reformation by external chemical stimuli","Soft Matter","2010","6","15","3541","","10.1039/c0sm00313a","","","0.71073","MoKα","","0.1354","0.0971","","","0.2266","0.2489","","","","","","1.128","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1515944","28.41","0.03","28.41","0.03","16.57","0.018","90","","90","","90","","13374","2","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C41.5 H29.5 N3 O2.75 -","- C41.5 H29 N3 O2.75 -","- C664 H464 N48 O44 -","16","1","","Colquhoun, Howard M.; Zhu, Zhixue; Cardin, Christine J.; Drew, Michael G. B.; Gan, Yu","Recognition of sequence-information in synthetic copolymer chains by a conformationally-constrained tweezer molecule","Faraday Discussions","2009","143","","205","","10.1039/b900684b","","","0.71073","MoKα","","0.1974","0.101","","","0.247","0.2866","","","","","","1","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516917","26.2339","0.0016","26.2339","0.0016","12.0733","0.0014","90","","90","","90","","8309.1","1.2","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C12 H19 N3 Nd2 O14 -","- C12 H19 N3 Nd2 O14 -","- C192 H304 N48 Nd32 O224 -","16","1","","Limin Zhang; Naiqian Yu; Kaihong Zhang; Ruishuo Qiu; Yixuan Zhao; Wencong Rong; Hong Deng","Syntheses, structure, and properties of a series of three-dimensional lanthanide-based hybrid frameworks","Inorganica Chimica Acta","2013","400","","67","73","","","","0.71073","MoKα","","0.0343","0.0288","","","0.0676","0.0701","","","","","","1.086","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1516918","26.019","0.003","26.019","0.003","12.0188","0.0012","90","","90","","90","","8136.6","1.6","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C12 H19 Eu2 N3 O14 -","- C12 H19 Eu2 N3 O14 -","- C192 H304 Eu32 N48 O224 -","16","1","","Limin Zhang; Naiqian Yu; Kaihong Zhang; Ruishuo Qiu; Yixuan Zhao; Wencong Rong; Hong Deng","Syntheses, structure, and properties of a series of three-dimensional lanthanide-based hybrid frameworks","Inorganica Chimica Acta","2013","400","","67","73","","","","0.71073","MoKα","","0.0498","0.0351","","","0.0613","0.0664","","","","","","1.073","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516919","25.824","0.005","25.824","0.005","11.966","0.003","90","","90","","90","","7980","3","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C12 H19 N3 O14 Tb2 -","- C12 H19 N3 O14 Tb2 -","- C192 H304 N48 O224 Tb32 -","16","1","","Limin Zhang; Naiqian Yu; Kaihong Zhang; Ruishuo Qiu; Yixuan Zhao; Wencong Rong; Hong Deng","Syntheses, structure, and properties of a series of three-dimensional lanthanide-based hybrid frameworks","Inorganica Chimica Acta","2013","400","","67","73","","","","0.71073","MoKα","","0.0308","0.0261","","","0.0622","0.064","","","","","","1.059","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1516920","25.803","0.003","25.803","0.003","11.9679","0.0015","90","","90","","90","","7968.2","1.6","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C12 H19 Dy2 N3 O14 -","- C12 H19 Dy2 N3 O14 -","- C192 H304 Dy32 N48 O224 -","16","1","","Limin Zhang; Naiqian Yu; Kaihong Zhang; Ruishuo Qiu; Yixuan Zhao; Wencong Rong; Hong Deng","Syntheses, structure, and properties of a series of three-dimensional lanthanide-based hybrid frameworks","Inorganica Chimica Acta","2013","400","","67","73","","","","0.71073","MoKα","","0.0686","0.0551","","","0.1027","0.1097","","","","","","1.067","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1517132","19.904","0.003","19.904","0.003","26.18","0.005","90","","90","","90","","10372","3","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C28 H24 Co N4 O5 -","- C28 H24 Co N4 O5 -","- C448 H384 Co16 N64 O80 -","16","1","","Guang-Feng Hou; Bo Wen; Ying-Hui Yu; Jin-Sheng Gao; Xiao-Dan Wang; Peng-Fei Yan","Two novel 2-fold interpenetration frameworks constructed by 4,4'-bis(1H-imidazol-1-yl-methyl)biphenyl cobalt(II) coordination polymer and the effect of dicarboxylic acid","Inorganica Chimica Acta","2013","402","","128","132","","","","0.71073","MoKα","","0.085","0.0495","","","0.1044","0.1167","","","","","","1.043","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1517248","19.225","0.013","19.225","0.013","10.568","0.009","90","","90","","90","","3906","5","566","2","566","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C10 H12 O4 -","- C10 H12 O4 -","- C160 H192 O64 -","16","1","","Kasare, Sanghratna; Bankar, Siddheshwar K.; Ramasastry, S. S. V.","Expeditious Metal-Free Access to Functionalized Polycyclic Acetals under Mild Aqueous Conditions.","Organic letters","2014","16","16","4284","4287","10.1021/ol501986f","","","0.71073","MoKα","","0.1103","0.0654","","","0.1547","0.184","","","","","","1.055","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1517603","20.324","0.001","20.324","0.001","15.2571","0.0007","90","","90","","90","","6302.2","0.5","223","2","223","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C15 H19 Mn N O5 -","- C15 H19 Mn N O5 -","- C240 H304 Mn16 N16 O80 -","16","1","","Shi-Yao Yang; Hong-Bo Yuan; Xiao-Bin Xu; Rong-Bin Huang","Influential factors on assembly of first-row transition metal coordination polymers","Inorganica Chimica Acta","2013","403","","53","62","","","","0.71073","MoKα","","0.0572","0.0542","","","0.1162","0.1177","","","","","","1.209","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1518579","25.4401","0.0006","25.4401","0.0006","14.9071","0.0004","90","","90","","90","","9647.9","0.4","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C25 H19 N3 O4 -","- C25 H19 N3 O4 -","- C400 H304 N48 O64 -","16","1","","Kumar, N. N. Bhuvan; Kuznetsov, Dmitry M.; Kutateladze, Andrei G.","Intramolecular Cycloadditions of Photogenerated Azaxylylenes with Oxadiazoles Provide Direct Access to Versatile Polyheterocyclic Ketopiperazines Containing a Spiro-oxirane Moiety.","Organic letters","2015","17","3","438","441","10.1021/ol5033909","","","0.71073","MoKα","","0.0738","0.0448","","","0.1433","0.1747","","","","","","0.638","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1518754","36.71","0.003","36.71","0.003","4.9148","0.0006","90","","90","","90","","6623.3","1.1","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","ArFN=NArF","","","- C16 H6 F12 N2 -","- C16 H6 F12 N2 -","- C256 H96 F192 N32 -","16","1","","Tomson, Neil C.; Williams, Kamille D.; Dai, Xuliang; Sproules, Stephen; DeBeer, Serena; Warren, Timothy H.; Wieghardt, Karl","Re-evaluating the Cu K pre-edge XAS transition in complexes with covalent metal‒ligand interactions","Chem. Sci.","2015","6","4","2474","","10.1039/C4SC03294B","","","0.71073","MoKα","","0.1031","0.0515","","","0.1382","0.1668","","","","","","1.024","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519020","18.0201","0.0003","18.0201","0.0003","20.1616","0.0003","90","","90","","90","","6546.96","0.18","","","296","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C17 H23 N O S -","","","16","1","","Hegab, Mohamed I.; Abdel-Megeid, Farouk M. E.; Gad, Farouk A.; Shiba, Sayed A.; Sotofte, Inger; Moller, Jorgen; Senning, Alexander","New Reactions of Thione S-(tert-Alkylimides)","Acta Chemica Scandinavica","1999","53","","284","290","","","x-ray","0.71073","MoKα","","","0.0783","","","0.1929","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1519814","22.5496","0.0004","22.5496","0.0004","6.3581","0.0002","90","","90","","90","","3233","0.13","120","2","120","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C9 H10 O3 -","- C9 H10 O3 -","- C144 H160 O48 -","16","1","","Huth, Susanne L.; Hursthouse, Michael B.","2-Hydroxymethyl-1,4-benzodioxan","Crystal Structure Report Archive","2007","","","365","","","","","0.71073","MoKα","","0.072","0.0467","","","0.1089","0.1221","","","","","","1.052","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520060","19.4824","0.0016","19.4824","0.0016","7.743","0.0005","90","","90","","90","","2939","0.4","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- O9 Te2 Th W -","- O9 Te2 Th W -","- O144 Te32 Th16 W16 -","16","1","","Xiao, Bin; Klinkenberg, Martina; Bosbach, Dirk; Suleimanov, Evgeny V.; Alekseev, Evgeny V.","Effects of Te(IV) Oxo-Anion Incorporation into Thorium Molybdates and Tungstates.","Inorganic chemistry","2015","54","12","5981","5990","10.1021/acs.inorgchem.5b00789","","","0.71073","MoKα","","0.0555","0.0403","","","0.0796","0.0943","","","","","","0.941","","","","has coordinates","201369","2020-10-21","18:00:00",""
"1520536","41.594","0.0009","41.594","0.0009","13.1413","0.0006","90","","90","","90","","22735.2","1.2","149.99","0.19","149.99","0.19","","","","","","","University of Manchester","5","I 41/a :2","-I 4ad","88","","","","- C65 H64 B2 N4 S2 -","- C65 H64 B2 N4 S2 -","- C1040 H1024 B32 N64 S32 -","16","1","","Crossley, D. L.; Cade, I. A.; Clark, E. R.; Escande, A.; Humphries, M. J.; King, S. M.; Vitorica-Yrezabal, I.; Ingleson, M. J.; Turner, M. L.","Enhancing electron affinity and tuning band gap in donor‒acceptor organic semiconductors by benzothiadiazole directed C‒H borylation","Chem. Sci.","2015","6","9","5144","","10.1039/C5SC01800E","","","0.7107","MoKα","","0.0778","0.06","","0.1619","0.152","0.1619","","","","","","0.987","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520791","13.698","","13.698","","5.976","","90","","90","","90","","1121.31","","","","","","","","","","","","","2","I 41/a :2","-I 4ad","88","","","","- Nb O2 -","- Nb O2 -","- Nb32 O64 -","32","2","","Arakcheeva, A.V.; Shamrai, V.F.; Grinevich, V.V.; Meyer, M.; Chapuis, G.","K Nb4 O5 F and Nb O2 crystal structures. Structural aspect of chemical decomposition of K2-x Nb4 O3 (O, F)3 F in the melt of sodium and potassium chlorides","Kristallografiya","1999","44","","6","11","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520847","12.136","","12.136","","30.581","","90","","90","","90","","4504.05","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","H K4 (V10 O10 (H2 O)2 (O H)4 (P O4)7) (H2 O)9","","- H27 K4 O53 P7 V10 -","- K4 O53 P7 V10 -","- K16 O212 P28 V40 -","4","0.25","","Berrah, F.; Guesdon, A.; Leclaire, A.; Provost, J.; Borel, M.M.; Raveau, B.","A V(IV) hydroxyhydrogenomonophosphate with an intersecting tunnel structure: H K4 (V10 O10 (H2 O)2 (O H)4 (P O4)7) . 9(H2 O)","Journal of Solid State Chemistry","1999","148","","189","196","","","","","","","","","","","","","","","","","","","","","","has coordinates","140403","2020-10-21","18:00:00",""
"1521183","5.9199","","5.9199","","13.042","","90","","90","","90","","457.06","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Rb (I O4)","","- I O4 Rb -","- I O4 Rb -","- I4 O16 Rb4 -","4","0.25","","Hoppe, R.; Fischer, D.; Schneider, J.","Zur Kenntnis von Oxyden A (M O4): Ueber Li Mn O4, K Mn O4, Rb Mn O4, Cs Mn O4 sowie Rb I O4 und Cs I O4. (-Was heisst eigentlich ""Die Kristallstruktur von...""?-)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1135","1142","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521216","5.4854","","5.4854","","7.9231","","90","","90","","90","","238.403","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Zr V2 D3.9","","- D3.9 V2 Zr -","- D3.9 V2 Zr -","- D15.6 V8 Zr4 -","4","0.25","","Irodova, A.V.; Andre, G.; Bouree, F.","Phase transition between hydrogen superstructures with k=(001) and k=0 via incommensurate phase in Zr V2 Dx (2.8 <x <3.9)","Journal of Alloys Compd.","2000","302","","159","168","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521517","5.4587","","5.4587","","12.038","","90","","90","","90","","358.701","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","(Pb0.99 La0.01) (W O4)","","- La0.01 O4 Pb0.99 W -","- La0.01 O4 Pb0.99 W -","- La0.04 O16 Pb3.96 W4 -","4","0.25","","Lin, Q.-S.; Feng, X.-Q.; Chen, J.-T.","The structure of a PWO:La(3+) crystal","Journal of Alloys Compd.","2000","307","","245","248","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521775","13.5","","13.5","","28.26","","90","","90","","90","","5150.38","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Mn2 (C O)8 (Ga Mn (C O)5)2","","- C18 Ga2 Mn4 O18 -","- C18 Ga2 Mn4 O18 -","- C144 Ga16 Mn32 O144 -","8","0.5","","Preut, H.; Haupt, H.J.","Die Molekuel- und Kristallstruktur von Octacarbonyl-bis-(mue-(pentacarbonylmangan)gallium(III)-di angan und Octacarbonyl-bis-(mue-(pentacarbonylmangan)indium(III)-dim ngan)","Chemische Berichte","1974","107","","2860","2869","","","","","","","","","","","","","","","","","","","","","","has coordinates","141989","2020-10-21","18:00:00",""
"1522869","10.53","","10.53","","5.53","","90","","90","","90","","613.171","","","","","","","","","","","","","2","I 41/a :2","-I 4ad","88","","","","- Ga Mg -","- Ga Mg -","- Ga16 Mg16 -","16","1","","Schubert, K.; Gauzzi, F.; Frank, K.","Kristallstruktur einiger Mg-B(3)-Phasen","Zeitschrift fuer Metallkunde","1963","54","","422","429","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525203","18.618","","18.618","","10.094","","90","","90","","90","","3498.88","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","In Se I","","- I In Se -","- I In Se -","- I32 In32 Se32 -","32","2","","Sawitzki, G.; Mueller, D.; Hahn, H.","Die Kristallstrukturen von In Te I und In Se I","Materials Research Bulletin","1980","15","","753","762","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526674","11.38","","11.38","","11.29","","90","","90","","90","","1462.1","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Na5 Lu (W O4)4","","- Lu Na5 O16 W4 -","- Lu Na5 O16 W4 -","- Lu4 Na20 O64 W16 -","4","0.25","","Klevtsova, R.F.; Kozeeva, L.P.; Glinskaya, L.A.; Klevtsov, P.V.","The double sodium lutetium tungstates, Na Lu (W O4)2 and Na5 Lu (W O4)4, and their crystal structures","Kristallografiya","1972","17","","768","772","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527204","5.614","","5.614","","12.719","","90","","90","","90","","400.865","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Ba (W O4)","","- Ba O4 W -","- Ba O4 W -","- Ba4 O16 W4 -","4","0.25","","Bylichkina, T.I.; Soleva, L.I.; Porai-Koshits, M.A.; Pobedimskaya, E.A.; Belov, N.V.","Crystal structures of Ba-molybdate and Ba-tungstate","Kristallografiya","1970","15","","165","167","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527205","5.62","","5.62","","12.82","","90","","90","","90","","404.912","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Ba (Mo O4)","","- Ba Mo O4 -","- Ba Mo O4 -","- Ba4 Mo4 O16 -","4","0.25","","Bylichkina, T.I.; Soleva, L.I.; Pobedimskaya, E.A.; Porai-Koshits, M.A.; Belov, N.V.","Crystal structures of Ba-molybdate and Ba-tungstate","Kristallografiya","1970","15","","165","167","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527421","6.892","","6.892","","15.327","","90","","90","","90","","728.027","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","K Tl Cl4","","- Cl4 K Tl -","- Cl4 K Tl -","- Cl16 K4 Tl4 -","4","0.25","","Glaser, J.","Crystal and Molecular Structure of Potassium Tetrachlorothallate(III)","Acta Chemica Scandinavica, Series A: (28,1974-)","1980","34","","75","76","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527935","5.5","","5.5","","12.12","","90","","90","","90","","366.63","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Pb (W O4)","","- O4 Pb W -","- O4 Pb W -","- O16 Pb4 W4 -","4","0.25","","Plakhov, G.F.; Simonov, M.A.; Pobedimskaya, E.A.; Belov, N.V.","The crystal structure of Pb W O4","Kristallografiya","1970","15","","1067","1068","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528417","5.0017","","5.0017","","11.2664","","90","","90","","90","","281.852","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Ho (Cr O4)","","- Cr Ho O4 -","- Cr Ho O4 -","- Cr4 Ho4 O16 -","4","0.25","","Climent-Pascual, E.; Saez-Puche, R.; de Paz, J.R.; Gallardo-Amores, J.M.","Ferromagnetism vs. antiferromagnetism of the dimorphic Ho Cr O4 oxide","Solid State Sciences","2007","9","","574","579","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528780","5.40046","","5.40046","","11.66892","","90","","90","","90","","340.324","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Ce0.21 La0.79 Nb O3.96 -","- Ce0.21 La0.79 Nb O3.96 -","- Ce0.84 La3.16 Nb4 O15.84 -","4","0.25","","Packer, R.J.; Stuart, P.A.; Skinner, S.J.","Structural characterisation of the Ce(1-x) La(x) Nb O(4+delta) solid solutions series: in-situ high-temperature powder diffraction studies","Journal of Solid State Chemistry","2008","181","","1445","1455","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1528782","5.3831","","5.3831","","11.6114","","90","","90","","90","","336.472","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Ce0.22 La0.78 Nb O3.92 -","- Ce0.22 La0.78 Nb O3.92 -","- Ce0.88 La3.12 Nb4 O15.68 -","4","0.25","","Packer, R.J.; Stuart, P.A.; Skinner, S.J.","Structural characterisation of the Ce(1-x) La(x) Nb O(4+delta) solid solutions series: in-situ high-temperature powder diffraction studies","Journal of Solid State Chemistry","2008","181","","1445","1455","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1528785","5.255","","5.255","","11.399","","90","","90","","90","","314.784","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Nd W O3.05 N0.95","","- N0.95 Nd O3.05 W -","- N0.95 Nd O3.05 W -","- N3.8 Nd4 O12.2 W4 -","4","0.25","","Pastrana-Fabregas, R.; Isasi-Marin, J.; Cascales, C.; Saez-Puche, R.","Synthesis, structure and magnetic properties of R-W-O-N (R = Nd and Eu) oxynitrides","Journal of Solid State Chemistry","2007","180","","92","97","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529050","4.491","","4.491","","10.352","","90","","90","","90","","208.79","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Yb (P O4)","","- O4 P Yb -","- O4 P Yb -","- O16 P4 Yb4 -","4","0.25","","Zhang, F.X.; Lian, J.; Lang, M.; Hu, J.; Ewing, R.C.; Wang, Z.W.; Boatner, L.A.","Pressure-induced zircon-type to scheelite-type phase transitions on Yb P O4 and Lu P O4","Journal of Solid State Chemistry","2008","181","","2633","2638","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529051","4.552","","4.552","","10.393","","90","","90","","90","","215.35","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Lu (P O4)","","- Lu O4 P -","- Lu O4 P -","- Lu4 O16 P4 -","4","0.25","","Zhang, F.X.; Boatner, L.A.; Ewing, R.C.; Lian, J.; Wang, Z.W.; Hu, J.; Lang, M.","Pressure-induced zircon-type to scheelite-type phase transitions on Yb P O4 and Lu P O4","Journal of Solid State Chemistry","2008","181","","2633","2638","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529097","11.0549","","11.0549","","8.9735","","90","","90","","90","","1096.66","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","In K (C2 O4)2 (H2 O)4","","- C4 H8 In K O12 -","- C4 H8 In K O12 -","- C16 H32 In4 K4 O48 -","4","0.25","","Audebrand, N.; Jeanneau, E.; Raite, S.; Bataille, T.; Louer, D.","A family of microporous mixed oxalates with isotypic-framework structures based on eight-coordinate metals","Solid State Sciences","2004","6","","579","591","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529098","11.4569","","11.4569","","9.1502","","90","","90","","90","","1201.06","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","Y Rb (C2 O4)2 (H2 O)4","","- C4 H8 O12 Rb Y -","- C4 O12 Rb Y -","- C16 O48 Rb4 Y4 -","4","0.25","","Audebrand, N.; Jeanneau, E.; Bataille, T.; Raite, S.; Louer, D.","A family of microporous mixed oxalates with isotypic-framework structures based on eight-coordinate metals","Solid State Sciences","2004","6","","579","591","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529805","5.484","","5.484","","7.902","","90","","90","","90","","237.647","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Zr V2 D3.6","","- D3.6 V2 Zr -","- D3.604 V2 Zr -","- D14.416 V8 Zr4 -","4","0.25","","Didisheim, J.J.; Yvon, K.; Fisher, P.; Tissot, P.","Order-disorder phase transition in Zr V2 D3.6","Solid State Communications","1981","38","","637","641","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529836","11.409","","11.409","","11.453","","90","","90","","90","","1490.78","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Na5 Tb (Mo O4)4","","- Mo4 Na5 O16 Tb -","- Mo4 Na5 O16 Tb -","- Mo16 Na20 O64 Tb4 -","4","0.25","","Efremov, V.A.; Berezina, T.A.; Trunov, V.K.; Averina, I.M.","Structure of Na5 Tb (Mo O4)4, Na5 Lu (Mo O4)4, and Na5 Lu (W O4)4","Kristallografiya","1980","25","","254","261","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529837","11.323","","11.323","","11.385","","90","","90","","90","","1459.68","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Na5 Lu (Mo O4)4","","- Lu Mo4 Na5 O16 -","- Lu Mo4 Na5 O16 -","- Lu4 Mo16 Na20 O64 -","4","0.25","","Efremov, V.A.; Trunov, V.K.; Berezina, T.A.; Averina, I.M.","Structure of Na5 Tb (Mo O4)4, Na5 Lu (Mo O4)4, and Na5 Lu (W O4)4","Kristallografiya","1980","25","","254","261","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529891","11.387","","11.387","","11.282","","90","","90","","90","","1462.87","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Na5 Lu (W O4)4","","- Lu Na5 O16 W4 -","- Lu Na5 O16 W4 -","- Lu4 Na20 O64 W16 -","4","0.25","","Efremov, V.A.; Berezina, T.A.; Averina, I.M.; Trunov, V.K.","Structure of Na5 Tb (Mo O4)4, Na5 Lu (Mo O4)4, and Na5 Lu (W O4)4","Kristallografiya","1980","25","","254","261","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529895","5.284","","5.284","","11.563","","90","","90","","90","","322.847","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Li Ce (Mo O4)2","","- Ce Li Mo2 O8 -","- Ce Li Mo2 O8 -","- Ce2 Li2 Mo4 O16 -","2","0.125","","Egorova, A.N.; Maier, A.A.; Nevskii, N.N.; Provotorov, M.V.","The crystal structure of Li Ce (Mo O4)2","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1982","18","","2036","2038","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530180","11.03","","11.03","","11.68","","90","","90","","90","","1421","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Na4 Zr (Mo O4)4","","- Mo4 Na4 O16 Zr -","- Mo4 Na4 O16 Zr -","- Mo16 Na16 O64 Zr4 -","4","0.25","","Klevtsova, R.F.; Gaponenko, L.A.; Zolotova, E.S.; Glinskaya, L.A.; Podberezskaya, N.V.; Klevtsov, P.V.","Synthesis and crystal structure of double molybdates of sodium and zirconium","Kristallografiya","1979","24","","751","756","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530327","9.129","","9.129","","18.076","","90","","90","","90","","1506.43","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","K3 Np O2 F5","","- F5 K3 Np O2 -","- F5 K3 Np O2 -","- F40 K24 Np8 O16 -","8","0.5","","Lychev, A.A.; Mashirov, L.G.; Smolin, Yu.I.; Shepelev, Yu.F.","Crystal Structure of K3 Np O2 F5","Radiokhimiya","1984","26","","255","259","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1531435","4.9589","","4.9589","","10.505","","90","","90","","90","","258.325","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Y Li F4","","- F4 Li Y -","- F4 Li Y -","- F16 Li4 Y4 -","4","0.25","","Grzechnik, A.; Syassen, K.; Loa, I.; Hanfland, M.; Gesland, J.Y.","Scheelite to fergusonite phase transition in Y Li F4 at high pressures","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2002","65","","104102-1","104102-6","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1531512","5.447","","5.447","","12.08","","90","","90","","90","","358.411","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","K La (W O4)2","","- K La O8 W2 -","- K La O8 W2 -","- K2 La2 O16 W4 -","2","0.125","","Han, X.-M.; Lin, Z.-B.; Wang, G.-F.; Hu, Z.-S.","Structure of K La (W O4)2 with a novel isolated La polyhedron","Materials Research Innovation","2002","6","","118","121","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532361","9.354","","9.354","","5.746","","90","","90","","90","","502.76","","","","","","","","","","","","","2","I 41/a :2","-I 4ad","88","","","","- Li Si -","- Li Si -","- Li16 Si16 -","16","1","","Stearns, L.A.; McMillan, P.F.; Gryko, J.; Ramachandran, G.K.; Diefenbacher, J.","Lithium monosilicide (Li Si), a low-dimensional silicon-based material prepared by high pressure synthesis: NMR and vibrational spectroscopy and electrical properties characterization","Journal of Solid State Chemistry","2003","173","","251","258","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1532621","6.384","","6.384","","13.227","","90","","90","","90","","539.072","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","K (H4 F5)","","- F5 H4 K -","- F5 H4 K -","- F20 H16 K4 -","4","0.25","","Coyle, B.A.; Schroeder, L.W.; Ibers, J.A.","The structure of potassium tetrahydrogen pentafluoride","Journal of Solid State Chemistry","1970","1","","386","393","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1533324","15.002","","15.002","","7.383","","90","","90","","90","","1661.62","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","K4 (Ge9 O20)","","- Ge9 K4 O20 -","- Ge9 K4 O20 -","- Ge36 K16 O80 -","4","0.25","","Zhou Yaming; Chen Zhenxia; Liu Zhichen; Weng Linhong; Zhao Dongyuan","(H3 O)4 Ge7 O16 * 3(H2 O) and K4 Ge9 O20: two microporous germanates constructed by Ge10 O28 units","Hua Hsueh Hsueh Pao","2003","61","","382","387","","","","","","","","","","","","","","","","","","","","","","has coordinates","159465","2020-10-21","18:00:00",""
"1533363","5.2821","","5.2821","","11.5893","","90","","90","","90","","323.348","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Nd (W O3 N)","","- N Nd O3 W -","- N1.004 Nd O2.996 W -","- N4.016 Nd4 O11.984 W4 -","4","0.25","","Chevire, F.; Tessier, F.; Marchand, R.","New scheelite-type oxynitrides in the systems (R W O3 N) - (A W O4) (R= rare-earth element; A= Ca, Sr) from precursors obtained by the citrate route","Materials Research Bulletin","2004","39","","1091","1101","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1533564","5.3897","","5.3897","","12.0209","","90","","90","","90","","349.194","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Sr (Mo O4)","","- Mo O4 Sr -","- Mo O4 Sr -","- Mo4 O16 Sr4 -","4","0.25","","Azad, A.K.; Eriksson, S.G.; Ivanov, S.A.; Svedlindh, P.; Mathieu, R.; Eriksen, J.; Rundlof, H.","Synthesis, structural and magnetic characterisation of the double perovskite A2 Mn Mo O6 (A = Ba, Sr)","Journal of Alloys Compd.","2004","364","","77","82","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1533793","5.442","","5.442","","12.661","","90","","90","","90","","374.96","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","K (Al H4)","","- Al H4 K -","- Al H4 K -","- Al4 H16 K4 -","4","0.25","","Vajeeston, P.; Ravindran, P.; Fjellvag, H.; Kjekshus, A.","Crystal structure of K Al H4 from first principle calculations","Journal of Alloys Compd.","2004","363","","L7","L11","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1533925","5.0099","","5.0099","","11.3228","","90","","90","","90","","284.192","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Na0.94 (Al0.96 D4.02)","","- Al0.96 D4.02 Na0.94 -","- Al0.9621 D4.024 Na0.9432 -","- Al3.8484 D16.096 Na3.7728 -","4","0.25","","Ozolins, V.; Majzoub, E.H.; Udovic, T.J.","Electronic structure and Rietveld refinement parameters of Ti-doped sodium alanates","Journal of Alloys Compd.","2004","375","","1","10","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1533929","4.83","","4.83","","10.56","","90","","90","","90","","246.353","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Na (Al H4)","","- Al H4 Na -","- Al H4 Na -","- Al4 H16 Na4 -","4","0.25","","Ozolins, V.; Udovic, T.J.; Majzoub, E.H.","Electronic structure and Rietveld refinement parameters of Ti-doped sodium alanates","Journal of Alloys Compd.","2004","375","","1","10","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1533933","4.99","","4.99","","11.07","","90","","90","","90","","275.644","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Na (Al H4)","","- Al H4 Na -","- Al H4 Na -","- Al4 H16 Na4 -","4","0.25","","Ozolins, V.; Majzoub, E.H.; Udovic, T.J.","Electronic structure and Rietveld refinement parameters of Ti-doped sodium alanates","Journal of Alloys Compd.","2004","375","","1","10","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534104","25.108","0.0017","25.108","0.0017","8.6289","0.0008","90","","90","","90","","5439.8","0.7","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C13 H14 B Cl F2 N2 -","- C13 H14 B Cl F2 N2 -","- C208 H224 B16 Cl16 F32 N32 -","16","1","","Zhou, Xin; Yu, Changjiang; Feng, Zeya; Yu, Yang; Wang, Jun; Hao, Erhong; Wei, Yun; Mu, Xiaolong; Jiao, Lijuan","Highly Regioselective α-Chlorination of the BODIPY Chromophore with Copper(II) Chloride.","Organic letters","2015","17","18","4632","4635","10.1021/acs.orglett.5b02383","","","0.71073","MoKα","","0.0707","0.0579","","","0.1733","0.1872","","","","","","1.034","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1535211","12.7957","","12.7957","","15.1085","","90","","90","","90","","2473.71","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Rb Na3 (Sn O4)","","- Na3 O4 Rb Sn -","- Na3 O4 Rb Sn -","- Na48 O64 Rb16 Sn16 -","16","1","","Bernet, K.; Hoppe, R.","Das erste quaternaere Oxostannat mit ""Inselstruktur"": Rb Na3 (Sn O4)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1989","571","","101","112","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535276","6.463","","6.463","","13.163","","90","","90","","90","","549.823","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Gd Li Cl4","","- Cl4 Gd Li -","- Cl4 Gd Li -","- Cl16 Gd4 Li4 -","4","0.25","","Meyer, G.","Gd Li Cl4, ein inverser Chloroscheelit","Zeitschrift fuer Anorganische und Allgemeine Chemie","1984","511","","193","200","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535465","13.772","","13.772","","26.311","","90","","90","","90","","4990.35","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","(N O2) (Zr (N O3)5)","","- N6 O17 Zr -","- N6 O17 Zr -","- N96 O272 Zr16 -","16","1","","Tikhomirov, G.A.; Kemnitz, E.; Morozov, I.; Znamenkov, K.O.; Troyanov, S.","New volatile nitronium nitratometalates: N O2 (Fe (N O3)4) and N O2 (Zr (N O3)5) - synthesis and crystal structure","Zeitschrift fuer Anorganische und Allgemeine Chemie","2002","628","","872","876","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535796","4.9806","","4.9806","","10.075","","90","","90","","90","","249.924","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Li Sc F4","","- F4 Li Sc -","- F4 Li Sc -","- F16 Li4 Sc4 -","4","0.25","","Tyagi, A.K.; Koehler, J.; Weber, J.; Balog, P.","Synthesis and structures of Li3 Sc F6 and high pressure Li Sc F4, luminescence properties of Li Sc F4, a new phase in the system Li F - Sc F3","Journal of Solid State Chemistry","2005","178","","2620","2625","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536286","19.96419","","19.96419","","14.3731","","90","","90","","90","","5728.67","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Eu (Al F5)","","- Al Eu F5 -","- Al Eu F5 -","- Al64 Eu64 F320 -","64","4","","Weil, M.; Kubel, F.","Single crystal growth and classification of Eu Al F5 and solid solutions M(II)1-x Eux Al F5 (M = Ca, Sr, Ba) within the structural family of tetragonal M(II) M(III) F5 compounds","Journal of Solid State Chemistry","2002","164","","150","156","10.1006/jssc.2001.9464","","","","","","","","","","","","","","","","","","","","","has coordinates","288343","2023-12-15","15:49:38",""
"1536289","19.86249","","19.86249","","14.2928","","90","","90","","90","","5638.77","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","(Eu0.81 Ca0.19) (Al F5)","","- Al Ca0.19 Eu0.81 F5 -","- Al Ca0.18925 Eu0.81075 F5 -","- Al64 Ca12.112 Eu51.888 F320 -","64","4","","Weil, M.; Kubel, F.","Single crystal growth and classification of Eu Al F5 and solid solutions M(II)1-x Eux Al F5 (M = Ca, Sr, Ba) within the structural family of tetragonal M(II) M(III) F5 compounds","Journal of Solid State Chemistry","2002","164","","150","156","10.1006/jssc.2001.9464","","","","","","","","","","","","","","","","","","","","","has coordinates","288343","2023-12-15","15:49:38",""
"1536292","19.95099","","19.95099","","14.3656","","90","","90","","90","","5718.11","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","(Eu0.85 Sr0.15) (Al F5)","","- Al Eu0.85 F5 Sr0.15 -","- Al Eu0.84675 F5 Sr0.15325 -","- Al64 Eu54.192 F320 Sr9.808 -","64","4","","Weil, M.; Kubel, F.","Single crystal growth and classification of Eu Al F5 and solid solutions M(II)1-x Eux Al F5 (M = Ca, Sr, Ba) within the structural family of tetragonal M(II) M(III) F5 compounds","Journal of Solid State Chemistry","2002","164","","150","156","10.1006/jssc.2001.9464","","","","","","","","","","","","","","","","","","","","","has coordinates","288343","2023-12-15","15:49:38",""
"1536295","19.9203","","19.9203","","14.3445","","90","","90","","90","","5692.16","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","(Eu0.45 Sr0.55) (Al F5)","","- Al Eu0.45 F5 Sr0.55 -","- Al Eu0.45 F5 Sr0.55 -","- Al64 Eu28.8 F320 Sr35.2 -","64","4","","Weil, M.; Kubel, F.","Single crystal growth and classification of Eu Al F5 and solid solutions M(II)1-x Eux Al F5 (M = Ca, Sr, Ba) within the structural family of tetragonal M(II) M(III) F5 compounds","Journal of Solid State Chemistry","2002","164","","150","156","10.1006/jssc.2001.9464","","","","","","","","","","","","","","","","","","","","","has coordinates","288343","2023-12-15","15:49:38",""
"1536298","19.9036","","19.9036","","14.3279","","90","","90","","90","","5676.04","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","(Eu0.23 Sr0.77) (Al F5)","","- Al Eu0.23 F5 Sr0.77 -","- Al Eu0.22725 F5 Sr0.77275 -","- Al64 Eu14.544 F320 Sr49.456 -","64","4","","Weil, M.; Kubel, F.","Single crystal growth and classification of Eu Al F5 and solid solutions M(II)1-x Eux Al F5 (M = Ca, Sr, Ba) within the structural family of tetragonal M(II) M(III) F5 compounds","Journal of Solid State Chemistry","2002","164","","150","156","10.1006/jssc.2001.9464","","","","","","","","","","","","","","","","","","","","","has coordinates","288343","2023-12-15","15:49:38",""
"1536352","19.9837","","19.9837","","14.3879","","90","","90","","90","","5745.78","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","(Sr0.87 Ba0.13) (Al F5)","","- Al Ba0.13 F5 Sr0.87 -","- Al Ba0.12875 F5 Sr0.87125 -","- Al64 Ba8.24 F320 Sr55.76 -","64","4","","Weil, M.; Kubel, F.","Der Uebergang von isolierten dimeren (Al F4/1 F2/2)2 Gruppen aus kantenverknuepften Oktaedern zu unendlichen linearen (infty 1)(Al F4/1 F2/2)-Ketten eckenverknuepfter Oktaeder in den tetragonalen Verbindungen (Sr, M) Al F5 (M = Ca, Ba) - der Einfluss des unterschiedlichen Substitutionsgrades von Sr durch Ba und Ca","Zeitschrift fuer Anorganische und Allgemeine Chemie","2002","628","","1053","1058","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536665","14.494","","14.494","","9.317","","90","","90","","90","","1957.28","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Bi2 Cd4 O7 -","- Bi2 Cd4 O7 -","- Bi16 Cd32 O56 -","8","0.5","","Kirik, S.D.; Kutvitskii, V.A.; Pervyshina, G.G.; Tsurgan, L.S.; Koryagina, T.I.","Determination of Bi2Cd4O7 crystal structure by X-ray powder method.","Kristallografiya","1992","37","","1410","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1536945","18.524","","18.524","","9.1002","","90","","90","","90","","3122.63","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","(H6 I O6) (H S O4)","","- H7 I O10 S -","- H7 I O10 S -","- H112 I16 O160 S16 -","16","1","","Kraft, T.; Jansen, M.","Zur Existenz des Hexahydroxoperiodonium-Ions - Kristallzuechtung und Strukturanalyse von alpha- und betaH6IO6HSO4","Chemische Berichte","1993","126","","2415","2419","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1538348","13.71","","13.71","","5.985","","90","","90","","90","","1124.96","","","","","","","","","","","","","2","I 41/a :2","-I 4ad","88","","","","- Nb O2 -","- Nb O2 -","- Nb32 O64 -","32","2","","Marinder, B.O.","Note on the crystal structure of niobium dioxide","Acta Chemica Scandinavica (1-27,1973-42,1988)","1961","15","","707","708","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1538349","13.7","","13.7","","5.987","","90","","90","","90","","1123.7","","","","","","","","","","","","","2","I 41/a :2","-I 4ad","88","","","","- Nb O2 -","- Nb O2 -","- Nb32 O64 -","32","2","","Marinder, B.O.","The crystal structure of niobium dioxide","Arkiv foer Kemi","1962","19","","435","446","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1539269","5.247","","5.247","","11.542","","90","","90","","90","","317.763","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","(Am2 (Mo O4)3)1.333","","- Am2.666 Mo3.999 O15.996 -","- Am2.664 Mo4 O16 -","- Am2.664 Mo4 O16 -","1","0.0625","","Tabuteau, A.; Pages, M.","Etude cristallochimique du molybdate et du tungstate d'americium(III): alpha-Am2 (Mo O4)3, alpha-Am2 (W O4)3","Journal of Solid State Chemistry","1978","26","","153","158","","","","","","","","","","","","","","","","","","","","","","has coordinates","168113","2020-10-21","18:00:00",""
"1539994","5.224","","5.224","","11.35","","90","","90","","90","","309.743","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","(Na0.5 Gd0.5) (W O4)0.94","","- Gd0.5 Na0.5 O3.76 W0.94 -","- Gd0.5 Na0.5 O3.8192 W0.94 -","- Gd2 Na2 O15.2768 W3.76 -","4","0.25","","Zharikov, E.V.; Kuz'micheva, G.M.; Smirnov, B.A.; Lis, D.A.; Papin, Yu.M.; Rybakov, V.B.; Subbotin, K.A.","X-ray diffraction study of the structure and defect system of Yb-activated (Na0.5 Gd0.5) W O4 crystals","Neorganicheskie Materialy","2003","39","","200","211","","","","","","","","","","","","","","","","","","","","","","has coordinates","169125","2020-10-21","18:00:00",""
"1539995","5.225","","5.225","","11.326","","90","","90","","90","","309.207","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","(Na0.5 Gd0.5) (W O4)0.78","","- Gd0.5 Na0.5 O3.12 W0.78 -","- Gd0.5 Na0.5 O3.104 W0.776 -","- Gd2 Na2 O12.416 W3.104 -","4","0.25","","Zharikov, E.V.; Kuz'micheva, G.M.; Subbotin, K.A.; Lis, D.A.; Papin, Yu.M.; Rybakov, V.B.; Smirnov, B.A.","X-ray diffraction study of the structure and defect system of Yb-activated (Na0.5 Gd0.5) W O4 crystals","Neorganicheskie Materialy","2003","39","","200","211","","","","","","","","","","","","","","","","","","","","","","has coordinates","169126","2020-10-21","18:00:00",""
"1539996","5.225","","5.225","","11.331","","90","","90","","90","","309.343","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","(Na0.24 Gd0.59 Yb0.17) (W O4)0.98","","- Gd0.59 Na0.24 O3.92 W0.98 Yb0.17 -","- Gd0.592 Na0.24 O3.92 W0.98 Yb0.168 -","- Gd2.368 Na0.96 O15.68 W3.92 Yb0.672 -","4","0.25","","Zharikov, E.V.; Kuz'micheva, G.M.; Lis, D.A.; Papin, Yu.M.; Subbotin, K.A.; Rybakov, V.B.; Smirnov, B.A.","X-ray diffraction study of the structure and defect system of Yb-activated (Na0.5 Gd0.5) W O4 crystals","Neorganicheskie Materialy","2003","39","","200","211","","","","","","","","","","","","","","","","","","","","","","has coordinates","169127","2020-10-21","18:00:00",""
"1540273","5.278","","5.278","","11.503","","90","","90","","90","","320.442","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Na Nd (W O4)2","","- Na Nd O8 W2 -","- Na Nd O8 W2 -","- Na2 Nd2 O16 W4 -","2","0.125","","Li, H.; Hong, G.; Yue, S.","Crystal study of NaLn(WO4)2 (Ln= La, Pr, Nd)","Zhongguo Xitu Xuebao","1990","8","","37","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1540575","5.22344","0.00032","5.22344","0.00032","11.50019","0.0009","90","","90","","90","","313.77","0.04","300","","300","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Ca Gd2 Mo4 O16 -","- Ca Gd2 Mo4 O16 -","- Ca Gd2 Mo4 O16 -","1","0.0625","","Chang Sung Lim; Victor Atuchin; Aleksandr Aleksandrovsky; Maxim Molokeev; Aleksandr Oreshonkov","Microwave sol-gel synthesis of CaGd2(MoO4)4:Er3+/Yb3+ phosphors and their upconversion photoluminescence properties","Journal of the American Ceramic Society","2015","98","10","3223","3230","10.1111/jace.13739","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","5.1","1.435","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"1540576","5.21601","0.00027","5.21601","0.00027","11.4875","0.00076","90","","90","","90","","312.54","0.03","300","","300","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- Ca Er0.2 Gd1.8 Mo4 O16 -","- Ca Er0.2 Gd1.8 Mo4 O16 -","- Ca Er0.2 Gd1.8 Mo4 O16 -","1","0.0625","","Chang Sung Lim; Victor Atuchin; Aleksandr Aleksandrovsky; Maxim Molokeev; Aleksandr Oreshonkov","Microwave sol-gel synthesis of CaGd2(MoO4)4:Er3+/Yb3+ phosphors and their upconversion photoluminescence properties","Journal of the American Ceramic Society","2015","98","10","3223","3230","10.1111/jace.13739","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","5.53","1.325","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"1540577","5.21412","0.00036","5.21412","0.00036","11.48095","0.00089","90","","90","","90","","312.13","0.04","300","","300","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- Ca Er0.1 Gd1.7 Mo4 O16 Yb0.2 -","- Ca Er0.1 Gd1.7 Mo4 O16 Yb0.2 -","- Ca Er0.1 Gd1.7 Mo4 O16 Yb0.2 -","1","0.0625","","Chang Sung Lim; Victor Atuchin; Aleksandr Aleksandrovsky; Maxim Molokeev; Aleksandr Oreshonkov","Microwave sol-gel synthesis of CaGd2(MoO4)4:Er3+/Yb3+ phosphors and their upconversion photoluminescence properties","Journal of the American Ceramic Society","2015","98","10","3223","3230","10.1111/jace.13739","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","5.24","1.294","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"1540578","5.21103","0.00041","5.21103","0.00041","11.47435","0.00093","90","","90","","90","","311.58","0.04","300","","300","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- Ca Er0.05 Gd1.5 Mo4 O16 Yb0.45 -","- Ca Er0.05 Gd1.5 Mo4 O16 Yb0.45 -","- Ca Er0.05 Gd1.5 Mo4 O16 Yb0.45 -","1","0.0625","","Chang Sung Lim; Victor Atuchin; Aleksandr Aleksandrovsky; Maxim Molokeev; Aleksandr Oreshonkov","Microwave sol-gel synthesis of CaGd2(MoO4)4:Er3+/Yb3+ phosphors and their upconversion photoluminescence properties","Journal of the American Ceramic Society","2015","98","10","3223","3230","10.1111/jace.13739","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","3.72","1.395","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"1540846","20.611","","20.611","","15.382","","90","","90","","90","","6534.48","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Ba5 Cr3 F18 -","- Ba5 Cr3 F18 -","- Ba80 Cr48 F288 -","16","1","","Welsch, M.; Holler, H.; Babel, D.","Ueber Ba2 Cr F6 und Ba5 Cr3 F18, ein Beitrag zur Strukturchemie von Chrom(II)- und Barium-Uebergangsmetall-Fluoriden","Zeitschrift fuer Anorganische und Allgemeine Chemie","1989","575","","171","186","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1541741","15.028","","15.028","","18.634","","90","","90","","90","","4208.32","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Si (N C S)4","","- C4 N4 S4 Si -","- C4 N4 S4 Si -","- C64 N64 S64 Si16 -","16","1","","Seiler, O.; Buggisch, N.; Bertermann, R.; Burschka, C.; Tacke, R.; Penka, M.; Tebbe, D.","Hexacoordinate silicon(IV) complexes containing thiocyanato-N ligands - syntheses, structural characterization and computational studies","Zeitschrift fuer Anorganische und Allgemeine Chemie","2003","629","","1403","1411","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1542078","13.66","","13.66","","5.964","","90","","90","","90","","1112.86","","","","","","","","","","","","","2","I 41/a :2","-I 4ad","88","","","","- Nb O2 -","- Nb O2 -","- Nb32 O64 -","32","2","","Pynn, R.; Axe, J.D.; Thomas, R.","Structural distortions in the low-temperature phase of Nb O2","Physical Review, Serie 3. B - Solid State (1,1970-17,1977)","1976","13","","2965","2975","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1543275","14.1096","0.0006","14.1096","0.0006","24.6537","0.0011","90","","90","","90","","4908.1","0.4","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","2-Amino-6-methylpyridinium 2-hydroxybenzoate","","- C13 H14 N2 O3 -","- C13 H14 N2 O3 -","- C208 H224 N32 O48 -","16","1","BT4008","Sivakumar, P.; Sudhahar, S.; Israel, S.; Chakkaravarthi, G.","2-Amino-6-methylpyridinium 2-hydroxybenzoate","IUCrData","2016","1","5","x160747","","10.1107/S2414314616007471","","","0.71073","MoKα","","0.1063","0.0546","","","0.1401","0.191","","","","","","1.052","","","","has coordinates,has Fobs","182860","2020-10-21","18:00:00",""
"1544327","5.37783","0.00014","5.37783","0.00014","11.75716","0.0003","90","","90","","90","","340.029","0.015","300","","300","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- La1.33 Na1.33 O16 Sr1.33 W4 -","- La1.33333 Na1.33333 O16 Sr1.33333 W4 -","- La1.33333 Na1.33333 O16 Sr1.33333 W4 -","1","0.0625","","Lim, Chang Sung; Atuchin, Victor; Aleksandrovsky, Aleksandr; Molokeev, Maxim","Preparation of NaSrLa1-x(WO4)3:Ho3+/Yb3+ ternary tungstates and their upconversion photoluminescence properties","Materials Letters","2016","181","0","38","41","10.1016/j.matlet.2016.05.121","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","5.13","1.247","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"1544328","5.360174","0.000093","5.360174","0.000093","11.71105","0.00022","90","","90","","90","","336.476","0.01","300","","300","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- Ho0.27 La1.07 Na1.33 O16 Sr1.33 W4 -","- Ho0.266667 La1.06667 Na1.33333 O16 Sr1.33333 W4 -","- Ho0.266667 La1.06667 Na1.33333 O16 Sr1.33333 W4 -","1","0.0625","","Lim, Chang Sung; Atuchin, Victor; Aleksandrovsky, Aleksandr; Molokeev, Maxim","Preparation of NaSrLa1-x(WO4)3:Ho3+/Yb3+ ternary tungstates and their upconversion photoluminescence properties","Materials Letters","2016","181","0","38","41","10.1016/j.matlet.2016.05.121","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","3.51","1.176","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"1544329","5.34372","0.0001","5.34372","0.0001","11.67359","0.00026","90","","90","","90","","333.343","0.012","300","","300","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- Ho0.13 La0.93 Na1.33 O16 Sr1.33 W4 Yb0.27 -","- Ho0.133333 La0.933333 Na1.33333 O16 Sr1.33333 W4 Yb0.266667 -","- Ho0.133333 La0.933333 Na1.33333 O16 Sr1.33333 W4 Yb0.266667 -","1","0.0625","","Lim, Chang Sung; Atuchin, Victor; Aleksandrovsky, Aleksandr; Molokeev, Maxim","Preparation of NaSrLa1-x(WO4)3:Ho3+/Yb3+ ternary tungstates and their upconversion photoluminescence properties","Materials Letters","2016","181","0","38","41","10.1016/j.matlet.2016.05.121","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","3.83","1.224","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"1544330","5.3257","0.00011","5.3257","0.00011","11.62354","0.00031","90","","90","","90","","329.679","0.013","300","","300","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- Ho0.07 La0.67 Na1.33 O16 Sr1.33 W4 Yb0.6 -","- Ho0.0666667 La0.666667 Na1.33333 O16 Sr1.33333 W4 Yb0.6 -","- Ho0.0666667 La0.666667 Na1.33333 O16 Sr1.33333 W4 Yb0.6 -","1","0.0625","","Lim, Chang Sung; Atuchin, Victor; Aleksandrovsky, Aleksandr; Molokeev, Maxim","Preparation of NaSrLa1-x(WO4)3:Ho3+/Yb3+ ternary tungstates and their upconversion photoluminescence properties","Materials Letters","2016","181","0","38","41","10.1016/j.matlet.2016.05.121","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","2.6","1.177","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"1544519","18.384","0.002","18.384","0.002","4.651","0.001","90","","90","","90","","1571.9","0.4","","","296","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- As2 Ba O10 V2 -","- As2 Ba O10 V2 -","- As16 Ba8 O80 V16 -","8","0.5","","Wang, Sue-Lein; Cheng, Chih-Yi","A(VO)2(AsO4)2 (A = Ba or Sr) : Two vanadyl(IV) arsenates containing dimers of edge-sharing VO6 octahedra","Journal of Solid State Chemistry","1994","109","","277","280","10.1006/jssc.1994.1104","","x-ray","0.71069","MoKα","","","0.0271","","","0.031","","","","","","","","","","","has coordinates","211137","2020-10-21","18:00:00",""
"1544520","18.131","0.005","18.131","0.005","4.669","0.001","90","","90","","90","","1534.9","0.7","","","296","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- As2 O10 Sr V2 -","- As2 O10 Sr V2 -","- As16 O80 Sr8 V16 -","8","0.5","","Wang, Sue-Lein; Cheng, Chih-Yi","A(VO)2(AsO4)2 (A = Ba or Sr) : Two vanadyl(IV) arsenates containing dimers of edge-sharing VO6 octahedra","Journal of Solid State Chemistry","1994","109","","277","280","10.1006/jssc.1994.1104","","x-ray","0.71069","MoKα","","","0.0338","","","0.0319","","","","","","","","","","","has coordinates","211137","2020-10-21","18:00:00",""
"1544538","21.092","0.002","21.092","0.002","45.876","0.003","90","","90","","90","","20409","3","200","2","200","2","","","","","","","","6","I 41/a :2","-I 4ad","88","Gross82 (Sudhakar)","","","- C37.66667 H8.66667 Au Cl2 F15 N4 -","- C37.6667 H8.66667 Au Cl2 F15 N4 -","- C904 H208 Au24 Cl48 F360 N96 -","24","1.5","","Soll, Matan; Sudhakar, Kolanu; Fridman, Natalia; Müller, Alexander; Röder, Beate; Gross, Zeev","One-Pot Conversion of Fluorophores to Phosphorophores.","Organic letters","2016","18","22","5840","5843","10.1021/acs.orglett.6b02877","","","0.71073","MoKα","","0.0367","0.0296","","","0.0781","0.0811","","","","","","1.065","","","","has coordinates","215051","2020-10-21","18:00:00",""
"1545626","19.7345","0.0003","19.7345","0.0003","14.1982","0.0002","90","","90","","90","","5529.5","0.14","","","295","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Al Ca0.33 F5 Sr0.67 -","- Al Ca0.325 F5 Sr0.675 -","- Al64 Ca20.8 F320 Sr43.2 -","64","4","","Matthias Weil; Erich Zobetz; Franz Werner; Frank Kubel","New alkaline earth aluminium fluorides with the formula (M1, M2)AlF5 (M1, M2 = Ca, Sr, Ba)","Solid State Sciences","2001","3","","441","453","10.1016/S1293-2558(01)01165-7","","x-ray","0.71073","MoKα","","","0.039","","","","0.099","","","","","","1.07","","","","has coordinates","194446","2020-10-21","18:00:00",""
"1545795","5.36033","0.0001","5.36033","0.0001","11.82739","0.00026","90","","90","","90","","339.838","0.012","300","","300","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- La1.33 Mo4 Na1.33 O16 Sr1.33 -","- La1.33333 Mo4 Na1.33333 O16 Sr1.33333 -","- La1.33333 Mo4 Na1.33333 O16 Sr1.33333 -","1","0.0625","","Chang Sung Lim; Aleksandr S. Aleksandrovsky; Maxim S. Molokeev; Aleksandr S. Oreshonkov; Victor V. Atuchin","Microwave synthesis and spectroscopic properties of ternary scheelite-type molybdate phosphors NaSrLa(MoO4)3:Er3+,Yb3+","Journal of Alloys and Compounds","2017","713","0","156","163","10.1016/j.jallcom.2017.04.060","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","6.6","1.245","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"1545796","5.34061","0.00011","5.34061","0.00011","11.77693","0.00024","90","","90","","90","","335.903","0.012","300","","300","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- Er0.27 La1.07 Mo4 Na1.33 O16 Sr1.33 -","- Er0.266667 La1.06667 Mo4 Na1.33333 O16 Sr1.33333 -","- Er0.266667 La1.06667 Mo4 Na1.33333 O16 Sr1.33333 -","1","0.0625","","Chang Sung Lim; Aleksandr S. Aleksandrovsky; Maxim S. Molokeev; Aleksandr S. Oreshonkov; Victor V. Atuchin","Microwave synthesis and spectroscopic properties of ternary scheelite-type molybdate phosphors NaSrLa(MoO4)3:Er3+,Yb3+","Journal of Alloys and Compounds","2017","713","0","156","163","10.1016/j.jallcom.2017.04.060","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","4.11","1.157","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"1545797","5.32926","0.00014","5.32926","0.00014","11.74788","0.0003","90","","90","","90","","333.652","0.015","300","","300","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- Er0.13 La0.93 Mo4 Na1.33 O16 Sr1.33 Yb0.27 -","- Er0.133333 La0.933333 Mo4 Na1.33333 O16 Sr1.33333 Yb0.266667 -","- Er0.133333 La0.933333 Mo4 Na1.33333 O16 Sr1.33333 Yb0.266667 -","1","0.0625","","Chang Sung Lim; Aleksandr S. Aleksandrovsky; Maxim S. Molokeev; Aleksandr S. Oreshonkov; Victor V. Atuchin","Microwave synthesis and spectroscopic properties of ternary scheelite-type molybdate phosphors NaSrLa(MoO4)3:Er3+,Yb3+","Journal of Alloys and Compounds","2017","713","0","156","163","10.1016/j.jallcom.2017.04.060","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","2.34","1.139","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"1545798","5.30628","0.0001","5.30628","0.0001","11.68195","0.00025","90","","90","","90","","328.924","0.011","300","","300","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- Er0.07 La0.67 Mo4 Na1.33 O16 Sr1.33 Yb0.6 -","- Er0.0666667 La0.666667 Mo4 Na1.33333 O16 Sr1.33333 Yb0.6 -","- Er0.0666667 La0.666667 Mo4 Na1.33333 O16 Sr1.33333 Yb0.6 -","1","0.0625","","Chang Sung Lim; Aleksandr S. Aleksandrovsky; Maxim S. Molokeev; Aleksandr S. Oreshonkov; Victor V. Atuchin","Microwave synthesis and spectroscopic properties of ternary scheelite-type molybdate phosphors NaSrLa(MoO4)3:Er3+,Yb3+","Journal of Alloys and Compounds","2017","713","0","156","163","10.1016/j.jallcom.2017.04.060","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","2.62","1.113","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"1545878","8.223","0.005","8.223","0.005","23.61","0.014","90","","90","","90","","1596.5","1.7","","","293","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Ba F11 Na Zr2 -","- Ba F11 Na Zr2 -","- Ba8 F88 Na8 Zr16 -","8","0.5","","Laval, J. P.; Abaouz, A.","Crystal structure of BaNaZr2F11 : a phase recrystallizing from fluorozirconate glasses","Journal of Solid State Chemistry","1992","101","","18","25","10.1016/0022-4596(92)90195-2","","x-ray","0.71069","MoKα","","","0.055","","","0.057","","","","","","","","","","","has coordinates","195780","2020-10-21","18:00:00",""
"1546034","5.205","0.005","5.205","0.005","11.275","0.007","90","","90","","90","","305.46","","","","","","1400000","","1400000","","","","","3","I 41/a :2","-I 4ad","88","","","Scheelite","- Ca O4 W -","- Ca O4 W -","- Ca4 O16 W4 -","4","0.25","","Rodríguez-Hernández, P.; López-Solano, J.; Radescu, S.; Mujica, A.; Muñoz, A.; Errandonea, D.; Pellicer-Porres, J.; Segura, A.; Ferrer-Roca, Ch.; Manjón, F. J.; Kumard, R. S.; Tschaunerd, O.; Aquilantie, G.","Theoretical and experimental study of CaWO~4~ and SrWO~4~ under pressure","Journal of Physics and Chemistry of Solids","2006","67","9-10","2164","2171","10.1016/j.jpcs.2006.05.011","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","196686","2020-10-21","18:00:00",""
"1546036","5.391","0.008","5.391","0.008","11.893","0.007","90","","90","","90","","345.64","","","","","","200000","","200000","","","","","3","I 41/a :2","-I 4ad","88","","","Scheelite","- O4 Sr W -","- O4 Sr W -","- O16 Sr4 W4 -","4","0.25","","Rodríguez-Hernández, P.; López-Solano, J.; Radescu, S.; Mujica, A.; Muñoz, A.; Errandonea, D.; Pellicer-Porres, J.; Segura, A.; Ferrer-Roca, Ch.; Manjón, F. J.; Kumard, R. S.; Tschaunerd, O.; Aquilantie, G.","Theoretical and experimental study of CaWO~4~ and SrWO~4~ under pressure","Journal of Physics and Chemistry of Solids","2006","67","9-10","2164","2171","10.1016/j.jpcs.2006.05.011","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","196687","2020-10-21","18:00:00",""
"1546810","14.084","0.006","14.084","0.006","39.7","0.03","90","","90","","90","","7875","8","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C26 H17 Cl O1.5 P -","- C26 H17 Cl O1.5 P -","- C416 H272 Cl16 O24 P16 -","16","1","","Li, Jie; Zhang, Wen-Wen; Wei, Xiao-Jing; Hao, Wen-Juan; Li, Guigen; Tu, Shu-Jiang; Jiang, Bo","Synthesis of Tribenzo[b,e,g]phosphindole Oxides via Radical Bicyclization Cascades of o-Arylalkynylanilines.","Organic letters","2017","19","17","4512","4515","10.1021/acs.orglett.7b02071","","","0.71073","MoKα","","0.1048","0.0552","","","0.1326","0.149","","","","","","1.066","","","","has coordinates","200724","2020-10-21","18:00:00",""
"1547818","4.97","","4.97","","11.844","","90","","90","","90","","292.557","","","","","","","","","","","","Synthetic","3","I 41/a :2","-I 4ad","88","","","","- Cr O4 Sr -","- Cr O4 Sr -","- Cr4 O16 Sr4 -","4","0.25","","Gleissner, J.; Errandonea, D.","Monazite-type SrCrO4 under compression","Phys. Rev B","2016","94","","134108","134108","","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","202408","2020-10-21","18:00:00",""
"1549132","5.159","0.0001","5.159","","11.169","0.0003","90","","90","","90","","297.266","0.01","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Cd O4 W -","- Cd O4 W -","- Cd4 O16 W4 -","4","0.25","","Eranjaneya, H.; Chandrappa, G. T.","Selective synthesis of scheelite/wolframite CdWO4 nanoparticles: a mechanistic investigation of phase formation and property correlation","Journal of Sol-Gel Science and Technology","2018","85","3","585","594","10.1007/s10971-017-4545-2","","","","","","","","","","","","","","","","","","","","","has coordinates","288118","2023-12-07","10:18:29",""
"1549377","27.4219","0.0002","27.4219","0.0002","15.9884","0.0002","90","","90","","90","","12022.7","0.19","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C27 H42 Cl4 N2 Pd -","- C27 H40 Cl4 N2 Pd -","- C432 H640 Cl64 N32 Pd16 -","16","1","","Zheng, Ting; Liao, Heng; Gao, Jie; Zhong, Liu; Gao, Haiyang; Wu, Qing","Synthesis and characterization of α-diamine palladium complexes and insight into hybridization effects of nitrogen donor atoms on norbornene (co)polymerizations","Polymer Chemistry","2018","9","22","3088","","10.1039/C8PY00395E","","","1.54178","CuKα","","0.0558","0.0543","","","0.1536","0.1554","","","","","","1.122","","","","has coordinates,has disorder","230952","2020-10-21","18:00:00",""
"1550096","25.7276","0.0005","25.7276","0.0005","7.7202","0.0003","90","","90","","90","","5110.1","0.2","100","2","100","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C41 H56 N8 O20 S4 -","- C41 H56 N8 O20 S4 -","- C164 H224 N32 O80 S16 -","4","0.25","","Sozzani, Piero; Xing, Guolong; Bassanetti, Irene; Bracco, Silvia; Negroni, Mattia; Bezuidenhout, Charl; Ben, Teng; Comotti, Angiolina","Double Helix of Opposite Charges to Form Channels with Unique CO2 Selectivity and Dynamics","Chemical Science","2019","","","","","10.1039/C8SC04376K","","x-ray","0.7","synchrotron","","0.0503","0.0486","","","0.1401","0.1429","","","","","","1.083","","","","has coordinates","277994","2022-09-20","08:32:41",""
"1550097","25.1179","0.0007","25.1179","0.0007","7.6702","0.0005","90","","90","","90","","4839.2","0.4","273","2","273.15","","","","","","","","","5","I 41/a :2","-I 4ad","88","","POS-1 273K","","- C41 H40 N8 O12 S4 -","- C164 H160 N32 O48 S16 -","- C164 H160 N32 O48 S16 -","1","0.0625","","Sozzani, Piero; Xing, Guolong; Bassanetti, Irene; Bracco, Silvia; Negroni, Mattia; Bezuidenhout, Charl; Ben, Teng; Comotti, Angiolina","Double Helix of Opposite Charges to Form Channels with Unique CO2 Selectivity and Dynamics","Chemical Science","2019","","","","","10.1039/C8SC04376K","","","0.71073","MoKα","","0.128","0.0936","","","0.2728","0.31","","","","","","1.153","","","","has coordinates,has disorder","277994","2022-09-20","08:32:41",""
"1551728","27.799","0.0013","27.799","","12.18","0.0008","90","","90","","90","","9412.5","0.8","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C27 H27 N3 O2 -","- C27 H27 N3 O2 -","- C432 H432 N48 O32 -","16","1","","NEETHA, S.; JOSHIPURA, D. N.; SRIDHAR, M. A.; PRASAD, J. Shashidhara; SHAH, Anamik","Synthesis and Crystal Structure Study of 4-Anilino-3-[(4-benzylpiperazin-1-yl)-methyl]-2H-chromen-2-one","X-ray Structure Analysis Online","2011","27","","1","","10.2116/xraystruct.27.1","","","0.71073","MoKα","","0.1007","0.0692","","","0.2093","0.2491","","","","","","1.06","","","","has coordinates","216340","2020-10-21","18:00:00",""
"1551844","23.6365","0.0015","23.6365","0.0015","7.1651","0.0006","90","","90","","90","","4003","0.5","295.65","","295.65","","","","","","","","","3","I 41/a :2","-I 4ad","88","E4-1a","tetrakis(4-((E)-phenyldiazenyl)phenyl)methane","","- C49 H36 N8 -","- C49 H36 N8 -","- C196 H144 N32 -","4","0.25","","Massimo Baroncini; Simone d Agostino; Giacomo Bergamini; Paola Ceroni; Angiolina Comotti; Piero Sozzani; Irene Bassanetti; Fabrizia Grepioni; Taylor M. Hernandez; Serena Silvi; Margherita Venturi; Alberto Credi","Photoinduced reversible switching of porosity in molecular crystals based on star-shaped azobenzene tetramers","Nature Chemistry","2015","7","","634","640","10.1038/nchem.2304","","","0.71073","MoKα","","0.1546","0.0611","","","0.1585","0.1836","","","","","","0.85","","","","has coordinates","216465","2020-10-21","18:00:00",""
"1551845","24.2515","0.0011","24.2515","0.0011","7.7078","0.0005","90","","90","","90","","4533.2","0.4","293","2","293","2","","","","","","","","3","I 41/a :2","-I 4ad","88","E4-1b form I","","","- C53 H44 N8 -","- C53 H44 N8 -","- C212 H176 N32 -","4","0.25","","Massimo Baroncini; Simone d Agostino; Giacomo Bergamini; Paola Ceroni; Angiolina Comotti; Piero Sozzani; Irene Bassanetti; Fabrizia Grepioni; Taylor M. Hernandez; Serena Silvi; Margherita Venturi; Alberto Credi","Photoinduced reversible switching of porosity in molecular crystals based on star-shaped azobenzene tetramers","Nature Chemistry","2015","7","","634","640","10.1038/nchem.2304","","","0.71073","MoKα","","0.2338","0.066","","","0.1519","0.2275","","","","","","0.941","","","","has coordinates,has disorder","216466","2020-10-21","18:00:00",""
"1551846","24.072","0.002","24.072","0.002","7.4555","0.0012","90","","90","","90","","4320.2","0.9","297.65","","297.65","","","","","","","","","3","I 41/a :2","-I 4ad","88","E4-1b form II","tetrakis(4-((E)-p-tolyldiazenyl)phenyl)methane","","- C53 H44 N8 -","- C53 H44 N8 -","- C212 H176 N32 -","4","0.25","","Massimo Baroncini; Simone d Agostino; Giacomo Bergamini; Paola Ceroni; Angiolina Comotti; Piero Sozzani; Irene Bassanetti; Fabrizia Grepioni; Taylor M. Hernandez; Serena Silvi; Margherita Venturi; Alberto Credi","Photoinduced reversible switching of porosity in molecular crystals based on star-shaped azobenzene tetramers","Nature Chemistry","2015","7","","634","640","10.1038/nchem.2304","","","0.71073","MoKα","","0.3267","0.0903","","","0.1848","0.2853","","","","","","0.955","","","","has coordinates","216467","2020-10-21","18:00:00",""
"1552763","20.2681","0.0016","20.2681","0.0016","7.1102","0.0008","90","","90","","90","","2920.8","0.5","180.15","","180.15","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C33 H28 O4 S4 -","- C33 H28 O4 S4 -","- C132 H112 O16 S16 -","4","0.25","","Šebera, Jakub; Lindner, Marcin; Gasior, Jindřich; Mészáros, Gábor; Fuhr, Olaf; Mayor, Marcel; Valášek, Michal; Kolivoška, Viliam; Hromadová, Magdaléna","Tuning the contact conductance of anchoring groups in single molecule junctions by molecular design.","Nanoscale","2019","11","27","12959","12964","10.1039/c9nr04071d","","x-ray","0.71073","MoKα","","0.0375","0.0294","","","0.0764","0.0796","","","","","","1.066","","","","has coordinates","223406","2020-10-21","18:00:00",""
"1553617","20.763","0.003","20.763","0.003","13.7545","0.0018","90","","90","","90","","5929.6","1.4","296","2","296.15","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C44 H72 Li4 O4 S4 Si4 -","- C44 H72 Li4 O4 S4 Si4 -","- C176 H288 Li16 O16 S16 Si16 -","4","0.25","","Li, Lu; Li, Bingbing; Li, Chunli; Ma, Zhiying; Xu, Li; Wang, Hua","Selective deprotonation of tetra[3,4]thienylene in the presence of n-BuLi","Organic Chemistry Frontiers","2017","4","6","1019","","10.1039/C6QO00754F","","","0.71073","MoKα","","0.1222","0.0831","","","0.2424","0.2973","","","","","","1.024","","","","has coordinates","235211","2020-10-21","18:00:00",""
"1554073","36.1167","0.0008","36.1167","0.0008","14.507","0.0004","90","","90","","90","","18923.2","0.8","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C66 H132 Co4 Dy2 N8 O30 -","- C66 H132 Co4 Dy2 N8 O30 -","- C528 H1056 Co32 Dy16 N64 O240 -","8","0.5","","Radu, Ioana; Kravtsov, Victor Ch.; Krämer, Karl; Decurtins, Silvio; Liu, Shi-Xia; Reu, Oleg S.; Ostrovsky, Serghei M.; Klokishner, Sophia I.; Baca, Svetlana G.","Synthesis, Characterization, and Modeling of Magnetic Properties of a Hexanuclear Amino Alcohol-Supported {CoII2CoIII2DyIII2} Pivalate Cluster","The Journal of Physical Chemistry C","2016","120","13","7435","","10.1021/acs.jpcc.6b01378","","","0.71073","MoKα","","0.0959","0.0502","","","0.1039","0.1192","","","","","","1.003","","","","has coordinates,has disorder","236532","2020-10-21","18:00:00",""
"1554327","18.7671","0.0001","18.7671","0.0001","24.2076","0.0003","90","","90","","90","","8526.01","0.12","100","0.1","100","0.1","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C26 H21 F2 N3 -","- C26 H21 F2 N3 -","- C416 H336 F32 N48 -","16","1","","Liu, Yun-Lin; Mao, Xiang-Yu; Lin, Xiao-Tong; Chen, Guo-Shu","A Zn(OTf)2 catalyzed Ugi-type reaction of 3-(2-isocyanoethyl)indoles with indole-derived ketimines: rapid access to hexacyclic spiroindolines","Organic Chemistry Frontiers","2018","5","15","2303","","10.1039/C8QO00382C","","x-ray","1.54184","CuKα","","0.0426","0.0395","","","0.098","0.1","","","","","","1.041","","","","has coordinates","237130","2020-10-21","18:00:00",""
"1554351","40.9015","0.0014","40.9015","0.0014","9.3338","0.0005","90","","90","","90","","15614.8","1.1","100","","100","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C45 H68 N2 O2 -","- C45 H68 N2 O2 -","- C720 H1088 N32 O32 -","16","1","","Mahoney, Janell K.; Regnier, Vianney; Romero, Erik A.; Molton, Florian; Royal, Guy; Jazzar, Rodolphe; Martin, David; Bertrand, Guy","The serendipitous discovery of a readily available redox-bistable molecule derived from cyclic(alkyl)(amino)carbenes","Organic Chemistry Frontiers","2018","5","13","2073","","10.1039/C8QO00447A","","x-ray","1.54178","CuKα","","0.053","0.039","","","0.0921","0.1006","","","","","","1.038","","","","has coordinates","237149","2020-10-21","18:00:00",""
"1554458","27.972","0.006","27.972","0.006","11.844","0.003","90","","90","","90","","9267","4","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","1,1-phenylenedioxa-5-phenyl-3,7-bis(trichloromethyl)-1-phospha-2,6,8-trioxabicyclo[4.3.2(1,5)]octane","","- C18 H13 Cl6 O5 P -","- C18 H13 Cl6 O5 P -","- C288 H208 Cl96 O80 P16 -","16","1","","Khasiyatullina, Nadezhda R.; Baronova, Tamara A.; Mironova, Ekaterina V.; Fayzullin, Robert R.; Litvinov, Igor A.; Efimov, Sergey V.; Musin, Rashid Z.; Klochkov, Vladimir V.; Mironov, Vladimir F.","Tandem dihetero-Diels‒Alder and Huisgen cycloaddition reactions. Synthesis, crystal structure and hydrolysis of the novel cage phosphoranes","Organic Chemistry Frontiers","2018","5","21","3113","","10.1039/C8QO00915E","","x-ray","0.71073","MoKα","","0.05","0.0399","","","0.0929","0.099","","","","","","1.048","","","","has coordinates","237249","2020-10-21","18:00:00",""
"1554685","12.7985","0.0003","12.7985","0.0003","25.8884","0.0013","90","","90","","90","","4240.6","0.3","370","2","370","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C10 H26 Cl6 N2 Zn -","- C10 H26 Cl6 N2 Zn -","- C80 H208 Cl48 N16 Zn8 -","8","0.5","","Zhang, Yu-Wei; Wang, Qing; Shi, Ping-Ping; Zhang, Wan-Ying; Ye, Qiong; Fu, Da-Wei","Visual low-high interchange in a dielectric switch for trimethylchloroethylamine tetrachlorozincate with a large leap symmetry breaking","Materials Chemistry Frontiers","2019","3","10","2077","","10.1039/C9QM00427K","","","0.71073","MoKα","","0.2102","0.2011","","","0.4934","0.6065","","","","","","1.1432","","","","has coordinates","278190","2022-09-26","15:36:48",""
"1555260","16.4008","0.0015","16.4008","0.0015","22.397","0.002","90","","90","","90","","6024.5","0.9","100","","100","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C15 H18 O8.25 -","- C15 H18 O8.25 -","- C240 H288 O132 -","16","1","","Cui, Peng; McMahon, David P.; Spackman, Peter R.; Alston, Ben M.; Little, Marc A.; Day, Graeme M.; Cooper, Andrew I.","Mining predicted crystal structure landscapes with high throughput crystallisation: old molecules, new insights","Chemical Science","2019","10","43","9988","","10.1039/C9SC02832C","","x-ray","0.71073","MoKα","","0.0686","0.0549","","","0.1517","0.1635","","","","","","1.053","","","","has coordinates","238432","2020-10-21","18:00:00",""
"1555261","16.238","0.0002","16.238","0.0002","22.3825","0.0003","90","","90","","90","","5901.65","0.13","100.01","0.1","100","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C60 H72 O24 -","- C60 H72 O24 -","- C240 H288 O96 -","4","0.25","","Cui, Peng; McMahon, David P.; Spackman, Peter R.; Alston, Ben M.; Little, Marc A.; Day, Graeme M.; Cooper, Andrew I.","Mining predicted crystal structure landscapes with high throughput crystallisation: old molecules, new insights","Chemical Science","2019","10","43","9988","","10.1039/C9SC02832C","","x-ray","0.71073","MoKα","","0.0639","0.0511","","","0.1334","0.1421","","","","","","1.064","","","","has coordinates","238432","2020-10-21","18:00:00",""
"1556108","33.3269","0.0011","33.3269","0.0011","9.8038","0.0003","90","","90","","90","","10888.9","0.6","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24.6 H32.8 Cl O1.3 Si2 -","- C24.6 H32.8 Cl O1.3 Si2 -","- C393.6 H524.8 Cl16 O20.8 Si32 -","16","1","","Simpkins, Simon M. E.; Kariuki, Benson M.; Aricó, Caterina S; Cox, Liam R.","Stereoselective synthesis of beta-(chloro)vinylsilanes using a regio- and (E)-stereoselective bis-stannylation of unsymmetrically substituted butadiynes: application to the synthesis of a masked triyne.","Organic letters","2003","5","21","3971","3974","10.1021/ol035536e","","","1.54178","CuKα","","0.2038","0.0644","","","0.1428","0.2114","","","","","","0.932","","","","has coordinates","244972","2020-10-21","18:00:00",""
"1556887","19.597","0.0006","19.597","0.0006","36.7108","0.0015","90","","90","","90","","14098.5","0.8","180.15","","180.15","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C40 H48 B2 Ca F48 O16 -","- C40 H48 B2 Ca F48 O16 -","- C320 H384 B16 Ca8 F384 O128 -","8","0.5","","Li, Zhenyou; Fuhr, Olaf; Fichtner, Maximilian; Zhao-Karger, Zhirong","Towards stable and efficient electrolytes for room-temperature rechargeable calcium batteries","Energy & Environmental Science","2019","12","12","3496","","10.1039/C9EE01699F","","x-ray","0.71073","MoKα","","0.1065","0.0898","","","0.2536","0.2684","","","","","","1.224","","","","has coordinates","246385","2020-10-21","18:00:00",""
"1556945","22.37","0.003","22.37","0.003","9.5963","0.0014","90","","90","","90","","4802.2","1.1","173","2","173.15","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C44 H48 Br4 O4 Ti -","- C44 H48 Br4 O4 Ti -","- C176 H192 Br16 O16 Ti4 -","4","0.25","","Aldrich, Kelly E.; Kansal, Dhwani; Odom, Aaron L.","Catalyst design insights from modelling a titanium-catalyzed multicomponent reaction.","Faraday discussions","2019","220","0","208","230","10.1039/c9fd00033j","","","0.71073","MoKα","","0.0889","0.0557","","","0.1627","0.1847","","","","","","1.0431","","","","has coordinates","246607","2020-10-21","18:00:00",""
"1557044","38.4682","0.0004","38.4682","0.0004","9.5772","0.0002","90","","90","","90","","14172.4","0.4","100","0.1","100","0.1","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C39 H44 N2 -","- C39 H44 N2 -","- C624 H704 N32 -","16","1","","Rottschäfer, Dennis; Glodde, Timo; Neumann, Beate; Stammler, Hans-Georg; Ghadwal, Rajendra S.","A crystalline C5-protonated 1,3-imidazol-4-ylidene.","Chemical communications (Cambridge, England)","2020","56","13","2027","2030","10.1039/c9cc09428h","","x-ray","1.54184","CuKα","","0.0519","0.0441","","","0.102","0.1068","","","","","","1.041","","","","has coordinates","248829","2020-10-21","18:00:00",""
"1557267","12.09","0.001","12.09","0.001","22.007","0.003","90","","90","","90","","3216.7","0.6","","","288","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C16 H28 N4 -","- C16 N4 -","- C128 N32 -","8","0.5","","Gopal, Damodaragounder; Macikenas, Dainius; Sayre, Lawrence M.; Protasiewicz, John D.","Structural Determination of a Dimeric Side-Product Accompanying Dihydropyrazine Preparation","Acta Chemica Scandinavica","1997","51","","938","941","10.3891/acta.chem.scand.51-0938","","x-ray","0.71073","MoKα","","","0.0505","","","0.0949","","","","","","","1.178","","","","has coordinates","247950","2020-10-21","18:00:00",""
"1557644","22.436","0.004","22.436","0.004","38.165","0.008","90","","90","","90","","19211","6","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C112 H192 In26 Mn4 N32 S51 -","- In26 Mn4 S51 -","- In104 Mn16 S204 -","4","0.25","","Xue, Chaozhuang; Fan, Xing; Zhang, Jiaxu; Hu, Dandan; Wang, Xiao-Li; Wang, Xiang; Zhou, Rui; Lin, Haiping; Li, Youyong; Li, Dong-Sheng; Wei, Xiao; Zheng, Daoyuan; Yang, Yang; Han, Keli; Wu, Tao","Direct observation of charge transfer between molecular heterojunctions based on inorganic semiconductor clusters","Chemical Science","2020","11","16","4085","4096","10.1039/D0SC00458H","","","0.71073","MoKα","","0.0946","0.0514","","","0.1645","0.2018","","","","","","1.175","","","","has coordinates","257333","2020-10-21","18:00:00",""
"1557645","22.329","0.002","22.329","0.002","38.059","0.003","90","","90","","90","","18976","3","120","2","120","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C112 H192 Fe4 In26 N32 O0 S51 -","- Fe4 In26 S51 -","- Fe16 In104 S204 -","4","0.25","","Xue, Chaozhuang; Fan, Xing; Zhang, Jiaxu; Hu, Dandan; Wang, Xiao-Li; Wang, Xiang; Zhou, Rui; Lin, Haiping; Li, Youyong; Li, Dong-Sheng; Wei, Xiao; Zheng, Daoyuan; Yang, Yang; Han, Keli; Wu, Tao","Direct observation of charge transfer between molecular heterojunctions based on inorganic semiconductor clusters","Chemical Science","2020","11","16","4085","4096","10.1039/D0SC00458H","","","0.71073","MoKα","","0.1319","0.0827","","","0.2055","0.264","","","","","","1.326","","","","has coordinates","257333","2020-10-21","18:00:00",""
"1557677","22.3413","0.0004","22.3413","0.0004","8.6532","0.0002","90","","90","","90","","4319.1","0.15","100","2","100","2","","","","","","","","3","I 41/a :2","-I 4ad","88","LM1RN5-137","","","- C12 H18 O -","- C12 H18 O -","- C192 H288 O16 -","16","1","","Nelson, Ronald; Calvelo, Martín; García-Fandiño, Rebeca; Lledós, Agustí; Ujaque, Gregori; Mascareñas, José L.; López, Fernando","Skeletal diversity in Pt- and Au-catalyzed annulations of allenedienes: dissecting unconventional mechanistic pathways","Chemical Science","2020","11","16","4209","4220","10.1039/D0SC00650E","","x-ray","0.71073","MoKα","","0.0562","0.0434","","","0.1175","0.1299","","","","","","1.028","","","","has coordinates","257334","2020-10-21","18:00:00",""
"1557944","17.4457","0.0004","17.4457","0.0004","29.8629","0.0009","90","","90","","90","","9088.8","0.4","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H4 F24 O8 U -","- C20 H4 F24 O8 U -","- C240 H48 F288 O96 U12 -","12","0.75","","Moreau, Liane M.; Herve, Alexandre; Straub, Mark D.; Russo, Dominic R.; Abergel, Rebecca J.; Alayoglu, Selim; Arnold, John; Braun, Augustin; Deblonde, Gauthier J. P.; Liu, Yangdongling; Lohrey, Trevor D.; Olive, Daniel T.; Qiao, Yusen; Rees, Julian A.; Shuh, David K.; Teat, Simon J.; Booth, Corwin H.; Minasian, Stefan G.","Structural properties of ultra-small thorium and uranium dioxide nanoparticles embedded in a covalent organic framework","Chemical Science","2020","11","18","4648","4668","10.1039/C9SC06117G","","","0.7749","synchrotron","","0.0911","0.0543","","","0.1361","0.1667","","","","","","1.016","","","","has coordinates","257390","2020-10-21","18:00:00",""
"1557989","20.4659","0.0002","20.4659","0.0002","27.7779","0.0004","90","","90","","90","","11634.9","0.2","94","2","94","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C50 H70 N8 O2 P2 Pt2 -","- C50 H70 N8 O2 P2 Pt2 -","- C400 H560 N64 O16 P16 Pt16 -","8","0.5","","Deolka, Shubham; Rivada-Wheelaghan, Orestes; Aristizábal, Sandra L.; Fayzullin, Robert R.; Pal, Shrinwantu; Nozaki, Kyoko; Khaskin, Eugene; Khusnutdinova, Julia R.","Metal‒metal cooperative bond activation by heterobimetallic alkyl, aryl, and acetylide PtII/CuI complexes","Chemical Science","2020","11","21","5494","5502","10.1039/D0SC00646G","","x-ray","0.71073","MoKα","","0.0482","0.0347","","","0.0824","0.0891","","","","","","1.027","","","","has coordinates,has disorder","257398","2020-10-21","18:00:00",""
"1558025","38.5523","0.0009","38.5523","0.0009","29.1596","0.0008","90","","90","","90","","43339.3","1.9","150","2","150","2","","","","","","","","9","I 41/a :2","-I 4ad","88","","","","- C32 H318 K8 N16 Na6 O402 Pr8 Te8 W88 -","- C16 H64 K4 N8 Na4 O368 Pr8 Te8 W88 -","- C64 H256 K16 N32 Na16 O1472 Pr32 Te32 W352 -","4","0.25","","Zhang, Yan; Jiang, Jun; Liu, Yifan; Li, Pan; Liu, Yong; Chen, Lijuan; Zhao, Junwei","Multi-praseodymium-and-tungsten bridging octameric tellurotungstate and its 2D honeycomb composite film for detecting estrogen.","Nanoscale","2020","12","19","10842","10853","10.1039/d0nr01901a","","","0.71073","MoKα","","0.0416","0.037","","","0.0928","0.0957","","","","","","1.069","","","","has coordinates","252847","2020-10-21","18:00:00",""
"1558678","21.5488","0.0014","21.5488","0.0014","9.6725","0.0006","90","","90","","90","","4491.4","0.5","100","","100","","","","","","","","","2","I 41/a :2","-I 4ad","88","","","","- C15 H14 -","- C15 H14 -","- C240 H224 -","16","1","","Aitchison, Catherine M.; Sachs, Michael; Little, Marc; Wilbraham, Liam; Brownbill, Nick J.; Kane, Chris; Blanc, Frédéric; Zwijnenburg, Martijn; Durrant, James; Sprick, Reiner Sebastian; Cooper, Andrew","Structure-activity relationships in well-defined conjugated oligomer photocatalysts for hydrogen production from water","Chemical Science","2020","","","","","10.1039/D0SC02675A","","x-ray","0.71073","MoKα","","0.0671","0.0478","","","0.118","0.1338","","","","","","1.049","","","","has coordinates","254636","2020-10-21","18:00:00",""
"1559191","20.0376","0.0007","20.0376","0.0007","23.8666","0.0007","90","","90","","90","","9582.6","0.6","170","2","170","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C60 H60 Cl4 N16 Pd4 -","- C60 H60 Cl4 N16 Pd4 -","- C240 H240 Cl16 N64 Pd16 -","4","0.25","","Gogula, Thirupathi; Zhang, Jinquan; Reddy, Madhava; Zhang, Shuaizhong; Zou, Hongbin","Temperature-modulated selective C(sp3)−H or C(sp2)−H arylation through palladium catalysis","Chemical Science","2020","","","","","10.1039/D0SC02328K","","","0.71073","MoKα","","0.0666","0.0463","","","0.1243","0.1468","","","","","","1.068","","","","has coordinates","256749","2020-10-21","18:00:00",""
"1559421","14.7759","0.0003","14.7759","0.0003","29.8577","0.0007","90","","90","","90","","6518.7","0.2","100","","100","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H15 N3 Ni O3 -","- C20 H15 N3 Ni O3 -","- C320 H240 N48 Ni16 O48 -","16","1","","Kutniewska, Sylwia E.; Krówczyński, Adam; Kamiński, Radosław; Jarzembska, Katarzyna N.; Pillet, Sébastien; Wenger, Emmanuel; Schaniel, Dominik","Photocrystallographic and spectroscopic studies of a model (N,N,O)-donor square-planar nickel(II) nitro complex: in search of high-conversion and stable photoswitchable materials","IUCrJ","2020","7","6","","","10.1107/S205225252001307X","","x-ray","1.54184","CuKα","","0.0411","0.038","","","0.0478","0.0484","","","","2.8","2.8","2.69","","","","has coordinates","258644","2020-10-30","05:35:28",""
"1559422","14.7908","0.0003","14.7908","0.0003","29.8489","0.0007","90","","90","","90","","6530","0.2","119.97","0.19","120","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H15 N3 Ni O3 -","- C20 H15 N3 Ni O3 -","- C320 H240 N48 Ni16 O48 -","16","1","","Kutniewska, Sylwia E.; Krówczyński, Adam; Kamiński, Radosław; Jarzembska, Katarzyna N.; Pillet, Sébastien; Wenger, Emmanuel; Schaniel, Dominik","Photocrystallographic and spectroscopic studies of a model (N,N,O)-donor square-planar nickel(II) nitro complex: in search of high-conversion and stable photoswitchable materials","IUCrJ","2020","7","6","","","10.1107/S205225252001307X","","x-ray","1.54184","CuKα","","0.0417","0.0387","","","0.0939","0.0953","","","","2.59","2.59","2.5","","","","has coordinates","258644","2020-10-30","05:35:30",""
"1559423","14.8076","0.0003","14.8076","0.0003","29.8449","0.0008","90","","90","","90","","6543.9","0.3","140","","140","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H15 N3 Ni O3 -","- C20 H15 N3 Ni O3 -","- C320 H240 N48 Ni16 O48 -","16","1","","Kutniewska, Sylwia E.; Krówczyński, Adam; Kamiński, Radosław; Jarzembska, Katarzyna N.; Pillet, Sébastien; Wenger, Emmanuel; Schaniel, Dominik","Photocrystallographic and spectroscopic studies of a model (N,N,O)-donor square-planar nickel(II) nitro complex: in search of high-conversion and stable photoswitchable materials","IUCrJ","2020","7","6","","","10.1107/S205225252001307X","","x-ray","1.54184","CuKα","","0.0416","0.0386","","","0.0925","0.0946","","","","2.49","2.49","2.42","","","","has coordinates","258644","2020-10-30","05:35:30",""
"1559424","14.8239","0.0004","14.8239","0.0004","29.8395","0.0008","90","","90","","90","","6557.2","0.3","160.01","0.1","160","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H15 N3 Ni O3 -","- C20 H15 N3 Ni O3 -","- C320 H240 N48 Ni16 O48 -","16","1","","Kutniewska, Sylwia E.; Krówczyński, Adam; Kamiński, Radosław; Jarzembska, Katarzyna N.; Pillet, Sébastien; Wenger, Emmanuel; Schaniel, Dominik","Photocrystallographic and spectroscopic studies of a model (N,N,O)-donor square-planar nickel(II) nitro complex: in search of high-conversion and stable photoswitchable materials","IUCrJ","2020","7","6","","","10.1107/S205225252001307X","","x-ray","1.54184","CuKα","","0.042","0.0385","","","0.0928","0.0946","","","","2.46","2.46","2.38","","","","has coordinates","258644","2020-10-30","05:35:30",""
"1559425","14.8206","0.0007","14.8206","0.0007","29.8617","0.0014","90","","90","","90","","6559.1","0.5","160","","160","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H15 N3 Ni O3 -","- C20 H15 N2.995 Ni O2.99 -","- C320 H240 N47.92 Ni16 O47.84 -","16","1","","Kutniewska, Sylwia E.; Krówczyński, Adam; Kamiński, Radosław; Jarzembska, Katarzyna N.; Pillet, Sébastien; Wenger, Emmanuel; Schaniel, Dominik","Photocrystallographic and spectroscopic studies of a model (N,N,O)-donor square-planar nickel(II) nitro complex: in search of high-conversion and stable photoswitchable materials","IUCrJ","2020","7","6","","","10.1107/S205225252001307X","","x-ray","1.54184","CuKα","","0.058","0.0499","","","0.1137","0.1176","","","","2.58","2.58","2.43","","","","has coordinates","258644","2020-10-30","05:35:30",""
"1559426","14.8394","0.0003","14.8394","0.0003","29.832","0.0008","90","","90","","90","","6569.2","0.3","180","","180","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H15 N3 Ni O3 -","- C20 H15 N3 Ni O3 -","- C320 H240 N48 Ni16 O48 -","16","1","","Kutniewska, Sylwia E.; Krówczyński, Adam; Kamiński, Radosław; Jarzembska, Katarzyna N.; Pillet, Sébastien; Wenger, Emmanuel; Schaniel, Dominik","Photocrystallographic and spectroscopic studies of a model (N,N,O)-donor square-planar nickel(II) nitro complex: in search of high-conversion and stable photoswitchable materials","IUCrJ","2020","7","6","","","10.1107/S205225252001307X","","x-ray","1.54184","CuKα","","0.0438","0.0399","","","0.0957","0.0983","","","","2.45","2.45","2.36","","","","has coordinates","258644","2020-10-30","05:35:30",""
"1559427","14.8477","0.0003","14.8477","0.0003","29.8554","0.0005","90","","90","","90","","6581.7","0.2","180","","180","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H15 N3 Ni O3 -","- C20 H15 N3 Ni O3 -","- C320 H240 N48 Ni16 O48 -","16","1","","Kutniewska, Sylwia E.; Krówczyński, Adam; Kamiński, Radosław; Jarzembska, Katarzyna N.; Pillet, Sébastien; Wenger, Emmanuel; Schaniel, Dominik","Photocrystallographic and spectroscopic studies of a model (N,N,O)-donor square-planar nickel(II) nitro complex: in search of high-conversion and stable photoswitchable materials","IUCrJ","2020","7","6","","","10.1107/S205225252001307X","","x-ray","1.54184","CuKα","","0.0421","0.0374","","","0.0912","0.0937","","","","2.2","2.2","2.11","","","","has coordinates","258644","2020-10-30","05:35:30",""
"1559428","14.8584","0.0003","14.8584","0.0003","29.828","0.0008","90","","90","","90","","6585.2","0.3","200","","200","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H15 N3 Ni O3 -","- C20 H15 N2.999 Ni O2.998 -","- C320 H240 N47.984 Ni16 O47.968 -","16","1","","Kutniewska, Sylwia E.; Krówczyński, Adam; Kamiński, Radosław; Jarzembska, Katarzyna N.; Pillet, Sébastien; Wenger, Emmanuel; Schaniel, Dominik","Photocrystallographic and spectroscopic studies of a model (N,N,O)-donor square-planar nickel(II) nitro complex: in search of high-conversion and stable photoswitchable materials","IUCrJ","2020","7","6","","","10.1107/S205225252001307X","","x-ray","1.54184","CuKα","","0.0424","0.0389","","","0.0943","0.0965","","","","2.47","2.47","2.39","","","","has coordinates","258644","2020-10-30","05:35:30",""
"1559429","14.8663","0.0003","14.8663","0.0003","29.841","0.0005","90","","90","","90","","6595.1","0.2","200","","200","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H15 N3 Ni O3 -","- C20 H15 N3 Ni O3 -","- C320 H240 N48 Ni16 O48 -","16","1","","Kutniewska, Sylwia E.; Krówczyński, Adam; Kamiński, Radosław; Jarzembska, Katarzyna N.; Pillet, Sébastien; Wenger, Emmanuel; Schaniel, Dominik","Photocrystallographic and spectroscopic studies of a model (N,N,O)-donor square-planar nickel(II) nitro complex: in search of high-conversion and stable photoswitchable materials","IUCrJ","2020","7","6","","","10.1107/S205225252001307X","","x-ray","1.54184","CuKα","","0.0453","0.0415","","","0.1","0.102","","","","2.56","2.56","2.46","","","","has coordinates","258644","2020-10-30","05:35:30",""
"1559430","14.8778","0.0003","14.8778","0.0003","29.8291","0.0006","90","","90","","90","","6602.6","0.2","220","","220","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H15 N3 Ni O3 -","- C20 H15 N3 Ni O3 -","- C320 H240 N48 Ni16 O48 -","16","1","","Kutniewska, Sylwia E.; Krówczyński, Adam; Kamiński, Radosław; Jarzembska, Katarzyna N.; Pillet, Sébastien; Wenger, Emmanuel; Schaniel, Dominik","Photocrystallographic and spectroscopic studies of a model (N,N,O)-donor square-planar nickel(II) nitro complex: in search of high-conversion and stable photoswitchable materials","IUCrJ","2020","7","6","","","10.1107/S205225252001307X","","x-ray","1.54184","CuKα","","0.0395","0.0369","","","0.0906","0.0919","","","","2.5","2.5","2.42","","","","has coordinates","258644","2020-10-30","05:35:30",""
"1559431","14.893","0.0006","14.893","0.0006","29.829","0.0013","90","","90","","90","","6616.1","0.5","240","","240","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H15 N3 Ni O3 -","- C20 H15 N3 Ni O3 -","- C320 H240 N48 Ni16 O48 -","16","1","","Kutniewska, Sylwia E.; Krówczyński, Adam; Kamiński, Radosław; Jarzembska, Katarzyna N.; Pillet, Sébastien; Wenger, Emmanuel; Schaniel, Dominik","Photocrystallographic and spectroscopic studies of a model (N,N,O)-donor square-planar nickel(II) nitro complex: in search of high-conversion and stable photoswitchable materials","IUCrJ","2020","7","6","","","10.1107/S205225252001307X","","x-ray","1.54184","CuKα","","0.0992","0.0934","","","0.2251","0.2272","","","","4.76","4.76","4.4","","","","has coordinates","258644","2020-10-30","05:35:30",""
"1559432","14.8976","0.0003","14.8976","0.0003","29.8244","0.0006","90","","90","","90","","6619.2","0.2","240","","240","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H15 N3 Ni O3 -","- C20 H15 N3 Ni O3 -","- C320 H240 N48 Ni16 O48 -","16","1","","Kutniewska, Sylwia E.; Krówczyński, Adam; Kamiński, Radosław; Jarzembska, Katarzyna N.; Pillet, Sébastien; Wenger, Emmanuel; Schaniel, Dominik","Photocrystallographic and spectroscopic studies of a model (N,N,O)-donor square-planar nickel(II) nitro complex: in search of high-conversion and stable photoswitchable materials","IUCrJ","2020","7","6","","","10.1107/S205225252001307X","","x-ray","1.54184","CuKα","","0.0402","0.0375","","","0.0464","0.0472","","","","2.48","2.48","2.39","","","","has coordinates","258644","2020-10-30","05:35:31",""
"1560035","31.8409","0.0002","31.8409","0.0002","11.0234","0.0001","90","","90","","90","","11176","0.14","100","0.1","100","0.1","","","","","","","","4","I 41/a :2","-I 4ad","88","3","C24H44Si4U","","- C24 H44 Si4 U -","- C24 H44 Si4 U -","- C384 H704 Si64 U16 -","16","1","","Tsoureas, Nikolaos; Mansikkamäki, Akseli; Layfield, Richard A.","Synthesis, bonding properties and ether activation reactivity of cyclobutadienyl-ligated hybrid uranocenes","Chemical Science","2021","12","8","2948","2954","10.1039/D0SC05199C","","x-ray","1.54184","CuKα","","0.0313","0.0266","","","0.0591","0.0617","","","","","","1.026","","","","has coordinates","263685","2021-04-05","14:19:37",""
"1560430","35.313","0.003","35.313","0.003","8.7513","0.0009","90","","90","","90","","10912.9","1.7","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C26 H24 Eu N O10 -","- C26 H24 Eu N O10 -","- C416 H384 Eu16 N16 O160 -","16","1","","Ma, Ranran; Chen, Zhiwei; Wang, Suna; Yao, Qingxia; Li, Yunwu; Lu, Jing; Li, Dacheng; Dou, Jianmin","Solvent-induced assembly of two helical Eu(III) metal-organic frameworks and fluorescence sensing activities towards nitrobenzene and Cu 2+ ions","Journal of Solid State Chemistry","2017","252","","142","151","10.1016/j.jssc.2017.05.018","","","0.71073","MoKα","","0.0749","0.0436","","","0.0956","0.1094","","","","","","1.007","","","","has coordinates","262005","2021-02-16","10:08:21",""
"1560597","9.9637","0.0003","9.9637","0.0003","40.898","0.003","90","","90","","90","","4060.2","0.3","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C12 H12 K2 O16 U2 -","- C12 H12 K2 O16 U2 -","- C96 H96 K16 O128 U16 -","8","0.5","","Novikov, S.A.; Grigoriev, M.S.; Serezhkina, L.B.; Serezhkin, V.N.","Potassium and magnesium succinatouranilates ‒ Synthesis and crystal structure","Journal of Solid State Chemistry","2017","248","","178","182","10.1016/j.jssc.2017.02.010","","","0.71073","MoKα","","0.0377","0.0239","","","0.0415","0.0442","","","","","","1.042","","","","has coordinates","262161","2021-02-23","10:37:05",""
"1561063","11.3294","0.0003","11.3294","0.0003","13.1741","0.0009","90","","90","","90","","1690.97","0.13","298","2","298","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C4 H6 Hg N8 -","- C4 H6 Hg N8 -","- C32 H48 Hg8 N64 -","8","0.5","","Liu, Dong-Sheng; Sui, Yan; Ye, Guang-Ming; Wang, Hui-ying; Liu, Jian-Qi; Chen, Wen-Tong","Synthesis, structures and properties of three mercury coordination polymers based on 5-methyltetrazolate ligand","Journal of Solid State Chemistry","2018","263","","182","189","10.1016/j.jssc.2018.04.016","","x-ray","0.71073","MoKα","","0.0324","0.0228","","","0.0583","0.0647","","","","","","1.036","","","","has coordinates","263082","2021-03-17","09:23:42",""
"1561106","24.4097","0.0005","24.4097","0.0005","14.7898","0.0007","90","","90","","90","","8812.3","0.5","297","2","297","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H19 N3 Ni2 O11 S -","- C16 H13 N3 Ni2 O8 S -","- C256 H208 N48 Ni32 O128 S16 -","16","1","","Chen, Yong-Qiang; Tian, Yuan; Li, Na; Liu, Sui-Jun","Ni(II)/Zn(II)-triazolate clusters based MOFs constructed from a V-shaped dicarboxylate ligand: Magnetic properties and phosphate sensing","Journal of Solid State Chemistry","2018","262","","100","105","10.1016/j.jssc.2018.03.015","","","0.71073","MoKα","","0.0385","0.0328","","","0.0764","0.0794","","","","","","0.971","","","","has coordinates","263114","2021-03-18","09:48:10",""
"1561107","24.9898","0.0013","24.9898","0.0013","14.9086","0.0015","90","","90","","90","","9310.3","1.2","297","2","297","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H19 N3 O11 S Zn2 -","- C16 H15 N3 O9 S Zn2 -","- C256 H240 N48 O144 S16 Zn32 -","16","1","","Chen, Yong-Qiang; Tian, Yuan; Li, Na; Liu, Sui-Jun","Ni(II)/Zn(II)-triazolate clusters based MOFs constructed from a V-shaped dicarboxylate ligand: Magnetic properties and phosphate sensing","Journal of Solid State Chemistry","2018","262","","100","105","10.1016/j.jssc.2018.03.015","","","0.71073","MoKα","","0.034","0.029","","","0.0719","0.0741","","","","","","1.044","","","","has coordinates","263114","2021-03-18","09:48:11",""
"1561108","5.15539","0.00012","5.15539","0.00012","11.192","0.0004","90","","90","","90","","297.461","0.014","293","1","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- Cd3.88 Mo3.88 O16 W0.12 Yb0.08 -","- Cd3.8824 Mo3.8824 O16 W0.1176 Yb0.0784 -","- Cd3.8824 Mo3.8824 O16 W0.1176 Yb0.0784 -","1","0.0625","","Groń, T.; Tomaszewicz, E.; Berkowski, M.; Głowacki, M.; Oboz, M.; Kusz, J.; Sawicki, B.; Kukuła, Z.; Duda, H.","Yb3±doped cadmium molybdato-tungstate single crystal ‒ Its structural, optical, magnetic and transport properties","Journal of Solid State Chemistry","2018","262","","164","171","10.1016/j.jssc.2018.03.014","","x-ray","0.71073","MoKα","","0.0183","0.0175","","","0.0534","0.0551","","","","","","1.166","","","","has coordinates","263115","2021-03-18","10:14:44",""
"1561284","13.8792","0.0009","13.8792","","39.672","0.003","90","","90","","90","","7642.1","0.8","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C11 H15 N6 O8 U -","- C7 H6 N5 O7 U -","- C112 H96 N80 O112 U16 -","16","1","","Tian, Hong-Hong; Chen, Liang-Ting; Zhang, Rong-Lan; Zhao, Jian-She; Liu, Chi-Yang; Weng, Ng Seik","A novel stable 3D luminescent uranyl complex for highly efficient and sensitive recognition of Ru3+ and biomolecules","Journal of Solid State Chemistry","2018","258","","674","681","10.1016/j.jssc.2017.11.032","","","0.71073","MoKα","","0.0569","0.0347","","","0.0785","0.086","","","","","","0.937","","","","has coordinates","263354","2021-03-26","09:37:04",""
"1561422","5.3414","0.0002","5.3414","0.0002","11.7393","0.0006","90","","90","","90","","334.93","0.02","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- La0.52 Mo Na0.48 O4 -","- La0.516 Mo Na0.484 O4 -","- La2.064 Mo4 Na1.936 O16 -","4","0.25","","Cortese, Anthony J.; Abeysinghe, Dileka; Smith, Mark D.; zur Loye, Hans-Conrad","Single crystal growth and characterization of NaxLn1−xMoO4, Ln=La, Ce, Pr, Nd, Sm, and Eu (x=0.397‒0.499)","Journal of Solid State Chemistry","2016","240","","76","81","10.1016/j.jssc.2016.05.007","","","0.71073","MoKα","","0.0289","0.0271","","","0.0434","0.044","","","","","","1.396","","","","has coordinates","263526","2021-04-01","09:14:31",""
"1561423","5.3173","0.0002","5.3173","0.0002","11.6652","0.0006","90","","90","","90","","329.82","0.02","301","2","301","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Ce0.51 Mo Na0.49 O4 -","- Ce0.5121 Mo Na0.4879 O4 -","- Ce2.0484 Mo4 Na1.9516 O16 -","4","0.25","","Cortese, Anthony J.; Abeysinghe, Dileka; Smith, Mark D.; zur Loye, Hans-Conrad","Single crystal growth and characterization of NaxLn1−xMoO4, Ln=La, Ce, Pr, Nd, Sm, and Eu (x=0.397‒0.499)","Journal of Solid State Chemistry","2016","240","","76","81","10.1016/j.jssc.2016.05.007","","","0.71073","MoKα","","0.0313","0.0222","","","0.0439","0.0473","","","","","","1.224","","","","has coordinates","263526","2021-04-01","09:14:41",""
"1561424","5.3009","0.00015","5.3009","0.00015","11.6089","0.0007","90","","90","","90","","326.2","0.02","301","2","301","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Mo Na0.5 O4 Pr0.5 -","- Mo Na0.4984 O4 Pr0.5016 -","- Mo4 Na1.9936 O16 Pr2.0064 -","4","0.25","","Cortese, Anthony J.; Abeysinghe, Dileka; Smith, Mark D.; zur Loye, Hans-Conrad","Single crystal growth and characterization of NaxLn1−xMoO4, Ln=La, Ce, Pr, Nd, Sm, and Eu (x=0.397‒0.499)","Journal of Solid State Chemistry","2016","240","","76","81","10.1016/j.jssc.2016.05.007","","","0.71073","MoKα","","0.0309","0.0195","","","0.0491","0.054","","","","","","1.042","","","","has coordinates","263526","2021-04-01","09:14:44",""
"1561425","5.2854","0.0002","5.2854","0.0002","11.5675","0.0006","90","","90","","90","","323.14","0.02","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Mo Na0.5 Nd0.5 O4 -","- Mo Na0.4989 Nd0.5011 O4 -","- Mo4 Na1.9956 Nd2.0044 O16 -","4","0.25","","Cortese, Anthony J.; Abeysinghe, Dileka; Smith, Mark D.; zur Loye, Hans-Conrad","Single crystal growth and characterization of NaxLn1−xMoO4, Ln=La, Ce, Pr, Nd, Sm, and Eu (x=0.397‒0.499)","Journal of Solid State Chemistry","2016","240","","76","81","10.1016/j.jssc.2016.05.007","","","0.71073","MoKα","","0.0224","0.0185","","","0.0474","0.0498","","","","","","1.118","","","","has coordinates","263526","2021-04-01","09:14:44",""
"1561426","5.256","0.0002","5.256","0.0002","11.4921","0.0006","90","","90","","90","","317.48","0.02","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Mo Na0.49 O4 Sm0.51 -","- Mo Na0.4908 O4 Sm0.5092 -","- Mo4 Na1.9632 O16 Sm2.0368 -","4","0.25","","Cortese, Anthony J.; Abeysinghe, Dileka; Smith, Mark D.; zur Loye, Hans-Conrad","Single crystal growth and characterization of NaxLn1−xMoO4, Ln=La, Ce, Pr, Nd, Sm, and Eu (x=0.397‒0.499)","Journal of Solid State Chemistry","2016","240","","76","81","10.1016/j.jssc.2016.05.007","","","0.71073","MoKα","","0.0312","0.0252","","","0.0664","0.0713","","","","","","1.212","","","","has coordinates","263526","2021-04-01","09:14:44",""
"1561427","5.2797","0.0002","5.2797","0.0002","11.5869","0.0007","90","","90","","90","","322.99","0.03","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Eu0.6 Mo Na0.4 O4 -","- Eu0.6028 Mo Na0.3972 O4 -","- Eu2.4112 Mo4 Na1.5888 O16 -","4","0.25","","Cortese, Anthony J.; Abeysinghe, Dileka; Smith, Mark D.; zur Loye, Hans-Conrad","Single crystal growth and characterization of NaxLn1−xMoO4, Ln=La, Ce, Pr, Nd, Sm, and Eu (x=0.397‒0.499)","Journal of Solid State Chemistry","2016","240","","76","81","10.1016/j.jssc.2016.05.007","","","0.71073","MoKα","","0.023","0.0161","","","0.0334","0.0353","","","","","","1.158","","","","has coordinates","263526","2021-04-01","09:14:44",""
"1561849","5.3909","0.0001","5.3909","0.0001","12.006","0.0005","90","","90","","90","","348.916","0.017","296","2","296","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Eu Mo O4 -","- Eu Mo O4 -","- Eu4 Mo4 O16 -","4","0.25","","Abeysinghe, Dileka; Gerke, Birgit; Morrison, Gregory; Hsieh, Chun H.; Smith, Mark D.; Pöttgen, Rainer; Makris, Thomas M.; zur Loye, Hans-Conrad","Synthesis, characterization, and properties of reduced europium molybdates and tungstates","Journal of Solid State Chemistry","2015","229","","173","180","10.1016/j.jssc.2015.05.014","","","0.71073","MoKα","","0.0184","0.0155","","","0.0342","0.0357","","","","","","1.143","","","","has coordinates","264239","2021-04-16","08:25:31",""
"1561850","5.4145","0.0003","5.4145","0.0003","11.9494","0.0011","90","","90","","90","","350.32","0.04","296","2","296","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Eu O4 W -","- Eu O4 W -","- Eu4 O16 W4 -","4","0.25","","Abeysinghe, Dileka; Gerke, Birgit; Morrison, Gregory; Hsieh, Chun H.; Smith, Mark D.; Pöttgen, Rainer; Makris, Thomas M.; zur Loye, Hans-Conrad","Synthesis, characterization, and properties of reduced europium molybdates and tungstates","Journal of Solid State Chemistry","2015","229","","173","180","10.1016/j.jssc.2015.05.014","","","0.71073","MoKα","","0.041","0.0263","","","0.0677","0.075","","","","","","1.13","","","","has coordinates","264239","2021-04-16","08:25:32",""
"1561851","5.3857","0.0002","5.3857","0.0002","11.9827","0.0006","90","","90","","90","","347.57","0.03","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Eu0.91 K0.09 Mo O4 -","- Eu0.906 K0.094 Mo O4 -","- Eu3.624 K0.376 Mo4 O16 -","4","0.25","","Abeysinghe, Dileka; Gerke, Birgit; Morrison, Gregory; Hsieh, Chun H.; Smith, Mark D.; Pöttgen, Rainer; Makris, Thomas M.; zur Loye, Hans-Conrad","Synthesis, characterization, and properties of reduced europium molybdates and tungstates","Journal of Solid State Chemistry","2015","229","","173","180","10.1016/j.jssc.2015.05.014","","","0.71073","MoKα","","0.0189","0.016","","","0.0418","0.0434","","","","","","1.152","","","","has coordinates","264239","2021-04-16","08:25:32",""
"1561852","5.4101","0.0002","5.4101","0.0002","11.9246","0.0007","90","","90","","90","","349.02","0.03","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Eu0.9 K0.1 O4 W -","- Eu0.903 K0.097 O4 W -","- Eu3.612 K0.388 O16 W4 -","4","0.25","","Abeysinghe, Dileka; Gerke, Birgit; Morrison, Gregory; Hsieh, Chun H.; Smith, Mark D.; Pöttgen, Rainer; Makris, Thomas M.; zur Loye, Hans-Conrad","Synthesis, characterization, and properties of reduced europium molybdates and tungstates","Journal of Solid State Chemistry","2015","229","","173","180","10.1016/j.jssc.2015.05.014","","","0.71073","MoKα","","0.0254","0.0163","","","0.0347","0.0378","","","","","","1.072","","","","has coordinates","264239","2021-04-16","08:25:32",""
"1562400","26.4901","0.0004","26.4901","0.0004","44.94","0.0011","90","","90","","90","","31535.5","1","100","0.1","100","0.1","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C84 H76 B4 N10 -","- C84 H76 B4 N10 -","- C1344 H1216 B64 N160 -","16","1","","Niermeier, Philipp; Maibom, Kristina; Lamm, Jan-Hendrik; Neumann, Beate; Stammler, Georg; Mitzel, Norbert Werner","Hydrogen-Bond-Induced Selectivity of a Head-to-Head Photo- Dimerization of Dialkynylanthracene ‒ Access to Tetra Lewis Acids","Chemical Science","2021","","","","","10.1039/D1SC02065J","","x-ray","1.54184","CuKα","","0.1095","0.075","","","0.1677","0.1949","","","","","","1.023","","","","has coordinates","265012","2021-05-07","01:25:33",""
"1563185","14.194","0.003","14.194","0.003","24.818","0.006","90","","90","","90","","5000.1","1.9","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C4 H14 B4 Co2 N4 O27 P6 -","- C4 H14 B4 Co2 N4 O27 P6 -","- C32 H112 B32 Co16 N32 O216 P48 -","8","0.5","","Liu, Wei; Guo, Xiang-Qin; Su, Ge; Cao, Li-Xin; Wang, Yong-Gang; Duan, Jing-Rui","A new organically-templated cobalt borophosphate with a novel borophosphatic anionic partial structure","Journal of Solid State Chemistry","2011","184","9","2538","2542","10.1016/j.jssc.2011.07.032","","","0.71073","MoKα","","0.1278","0.0779","","","0.1445","0.1644","","","","","","1.092","","","","has coordinates","266215","2021-06-07","09:14:33",""
"1563274","17.07243","0.00019","17.07243","0.00019","21.9046","0.0004","90","","90","","90","","6384.49","0.15","149.96","0.1","149.96","0.1","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C15 H23 N O Si -","- C15 H23 N O Si -","- C240 H368 N16 O16 Si16 -","16","1","","Yan, Zhi-Bo; Peng, Meng; Chen, Qi-Long; Lu, Ka; Tu, Yong Qiang; Dai, Kun Long; Zhang, Fu-Min; Zhang, Xiao-Ming","An Effective and Versatile Strategy for the Synthesis of Structurally Diverse Heteroarylsilanes via Ir(III)-Catalyzed C−H Silylation","Chemical Science","2021","","","","","10.1039/D1SC02344F","","x-ray","1.54184","CuKα","","0.0518","0.048","","","0.1321","0.1356","","","","","","1.083","","","","has coordinates","266340","2021-06-10","01:30:45",""
"1563305","20.627","0.002","20.627","0.002","35.584","0.005","90","","90","","90","","15140","3","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C86 H62 Cd2 N20 O11 -","- C86 H56 Cd2 N20 O11 -","- C688 H448 Cd16 N160 O88 -","8","0.5","","Wang, Xiuli; Zhang, Jinxia; Liu, Guocheng; Lin, Hongyan","A series of Cd(II) complexes with π‒π stacking and hydrogen bonding interactions: Structural diversities by varying the ligands","Journal of Solid State Chemistry","2011","184","2","280","288","10.1016/j.jssc.2010.11.016","","","0.71073","MoKα","","0.1212","0.0539","","","0.1199","0.1538","","","","","","1","","","","has coordinates","266361","2021-06-10","09:34:23",""
"1563307","20.587","0.005","20.587","0.005","34.824","0.005","90","0.005","90","0.005","90","0.005","14759","5","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C82 H58 Cd2 N16 O9 S4 -","- C82 H56 Cd2 N16 O9 S4 -","- C656 H448 Cd16 N128 O72 S32 -","8","0.5","","Wang, Xiuli; Zhang, Jinxia; Liu, Guocheng; Lin, Hongyan","A series of Cd(II) complexes with π‒π stacking and hydrogen bonding interactions: Structural diversities by varying the ligands","Journal of Solid State Chemistry","2011","184","2","280","288","10.1016/j.jssc.2010.11.016","","","0.71069","MoKα","","0.0664","0.034","","","0.0737","0.0949","","","","","","1.079","","","","has coordinates","266361","2021-06-10","09:34:23",""
"1563327","11.4366","0.0012","11.4366","0.0012","11.833","0.002","90","","90","","90","","1547.7","0.3","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","Sodium thorium tetrakis(tungstates)","","","- Na4 O16 Th W4 -","- Na4 O16 Th W4 -","- Na16 O64 Th4 W16 -","4","0.25","","Bang Jin, Geng; Soderholm, L.","Syntheses and single-crystal structures of CsTh(MoO4)2Cl and Na4Th(WO4)4","Journal of Solid State Chemistry","2011","184","2","337","342","10.1016/j.jssc.2010.12.003","","","0.71073","MoKα","","0.0461","0.0302","","","0.0659","0.0706","","","","","","1.058","","","","has coordinates","266391","2021-06-11","06:57:10",""
"1563583","21.999","0.002","21.999","0.002","16.7023","0.0015","90","","90","","90","","8083.2","1.3","298","2","298","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C28 H48 Ce4 N4 O74 Si W12 -","- C28 H48 Ce4 N4 O74 Si W12 -","- C112 H192 Ce16 N16 O296 Si4 W48 -","4","0.25","","Gao, Yuanzhe; Xu, Yanqing; Han, Zhangang; Li, Chunhong; Cui, Fengyun; Chi, Yingnan; Hu, Changwen","Syntheses, structures and properties of 3D inorganic‒organic hybrid frameworks constructed from lanthanide polymer and Keggin-type tungstosilicate","Journal of Solid State Chemistry","2010","183","5","1000","1006","10.1016/j.jssc.2010.03.006","","","0.71073","MoKα","","0.0731","0.0578","","","0.1398","0.1509","","","","","","1.15","","","","has coordinates","266564","2021-06-18","09:29:44",""
"1563584","21.8937","0.0019","21.8937","0.0019","16.7687","0.0015","90","","90","","90","","8037.8","1.2","298","2","298","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C28 H48 La4 N4 O74 Si W12 -","- C28 H44 La4 N4 O74 Si W12 -","- C112 H176 La16 N16 O296 Si4 W48 -","4","0.25","","Gao, Yuanzhe; Xu, Yanqing; Han, Zhangang; Li, Chunhong; Cui, Fengyun; Chi, Yingnan; Hu, Changwen","Syntheses, structures and properties of 3D inorganic‒organic hybrid frameworks constructed from lanthanide polymer and Keggin-type tungstosilicate","Journal of Solid State Chemistry","2010","183","5","1000","1006","10.1016/j.jssc.2010.03.006","","","0.71073","MoKα","","0.0552","0.0359","","","0.0837","0.0997","","","","","","1.141","","","","has coordinates","266564","2021-06-18","09:29:44",""
"1563585","21.917","0.002","21.917","0.002","16.5868","0.0018","90","","90","","90","","7967.6","1.3","298","2","298","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C28 H48 N4 Nd4 O78 Si W12 -","- C28 H32 N4 Nd4 O74 Si W12 -","- C112 H128 N16 Nd16 O296 Si4 W48 -","4","0.25","","Gao, Yuanzhe; Xu, Yanqing; Han, Zhangang; Li, Chunhong; Cui, Fengyun; Chi, Yingnan; Hu, Changwen","Syntheses, structures and properties of 3D inorganic‒organic hybrid frameworks constructed from lanthanide polymer and Keggin-type tungstosilicate","Journal of Solid State Chemistry","2010","183","5","1000","1006","10.1016/j.jssc.2010.03.006","","","0.71073","MoKα","","0.0971","0.061","","","0.1257","0.1472","","","","","","1.125","","","","has coordinates","266564","2021-06-18","09:29:45",""
"1563828","30.0121","0.0013","30.0121","0.0013","16.4324","0.0007","90","","90","","90","","14801.1","1.1","153","2","153","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C32 H30 N2 O6 Si -","- C32 H30 N2 O6 Si -","- C512 H480 N32 O96 Si16 -","16","1","","Schwarzer, Sandra; Böhme, Uwe; Fels, Sabine; Günther, Betty; Brendler, Erica","(S)-N-[(2-hydroxynaphthalen-1-yl)methylidene]valine ‒ A valuable ligand for the preparation of chiral complexes","Inorganica Chimica Acta","2018","483","","136","147","10.1016/j.ica.2018.08.011","","","0.71073","MoKα","","0.1543","0.1056","","","0.308","0.3406","","","","","","1.049","","","","has coordinates","266854","2021-07-01","07:24:33",""
"1563931","30.289","0.0014","30.289","0.0014","8.1594","0.0008","90","","90","","90","","7485.6","0.9","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C14 H4 N O8.25 S Zn -","- C14 H4 N O8.25 S Zn -","- C224 H64 N16 O132 S16 Zn16 -","16","1","","Cheng, Ai-Ling; Zhang, Juan; Ren, Ling-Ling; Gao, En-Qing","A new anionic metal-organic framework based on tetranuclear zinc clusters: Selective absorption of CO2 and luminescent response to lanthanide (III) ions","Inorganica Chimica Acta","2018","482","","154","159","10.1016/j.ica.2018.05.039","","","0.71073","MoKα","","0.0506","0.0417","","","0.1185","0.1225","","","","","","1.051","","","","has coordinates,has disorder","266991","2021-07-05","09:15:09",""
"1564329","19.559","0.002","19.559","0.002","16.966","0.003","90","","90","","90","","6490.4","1.5","150","2","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C17 H15 N5 O3 -","- C17 H15 N5 O3 -","- C272 H240 N80 O48 -","16","1","","Das, Bhriguram; Dolai, Malay; Ghosh, Avijit; Dhara, Anamika; Mahapatra, Ananya Das; Chattopadhyay, Debprasad; Mabhai, Subhabrata; Jana, Atanu; Dey, Satyajit; Misra, Ajay","A bio-compatible pyridine-pyrazole hydrazide based compartmental receptor for Al<sup>3+</sup> sensing and its application in cell imaging.","Analytical methods : advancing methods and applications","2021","13","37","4266","4279","10.1039/d1ay00963j","","","0.71073","MoKα","","0.083","0.0419","","","0.097","0.115","","","","","","1.008","","","","has coordinates","269598","2021-10-06","13:26:33",""
"1564586","24.454","0.006","24.454","0.006","16.024","0.004","90","","90","","90","","9582","4","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C44 H50 N6 O12 Zn3 -","- C44 H50 N6 O12 Zn3 -","- C352 H400 N48 O96 Zn24 -","8","0.5","","Liu, Chao; Chen, Ming-Xing; Li, Ming","Synthesis, crystal structures, catalytic application and antibacterial activities of Cu(II) and Zn(II) complexes bearing salicylaldehyde-imine ligands","Inorganica Chimica Acta","2020","508","","119639","","10.1016/j.ica.2020.119639","","","0.71073","MoKα","","0.0554","0.0318","","","0.0729","0.0843","","","","","","1.034","","","","has coordinates","269024","2021-09-07","09:43:41",""
"1565079","17.4201","0.0007","17.4201","0.0007","26.248","0.003","90","","90","","90","","7965.2","1","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","tetrakis(4-dihydroxyborylphenyl)adamantane dioxane disolvate water monosolvate","","- C42 H54 B4 O13 -","- C42 H54 B4 O13 -","- C336 H432 B32 O104 -","8","0.5","","Drapała, Jakub; Marek-Urban, Paulina H.; Klimkowski, Piotr; Urbanowicz, Karolina A.; Gontarczyk, Krzysztof; Woźniak, Krzysztof; Luliński, Sergiusz; Durka, Krzysztof","Design of solvatomorphic structures based on a polyboronated tetraphenyladamantane molecular tecton","CrystEngComm","2021","23","46","8169","8182","10.1039/D1CE01297E","","x-ray","1.54178","CuKα","","0.127","0.1118","","","0.3483","0.3637","","","","","","1.67","","","","has coordinates","271178","2021-12-07","03:09:07",""
"1565207","52.0433","0.0002","52.0433","0.0002","14.00387","0.0001","90","","90","","90","","37929.6","0.3","160","1","160","1","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C45.5 H49.5 Cu I4 N4 -","- C44 H46 Cu I4 N4 -","- C1408 H1472 Cu32 I128 N128 -","32","2","","Karges, Johannes; Blacque, Olivier; Gasser, Gilles","Metal dipyrrin complexes as potential photosensitizers for photodynamic therapy","Inorganica Chimica Acta","2020","505","","119482","","10.1016/j.ica.2020.119482","","x-ray","1.54184","CuKα","","0.044","0.0338","","","0.0765","0.0811","","","","","","1.018","","","","has coordinates","274567","2022-04-19","14:22:37",""
"1565451","28.7507","0.0013","28.7507","0.0013","17.9975","0.0009","90","","90","","90","","14876.8","1.2","112","","112","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C94 H113.2 Cl8 Fe4 N46 O57.6 -","- C94 H92.7 Cl8 Fe4 N46 O57.6 -","- C376 H370.8 Cl32 Fe16 N184 O230.4 -","4","0.25","","Tanaka, Tsubasa; Sunatsuki, Yukinari; Suzuki, Takayoshi","Synthesis and magnetic properties of tetrahedral tetranuclear iron(II) complexes with bis(bidentate)-type Schiff bases containing imidazole groups","Inorganica Chimica Acta","2020","502","","119373","","10.1016/j.ica.2019.119373","","","0.71075","MoKα","","0.0985","0.0796","","","0.233","0.2526","","","","","","1.032","","","","has coordinates","270939","2021-11-30","10:15:30",""
"1565452","28.627","0.004","28.627","0.004","18.807","0.003","90","","90","","90","","15412","4","112","","112","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C120 H140 B8 F32 Fe4 N48 O4 -","- C120 H96 B8 F32 Fe4 N48 O4 -","- C480 H384 B32 F128 Fe16 N192 O16 -","4","0.25","","Tanaka, Tsubasa; Sunatsuki, Yukinari; Suzuki, Takayoshi","Synthesis and magnetic properties of tetrahedral tetranuclear iron(II) complexes with bis(bidentate)-type Schiff bases containing imidazole groups","Inorganica Chimica Acta","2020","502","","119373","","10.1016/j.ica.2019.119373","","","0.71075","MoKα","","0.1022","0.0738","","","0.2202","0.242","","","","","","1.044","","","","has coordinates","270939","2021-11-30","10:15:33",""
"1565620","18.7509","0.0009","18.7509","0.0009","30.2733","0.0015","90","","90","","90","","10644","0.9","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C92 H88 N24 O40 Zn8 -","- C92 H88 N24 O40 Zn8 -","- C368 H352 N96 O160 Zn32 -","4","0.25","","Bharati, Ashok Kumar; Somnath,; Lama, Prem; Siddiqui, Kafeel Ahmad","A novel mixed ligand Zn-coordination polymer: Synthesis, crystal structure, thermogravimetric analysis and photoluminescent properties","Inorganica Chimica Acta","2020","500","","119219","","10.1016/j.ica.2019.119219","","","0.71073","MoKα","","0.0196","0.0181","","","0.0455","0.0462","","","","","","1.03","","","","has coordinates","271295","2021-12-09","09:58:19",""
"1566015","24.2528","0.0002","24.2528","0.0002","27.6148","0.0007","90","","90","","90","","16243","0.5","100.01","0.1","100.01","0.1","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C152 H136 N16 O16 Zn4 -","- C152 H136 N16 O16 Zn4 -","- C608 H544 N64 O64 Zn16 -","4","0.25","","Niklas, J.E.; Hiti, E.A.; Wilkinson, G.R.; Mayhugh, J.T.; Gorden, J.D.; Gorden, A.E.V.","Steric control of mesocate and helicate formation: Bulky pyrrol-2-yl Schiff base complexes of Zn2+","Inorganica Chimica Acta","2022","529","","120653","","10.1016/j.ica.2021.120653","","x-ray","1.54184","CuKα","","0.1071","0.0939","","","0.2964","0.3395","","","","","","1.4752","","","","has coordinates,has disorder","272098","2022-01-18","09:17:36",""
"1567305","25.3833","0.0004","25.3833","0.0004","65.6666","0.0017","90","","90","","90","","42309.8","1.4","140.1","0.5","140.1","0.5","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C72 H162 Cs2 O25 Si6 U2 -","- C72 H162 Cs2 O25 Si6 U2 -","- C1152 H2592 Cs32 O400 Si96 U32 -","16","1","","Jori, Nadir; Rajeshkumar, Thayalan; Scopelliti, Rosario; Z̆ivković, Ivica; Sienkiewicz, Andrzej; Maron, Laurent; Mazzanti, Marinella","Cation assisted binding and cleavage of dinitrogen by uranium complexes","Chemical Science","2022","13","32","9232","9242","10.1039/D2SC02530B","","x-ray","1.54184","CuKα","","0.0982","0.0556","","","0.1198","0.1475","","","","","","1.0072","","","","has coordinates,has disorder","277654","2022-09-06","09:54:36",""
"1567494","23.5399","0.0008","23.5399","0.0008","24.957","0.0011","90","","90","","90","","13829.3","0.9","102","2","102","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C39 H38 B F5 N3 O -","- C39 H38 B F5 N3 O -","- C624 H608 B16 F80 N48 O16 -","16","1","","Chen, Chaohuang; Daniliuc, Constantin Gabriel; Klabunde, Sina; Hansen, Michael Ryan; Kehr, Gerald; Erker, Gerhard","Generation of Boryl-nitroxide Radicals from a Boraalkene via the Nitroso Ene Reaction","Chemical Science","2022","","","","","10.1039/D2SC02485C","","","0.71073","MoKα","","0.0555","0.0422","","","0.0926","0.0995","","","","","","1.03","","","","has coordinates","277305","2022-08-18","22:08:29",""
"1567974","16.3337","0.0003","16.3337","0.0003","20.1543","0.0005","90","","90","","90","","5376.96","0.19","200","","200","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C6 H10 Br Cu2 N3 -","- C6 H10 Br Cu2 N3 -","- C96 H160 Br16 Cu32 N48 -","16","1","","Li, Haipeng; Dou, Zhao-Di; Xiao, Yi; Fan, Guan-Jiang; Pan, Dong-Chen; Hu, Mancheng; Zhai, Quan-Guo","Rational regulation of acetylene adsorption and separation for ultra-microporous copper-1,2,4-triazolate frameworks by halogen hydrogen bonds","Nanoscale","2022","","","","","10.1039/D2NR04187A","","x-ray","0.71073","MoKα","","0.0317","0.028","","","0.0881","0.0891","","","","","","1.111","","","","has coordinates,has disorder","279276","2022-11-15","01:31:41",""
"1567975","16.5753","0.0017","16.5753","0.0017","19.196","0.0018","90","","90","","90","","5273.9","0.9","298","2","298.15","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C8 H14 Br Cu2 N3 -","- C8 H14 Br Cu2 N3 -","- C128 H224 Br16 Cu32 N48 -","16","1","","Li, Haipeng; Dou, Zhao-Di; Xiao, Yi; Fan, Guan-Jiang; Pan, Dong-Chen; Hu, Mancheng; Zhai, Quan-Guo","Rational regulation of acetylene adsorption and separation for ultra-microporous copper-1,2,4-triazolate frameworks by halogen hydrogen bonds","Nanoscale","2022","","","","","10.1039/D2NR04187A","","x-ray","0.71073","MoKα","","0.0752","0.0349","","","0.0777","0.0984","","","","","","1.046","","","","has coordinates,has disorder","279276","2022-11-15","01:31:42",""
"1567976","15.9814","0.0007","15.9814","0.0007","20.7345","0.0018","90","","90","","90","","5295.7","0.6","153.02","","153.02","","","","","","","","","5","I 41/a :2","-I 4ad","88","","SNNU-314-Cl","","- C8 H14 Cl Cu2 N3 -","- C8 H14 Cl Cu2 N3 -","- C128 H224 Cl16 Cu32 N48 -","16","1","","Li, Haipeng; Dou, Zhao-Di; Xiao, Yi; Fan, Guan-Jiang; Pan, Dong-Chen; Hu, Mancheng; Zhai, Quan-Guo","Rational regulation of acetylene adsorption and separation for ultra-microporous copper-1,2,4-triazolate frameworks by halogen hydrogen bonds","Nanoscale","2022","","","","","10.1039/D2NR04187A","","x-ray","1.54178","CuKα","","0.0665","0.0652","","","0.2007","0.2028","","","","","","1.03","","","","has coordinates,has disorder","279276","2022-11-15","01:31:42",""
"1567977","16.0496","0.0006","16.0496","0.0006","20.19","0.0017","90","","90","","90","","5200.7","0.5","153","2","153.15","","","","","","","","","5","I 41/a :2","-I 4ad","88","","SNNU-313-Cl","","- C6 H8 Cl Cu2 N3 -","- C6 H8 Cl Cu2 N3 -","- C96 H128 Cl16 Cu32 N48 -","16","1","","Li, Haipeng; Dou, Zhao-Di; Xiao, Yi; Fan, Guan-Jiang; Pan, Dong-Chen; Hu, Mancheng; Zhai, Quan-Guo","Rational regulation of acetylene adsorption and separation for ultra-microporous copper-1,2,4-triazolate frameworks by halogen hydrogen bonds","Nanoscale","2022","","","","","10.1039/D2NR04187A","","x-ray","1.54184","CuKα","","0.0868","0.0838","","","0.2407","0.2468","","","","","","1.139","","","","has coordinates,has disorder","279276","2022-11-15","01:31:43",""
"1568259","17.675","0.003","17.675","0.003","29.023","0.005","90","","90","","90","","9067","3","302.45","","302.45","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C30 H21 B N2 O -","- C30 H21 B N2 O -","- C480 H336 B16 N32 O16 -","16","1","","Gai, Lizhi; Zhang, Ruijing; Shi, Xiuguang; Ni, Zhigang; Wang, Sisi; Zhang, Jun-Long; Lu, Hua; Guo, Zijian","BOINPYs: facile synthesis and photothermal properties triggered by photoinduced nonadiabatic decay.","Chemical science","2023","14","6","1434","1442","10.1039/d2sc06435a","","","0.71073","MoKα","","0.1405","0.0643","","","0.1667","0.2155","","","","","","1.018","","","","has coordinates","281372","2023-03-04","17:56:37",""
"1568826","19.3447","0.0015","19.3447","0.0015","10.3928","0.001","90","","90","","90","","3889.2","0.6","100","","100","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C8 H17 Li O2 -","- C8 H17 Li O2 -","- C128 H272 Li16 O32 -","16","1","","Deglmann, Peter; Machleit, Sara; Gallizioli, Cesare; Rupf, Susanne M.; Plajer, Alex J.","Lithium catalysed sequence selective ring opening terpolymerisation: a mechanistic study","Catalysis Science & Technology","2023","13","10","2937","2945","10.1039/D3CY00301A","","","0.71073","MoKα","","0.0649","0.0511","","","0.1476","0.1601","","","","","","1.033","","","","has coordinates,has disorder","284160","2023-06-05","03:20:35",""
"1569330","22.9835","0.0006","22.9835","0.0006","14.1686","0.0004","90","","90","","90","","7484.4","0.3","100","","100","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C19 H19 Bi Cl2 N2 -","- C19 H19 Bi Cl2 N2 -","- C304 H304 Bi16 Cl32 N32 -","16","1","","Korzun, André; Crespi, Stefano; Golz, Christopher; Bismuto, Alessandro","Replacing the BO in BODIPY: unlocking the path to SBDIPY and BIDIPY chromophores.","Chemical science","2023","14","24","6579","6584","10.1039/d3sc01493b","","x-ray","0.71073","MoKα","","0.0221","0.0187","","","0.0438","0.0452","","","","","","1.049","","","","has coordinates","284570","2023-06-29","09:21:02",""
"1569650","22.561","0.0004","22.561","0.0004","80.946","0.004","90","","90","","90","","41201","2","173","2","173.02","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C176 H208 Al Bi8 O22 -","- C176 H208 Al Bi8 O22 -","- C1408 H1664 Al8 Bi64 O176 -","8","0.5","","Hou, Baoshan; Zheng, Haiyan; Zhang, Kunhao; Wu, Qi; Qin, Chao; Sun, Chunyi; Pan, Qinhe; Kang, Zhenhui; Wang, Xinlong; Su, Zhongmin","Electron delocalization of robust high-nuclear bismuth-oxo clusters for promoted CO<sub>2</sub> electroreduction.","Chemical science","2023","14","33","8962","8969","10.1039/d3sc02924g","","x-ray","0.71073","MoKα","K-L~3~","0.101","0.0544","","","0.1166","0.1343","","","","","","1.022","","","","has coordinates","286048","2023-09-05","19:11:52",""
"1569688","19.7947","0.0003","19.7947","0.0003","16.0477","0.0003","90","","90","","90","","6287.97","0.18","200","2","200","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C56 H40 Fe2 N24 O4 W -","- C56 H40 Fe2 N24 O4 W -","- C224 H160 Fe8 N96 O16 W4 -","4","0.25","","Magott, Michał; Płonka, Klaudia; Sieklucka, Barbara; Dziedzic-Kocurek, Katarzyna; Kosaka, Wataru; Miyasaka, Hitoshi; Pinkowicz, Dawid","Guest-induced pore breathing controls the spin state in a cyanido-bridged framework.","Chemical science","2023","14","36","9651","9663","10.1039/d3sc03255h","","","0.71073","MoKα","","0.023","0.0201","","","0.0523","0.0535","","","","","","1.095","","","","has coordinates","286711","2023-10-05","23:51:34",""
"1570700","32.828","0.003","32.828","0.003","17.2912","0.0017","90","","90","","90","","18634","3","170","","170","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C19 H26 N Ni O -","- C19 H26 N Ni O -","- C608 H832 N32 Ni32 O32 -","32","2","","Tian, Wanlu; Li, Chao; Tan, Chen; Chen, Min","Lewis acid-induced homo- and heterogeneous nickel catalysts for ethylene polymerization and copolymerization with polar monomers","Polymer Chemistry","2024","15","7","631","638","10.1039/D3PY01266B","","","0.71073","MoKα","","0.1118","0.0761","","","0.1774","0.1992","","","","","","1.015","","","","has coordinates,has disorder","290285","2024-03-04","20:46:43",""
"1570753","5.2427","0.0001","5.2427","0.0001","11.372","0.0002","90","","90","","90","","312.57","0.01","","","298","","","","100","","","","","3","I 41/a :2","-I 4ad","88","CaWO4","","scheelite","- Ca O4 W -","- Ca O4 W -","- Ca4 O16 W4 -","4","0.25","","Murai, K.; Yamashita, K.; Kitahara, G.; Tokuda, M.; Yoshiasa, A.","Synthesis, single crystal structure analyses and ultraviolet light emission of CaW1-xMoxO4 (x = 0.0-1.0) scheelite-powellite solid solutions","Journal of Mineralogical and Petrological Sciences","2023","","","1","10","10.2465/jmps.220901","","","","","","","","","","","","","","","","","","","","","has coordinates","289016","2024-01-10","03:01:57",""
"1570754","5.2236","0.0001","5.2236","0.0001","11.4285","0.0004","90","","90","","90","","311.838","0.014","","","298","","","","100","","","","","3","I 41/a :2","-I 4ad","88","CaMoO4","","powellite","- Ca Mo O4 -","- Ca Mo O4 -","- Ca4 Mo4 O16 -","4","0.25","","Murai, K.; Yamashita, K.; Kitahara, G.; Tokuda, M.; Yoshiasa, A.","Synthesis, single crystal structure analyses and ultraviolet light emission of CaW1-xMoxO4 (x = 0.0-1.0) scheelite-powellite solid solutions","Journal of Mineralogical and Petrological Sciences","2023","","","1","10","10.2465/jmps.220901","","","","","","","","","","","","","","","","","","","","","has coordinates","289017","2024-01-10","03:02:28",""
"1570755","5.24","0.0001","5.24","0.0001","11.381","0.0003","90","","90","","90","","312.495","0.012","","","298","","","","100","","","","","4","I 41/a :2","-I 4ad","88","CaW0.78Mo0.22O4","","scheelite-powellite solid solution","- Ca Mo0.22 O4 W0.78 -","- Ca Mo0.221 O4 W0.779 -","- Ca4 Mo0.884 O16 W3.116 -","4","0.25","","Murai, K.; Yamashita, K.; Kitahara, G.; Tokuda, M.; Yoshiasa, A.","Synthesis, single crystal structure analyses and ultraviolet light emission of CaW1-xMoxO4 (x = 0.0-1.0) scheelite-powellite solid solutions","Journal of Mineralogical and Petrological Sciences","2023","","","1","10","10.2465/jmps.220901","","","","","","","","","","","","","","","","","","","","","has coordinates","289018","2024-01-10","03:03:21",""
"1570756","5.2368","0.0001","5.2368","0.0001","11.3972","0.0004","90","","90","","90","","312.558","0.014","","","298","","","","100","","","","","4","I 41/a :2","-I 4ad","88","CaW0.66Mo0.34O4","","scheelite-powellite solid solution","- Ca Mo0.34 O4 W0.66 -","- Ca Mo0.34 O4 W0.66 -","- Ca4 Mo1.36 O16 W2.64 -","4","0.25","","Murai, K.; Yamashita, K.; Kitahara, G.; Tokuda, M.; Yoshiasa, A.","Synthesis, single crystal structure analyses and ultraviolet light emission of CaW1-xMoxO4 (x = 0.0-1.0) scheelite-powellite solid solutions","Journal of Mineralogical and Petrological Sciences","2023","","","1","10","10.2465/jmps.220901","","","","","","","","","","","","","","","","","","","","","has coordinates","289019","2024-01-10","03:04:01",""
"1570757","5.2338","0.0001","5.2338","0.0001","11.4011","0.0002","90","","90","","90","","312.306","0.01","","","298","","","","100","","","","","4","I 41/a :2","-I 4ad","88","CaW0.51Mo0.49O4","","scheelite-powellite solid solution","- Ca Mo0.49 O4 W0.51 -","- Ca Mo0.487 O4 W0.513 -","- Ca4 Mo1.948 O16 W2.052 -","4","0.25","","Murai, K.; Yamashita, K.; Kitahara, G.; Tokuda, M.; Yoshiasa, A.","Synthesis, single crystal structure analyses and ultraviolet light emission of CaW1-xMoxO4 (x = 0.0-1.0) scheelite-powellite solid solutions","Journal of Mineralogical and Petrological Sciences","2023","","","1","10","10.2465/jmps.220901","","","","","","","","","","","","","","","","","","","","","has coordinates","289020","2024-01-10","03:04:42",""
"1570758","5.227","0.0001","5.227","0.0001","11.4095","0.0003","90","","90","","90","","311.725","0.012","","","298","","","","100","","","","","4","I 41/a :2","-I 4ad","88","CaW0.21Mo0.79O4","","scheelite-powellite solid solution","- Ca Mo0.79 O4 W0.21 -","- Ca Mo0.785 O4 W0.215 -","- Ca4 Mo3.14 O16 W0.86 -","4","0.25","","Murai, K.; Yamashita, K.; Kitahara, G.; Tokuda, M.; Yoshiasa, A.","Synthesis, single crystal structure analyses and ultraviolet light emission of CaW1-xMoxO4 (x = 0.0-1.0) scheelite-powellite solid solutions","Journal of Mineralogical and Petrological Sciences","2023","","","1","10","10.2465/jmps.220901","","","","","","","","","","","","","","","","","","","","","has coordinates","289021","2024-01-10","03:05:20",""
"1570817","17.6111","0.0004","17.6111","0.0004","26.4443","0.0006","90","","90","","90","","8201.7","0.3","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C12 H36 Ga3 Ho -","- C12 H36 Ga3 Ho -","- C192 H576 Ga48 Ho16 -","16","1","","Rieser, Theresa E.; Schädle, Dorothea; Maichle-Mössmer, Cäcilia; Anwander, Reiner","Terminal dysprosium and holmium organoimides.","Chemical science","2024","15","10","3562","3570","10.1039/d3sc06584g","","","0.71073","MoKα","","0.0434","0.0404","","","0.0773","0.0782","","","","","","1.395","","","","has coordinates","290838","2024-04-04","22:45:42",""
"1571146","11.8607","0.0003","11.8607","0.0003","39.8339","0.0019","90","","90","","90","","5603.7","0.3","130","","130","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C48 H40 F20 Mn O4 P2 Te4 -","- C48 H40 F20 Mn O4 P2 Te4 -","- C192 H160 F80 Mn4 O16 P8 Te16 -","4","0.25","","Pérez-Bitrián, Alberto; Munárriz, Julen; Krause, Konstantin B.; Schlögl, Johanna; Hoffmann, Kurt F.; Sturm, Johanna S.; Hadi, Amiera N.; Teutloff, Christian; Wiesner, Anja; Limberg, Christian; Riedel, Sebastian","Questing for homoleptic mononuclear manganese complexes with monodentate O-donor ligands.","Chemical science","2024","15","15","5564","5572","10.1039/d4sc00543k","","","0.71073","MoKα","","0.0393","0.0299","","","0.0644","0.0712","","","","","","1.133","","","","has coordinates","291585","2024-05-05","01:59:47",""
"1571167","5.3048","0.0003","5.3048","0.0003","11.4999","0.0009","90","","90","","90","","323.62","0.04","293","2","293","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","Neodymium(III) <i>ortho</i>-oxidotungstate(VI)","","- Nd0.67 O4 W -","- Nd0.6667 O4 W -","- Nd2.6668 O16 W4 -","4","0.25","WM4207","Knies, Benjamin; Hartenbach, Ingo","Crystal structure of defect scheelite-type Nd2/3[WO4]","IUCrData","2024","9","3","","","10.1107/S2414314624001755","","","0.71073","MoKα","","0.0331","0.0224","","","0.0476","0.0499","","","","","","1.008","","","","has coordinates","290377","2024-03-07","03:10:09",""
"1571596","20.7","0.3","20.7","0.3","8.8","0.2","90","","90","","90","","3771","12","298","1","298","1","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C41 H30 N4 O -","- C41 H28 N4 -","- C164 H112 N16 -","4","0.25","VQ5005","Bourda, Laurens; Bhandary, Subhrajyoti; Ito, Sho; Göb, Christian R; Van Der Voort, Pascal; Van Hecke, Kristof","Analysis of COF-300 synthesis: probing degradation processes and 3D electron diffraction structure.","IUCrJ","2024","11","4","","","10.1107/S2052252524003713","","electron","0.0251","transmissionelectronmicroscope","","0.1808","0.1372","","","0.3425","0.3793","","","","","","1.316","","","","has coordinates","291819","2024-05-11","01:57:53",""
"2000038","16.004","0.002","16.004","0.002","14.988","0.003","90","","90","","90","","3838.85","","","","173.15","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H20 B F24 Li O4 -","- C128 H80 B F108 Li O16 -","- C512 H320 B4 F432 Li4 O64 -","4","0.25","","Golden, Josh H.; Mutolo, Paul F.; Lobkovsky, Emil B.; DiSalvo, Francis J.","Lithium-Mediated Organofluorine Hydrogen Bonding: Structure of Lithium Tetrakis(3,5-bis(trifluoromethyl)phenyl)borate Tetrahydrate","Inorganic Chemistry","1994","33","24","5374","5375","10.1021/ic00102a004","","","","","","","0.0556","","","0.0556","","","","","","","","","","","has coordinates","199666","2020-10-21","18:00:00",""
"2000414","17.121","0.001","17.121","0.001","13.241","0.001","90","","90","","90","","3881.3","0.4","293","","293","","","","","","","","","3","I 41/a :2","-I 4ad","88","tetra(2-pyridyl)pyrazine","2,3,4,6-tetra(2-pyridyl)pyrazine","","- C24 H16 N6 -","- C24 H16 N6 -","- C192 H128 N48 -","8","0.5","AL1025","Greaves, B.; Stoeckli-Evans, H.","A tetragonal form of tetra(2-pyridyl)pyrazine (TPPZ)","Acta Crystallographica Section C","1992","48","12","2269","2271","10.1107/S0108270192009387","","","0.71073","MolybdenumKα","","0.053","0.053","","0.072","0.072","","","","","1.07","1.07","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001129","5.164","0.001","5.164","0.001","10.741","0.002","90","","90","","90","","286.43","0.09","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- F4 Li Y -","- F4 Li Y -","- F16 Li4 Y4 -","4","0.25","HH0619","Garcia, E.; Ryan, R. R.","Structure of the laser host material LiYF~4~","Acta Crystallographica Section C","1993","49","12","2053","2054","10.1107/S0108270193005876","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","203896","2020-10-21","18:00:00",""
"2003449","19.942","0.003","19.942","0.003","10.294","0.002","90","","90","","90","","4093.8","1.2","293","2","293","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","(1R*, 2R*, 3R*, 4R*, 7R*)-2,4,7-trimethylcyclohept-5-ene-1,3-diol","","- C10 H18 O2 -","- C10 H18 O2 -","- C160 H288 O32 -","16","1","FG1032","Colucci, J.; Gajda, C.; Lautens, M.; Lough, A. J.","Product of an <i>S</i>~<i>N~</i>2' Ring-Opening Reaction, (1<i>R</i>*,2<i>R</i>*,3<i>R</i>*,4<i>R</i>*,7<i>R</i>*)-2,4,7-Trimethylcyclohept-5-ene-1,3-diol","Acta Crystallographica Section C","1995","51","5","912","914","10.1107/S0108270194011194","","","0.71073","MoKα","","0.1651","0.04","","0.1092","0.0785","","","","1.012","1.158","1.158","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004026","15.967","0.001","15.967","0.001","15.348","0.004","90","","90","","90","","3912.9","1.1","296","","296","","","","","","","","","7","I 41/a :2","-I 4ad","88","","poly[bis-{μ~2~-(bromo)-copper(I)}-bis-μ~3~-(N,N-diethyldithiocarbamato- S,S,S',S')platinum(II)]","","- C10 H20 Br2 Cu2 N2 Pt S4 -","- C10 Br2 Cu2 N2 Pt0.5 S4 -","- C80 Br16 Cu16 N16 Pt4 S32 -","8","0.5","MU1152","Tokoro, K.; Ebihara, M.; Kawamura, T.","(Cu<i>X</i>)~<i>n~</i> Helical Chains in [Pt(S~2~CNEt~2~)~2~Cu~2~<i>X</i>~2~] (<i>X</i> = Br, Cl)","Acta Crystallographica Section C","1995","51","10","2010","2013","10.1107/S0108270195001855","","","0.7107","MolybdenumKα","","","0.045","","","0.041","","","","","1.56","1.56","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004027","15.835","0.002","15.835","0.002","15.037","0.003","90","","90","","90","","3770.5","1","296","","296","","","","","","","","","7","I 41/a :2","-I 4ad","88","","poly[bis-{μ~2~-(chloro)-copper(I)}-bis-μ~3~-(N,N-diethyldithiocarbamato- S,S,S',S')-platinum(II)]","","- C10 H20 Cl2 Cu2 N2 Pt S4 -","- C10 Cl2 Cu2 N2 Pt0.5 S4 -","- C80 Cl16 Cu16 N16 Pt4 S32 -","8","0.5","MU1152","Tokoro, K.; Ebihara, M.; Kawamura, T.","(Cu<i>X</i>)~<i>n~</i> Helical Chains in [Pt(S~2~CNEt~2~)~2~Cu~2~<i>X</i>~2~] (<i>X</i> = Br, Cl)","Acta Crystallographica Section C","1995","51","10","2010","2013","10.1107/S0108270195001855","","","0.7107","MolybdenumKα","","","0.038","","","0.037","","","","","1.73","1.73","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004178","21.184","0.005","21.184","0.005","15.412","0.004","90","","90","","90","","6916","3","291","2","293","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C16 H12 Cl N O3 -","- C16 H12 Cl N O3 -","- C256 H192 Cl16 N16 O48 -","16","1","PA1184","Palmer, R. A.; Richards, A. J.; Lisgarten, J. N.","2-Benzamido-3-(<i>p</i>-chlorophenyl)propenoic Acid (Antrex)","Acta Crystallographica Section C","1995","51","11","2338","2340","10.1107/S010827019500672X","","","1.54178","CuKα","","0.1133","0.0695","","0.3261","0.1838","","","","1.07","1.128","1.128","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004520","13.818","0.001","13.818","0.001","27.285","0.003","90","","90","","90","","5209.7","0.8","295","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C57 H38 Cl2 O12 Pb -","- C57 H36 Cl2 O12 Pb -","- C228 H144 Cl8 O48 Pb4 -","4","0.25","MU1180","Prout, K.; Vaughan-Lee, D.; Moloney, M. G.; Prottey, S. C.","Tetrakis(<i>o</i>-benzoylbenzoato-<i>O</i>,<i>O</i>')lead(IV) Dichloromethane Solvate","Acta Crystallographica Section C","1996","52","2","351","354","10.1107/S0108270195007785","","","0.71073","MoKα","","","0.0447","","","0.0464","","","","","1.21","1.21","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005038","19.649","0.003","19.649","0.003","10.704","0.002","90","","90","","90","","4132.6","1.2","111","2","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","Tetrakis[(μu3-5-methylthiophene-C2)-(diethylether-O)-lithium","","- C36 H60 Li4 O4 S4 -","- C36 H60 Li4 O4 S4 -","- C144 H240 Li16 O16 S16 -","4","0.25","NA1208","Powell, D. R.; Whipple, W. L.; Reich, H. J.","Tetrakis(μ~3~-2-methyl-5-thienyl)tetrakis(diethyl ether-<i>O</i>)-<i>tetrahedro</i>-tetralithium","Acta Crystallographica Section C","1996","52","6","1346","1348","10.1107/S0108270196000546","","","1.54184","CuKα","","","0.0727","","0.1918","0.1701","","","","1.097","1.243","1.243","","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2005218","32.41","0.01","32.41","0.01","6.056","0.003","90","","90","","90","","6361","4","298","","","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C14 H17.5 Cl N4 O1.25 S -","- C14 H17.5 Cl N4 O1.25 S -","- C224 H280 Cl16 N64 O20 S16 -","16","1","BM1047","Kovala-Demertzi, D.; Varagi, V.; Demertzis, M. A.; Raptopoulou, C. P.; Terzis, A.","2-Acetylpyridinium 4<i>N</i>-Phenylthiosemicarbazone Chloride 1.25-Hydrate","Acta Crystallographica Section C","1996","52","8","2027","2029","10.1107/S010827019600176X","","","0.7107","MoKα","","","0.0351","","","0.035","","","","","2.35","2.35","","","","","has coordinates","190703","2020-10-21","18:00:00",""
"2005777","13.885","0.001","13.885","0.001","26.207","0.003","90","","90","","90","","5052.5","0.8","295","","295","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C12 H30 Cd I4 S2 -","- C12 Cd I4 S2 -","- C96 Cd8 I32 S16 -","8","0.5","JZ1124","Bengtsson-Kloo, L.; Berglund, J.; Stegemann, H.; Svensson, C.; Svensson, P. H.","Bis(triethylsulfonium) Tetraiodocadmate(II)","Acta Crystallographica Section C","1996","52","12","3045","3047","10.1107/S0108270196006956","","","0.7107","MoKα","","","0.0486","","","0.0525","","","","","1.702","1.702","","","","","has coordinates","191977","2020-10-21","18:00:00",""
"2006016","20.7727","0.0002","20.7727","0.0002","36.6751","0.0001","90","","90","","90","","15825.5","0.2","150","","150","","","","","","","","","3","I 41/a :2","-I 4ad","88","","[Bis-(2-Hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)]-phenyl-methane","","- C23 H28 O4 -","- C23 H28 O4 -","- C736 H896 O128 -","32","2","SK1062","Bolte, M.; Degen, A.; Rühl, S.","Twinned Crystal Structure of Bis(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)phenylmethane at 150K","Acta Crystallographica Section C","1997","53","3","340","342","10.1107/S0108270196013078","","","0.71073","MoKα","","0.0441","0.0392","","0.0855","0.0825","","","","1.18","1.178","1.178","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006229","28.663","0.0007","28.663","0.0007","7.25719","0.0001","90","","90","","90","","5962.3","0.2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","(4-Ethylpyridine)(N-salicylideneglycinato)copper(II) Tetramer","","- C64 H64 Cu4 N8 O12 -","- C64 H64 Cu4 N8 O12 -","- C256 H256 Cu16 N32 O48 -","4","0.25","JZ1191","Warda, Salam A.","A (4-Ethylpyridine)(<i>N</i>-salicylideneglycinato)copper(II) Tetramer","Acta Crystallographica Section C","1997","53","6","697","699","10.1107/S0108270197002692","","","1.54178","CuKα","","0.0475","0.0435","","0.1254","0.1225","","","","1.124","1.153","1.153","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007135","13.727","0.001","13.727","0.001","8.13","0.001","90","","90","","90","","1531.9","0.2","150","2","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","2,3-diiodo-2-buten-1,4-diol","","- C4 H6 I2 O2 -","- C4 H6 I2 O2 -","- C32 H48 I16 O16 -","8","0.5","AB1505","Løiten, Marianne Sveaas; Bjørn Dalhus; Fjαertoft, Berit; Klaveness, Jo","<i>trans</i>-2,3-Diiodo-2-butene-1,4-diol","Acta Crystallographica Section C","1998","54","4","555","557","10.1107/S0108270197014406","","","0.71073","MoKα","","0.0315","0.0271","","0.0531","0.0522","","","","2.239","2.299","2.299","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007842","12.243","0.002","12.243","0.002","32.923","0.004","90","","90","","90","","4934.9","1.3","293","","293","","","","","","","","","5","I 41/a :2","-I 4ad","88","","octa(μ-methoxo)octa(μ-oxo)octaoxotetrapyridineoctamolybdenum(V)","","- C28 H44 Mo8 N4 O24 -","- C28 H44 Mo8 N4 O24 -","- C112 H176 Mo32 N16 O96 -","4","0.25","NA1365","Modec, Barbara; Brenčič, Jurij V.; Rotar, Rok; Golič, Ljubo; Prout, Keith","An Oxomolybdenum(V) Cluster, [Mo~8~O~16~(OCH~3~)~8~(C~5~H~5~N)~4~]","Acta Crystallographica Section C","1998","54","11","1573","1575","10.1107/S0108270198006106","","","0.71069","MoKα","","","0.027","","","","0.028","","","","","","0.976","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008006","13.903","0.001","13.903","0.001","25.963","0.003","90","","90","","90","","5018.5","0.8","295","","295","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C12 H30 Hg I4 S2 -","- C12 Hg I4 S2 -","- C96 Hg8 I32 S16 -","8","0.5","OS1033","Bengtsson-Kloo, L.; Berglund, J.; Stegemann, H.; Svensson, C.; Svensson, Per H.","Bis(triethylsulfonium) Tetraiodomercurate(II)","Acta Crystallographica Section C","1998","54","12","1851","1853","10.1107/S0108270198008889","","","0.7107","MoKα","","","0.037","","","0.048","","","","","1.633","1.633","","","","","has coordinates","191977","2020-10-21","18:00:00",""
"2008408","8.6226","0.0016","8.6226","0.0016","21.73","0.005","90","","90","","90","","1615.6","0.6","125","2","125","2","","","","","","","","2","I 41/a :2","-I 4ad","88","","perfluoro-benzocyclobutene","","- C8 F8 -","- C8 F8 -","- C64 F64 -","8","0.5","QA0106","Boese, Roland; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja","2,3,4,5,7,7,8,8,-Octafluorobicyclo[4.2.0]octa-1,3,5-triene at 125K","Acta Crystallographica Section C","1999","55","4","IUC9900036","","10.1107/S0108270199099606","","","0.71073","MoKα","","0.074","0.063","","","","0.2","","","","","","1.075","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008618","5.993","0.004","5.993","0.004","12.574","0.008","90","","90","","90","","451.6","0.5","150","2","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","ammonium periodate","Ammonium tetraoxoiodate(VII)","","- H4 I N O4 -","- H4 I N O4 -","- H16 I4 N4 O16 -","4","0.25","QA0117","Levason, William; Webster, Michael","Ammonium tetraoxoiodate(VII)","Acta Crystallographica Section C","1999","55","6","IUC9900052","","10.1107/S0108270199099394","","","0.71073","MoKα","","0.022","0.018","","","","0.049","","","","","","1.091","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008747","10.33","0.001","10.33","0.001","20.222","0.004","90","","90","","90","","2157.9","0.5","203","","203","","","","","","","","","5","I 41/a :2","-I 4ad","88","","tetrachlorotetra(2-propanol)uranium(IV)","","- C12 H32 Cl4 O4 U -","- C12 H32 Cl4 O4 U -","- C48 H128 Cl16 O16 U4 -","4","0.25","BK1458","Gordon, Pamela L.; Thompson, Julia A.; Watkin, John G.; Burns, Carol J.; Sauer, Nancy N.; Scott, Brian L.","Tetrachlorotetrakis(propan-2-ol)uranium(IV) and tetrachlorotetrakis(propan-2-ol)thorium(IV)","Acta Crystallographica Section C","1999","55","8","1275","1278","10.1107/S0108270199004898","","","0.71073","MoKα","","0.027","0.021","","","","0.051","","","","","","1.07","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008748","10.447","0.001","10.447","0.001","20.395","0.001","90","","90","","90","","2225.9","0.3","203","","203","","","","","","","","","5","I 41/a :2","-I 4ad","88","","tetrachlorotetra(2-proponol)thorium(IV)","","- C12 H32 Cl4 O4 Th -","- C12 H32 Cl4 O4 Th -","- C48 H128 Cl16 O16 Th4 -","4","0.25","BK1458","Gordon, Pamela L.; Thompson, Julia A.; Watkin, John G.; Burns, Carol J.; Sauer, Nancy N.; Scott, Brian L.","Tetrachlorotetrakis(propan-2-ol)uranium(IV) and tetrachlorotetrakis(propan-2-ol)thorium(IV)","Acta Crystallographica Section C","1999","55","8","1275","1278","10.1107/S0108270199004898","","","0.71073","MoKα","","0.03","0.021","","","","0.045","","","","","","1.18","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008824","5.3724","0.0004","5.3724","0.0004","11.7932","0.0016","90","","90","","90","","340.38","0.06","297","1","297","1","","","","","","","","3","I 41/a :2","-I 4ad","88","none","Silver Perrhenate","","- Ag O4 Re -","- Ag O4 Re -","- Ag4 O16 Re4 -","4","0.25","QA0115","Dmitry Yu. Naumov; Alexander V. Virovets; Sergey V. Korenev; Alexander I. Gubanov","Silver perrhenate, AgReO~4~","Acta Crystallographica Section C","1999","55","8","IUC9900097","","10.1107/S0108270199099138","","","0.71073","MoKα","","0.025","0.022","","","","0.049","","","","","","1.133","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009388","21.381","0.003","21.381","0.003","21.487","0.003","90","","90","","90","","9823","2","298","","298","","","","","","","","","4","I 41/a :2","-I 4ad","88","","(2,2',6,6'-Tetramethyl) Piperidine Thiocyanate","","- C20 H40 N4 S2 -","- C20 H40 N4 S2 -","- C320 H640 N64 S32 -","16","1","HH1074","Harrison, William T. A.; Stucky, Galen D.; Gier, Thurman E.","2,2,6,6-Tetramethylpiperidinium thiocyanate, 2C~9~H~20~N^+^.2SCN^{-^}","Acta Crystallographica Section C","1994","50","1","93","95","10.1107/S0108270193006183","","","0.71073","MoKα","","","0.054","","","0.051","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009432","27.746","0.002","27.746","0.002","11.817","0.003","90","","90","","90","","9097","2","296","","296","","","","","","","","","3","I 41/a :2","-I 4ad","88","sc*(9S*)-8-bromo-1,4-dimethyl-9-(2-methylbenzyl)triptycene","sc*(9S*)-8-bromo-1,4-dimethyl-9-(2-methylbenzyl)-9,10-dihydro-9,10[1',2']- benzenoanthracene","","- C30 H25 Br -","- C30 H25 Br -","- C480 H400 Br16 -","16","1","AS1064","Nemoto, Takashi; Ono, Taizo; Uchida, Akira; Ohashi, Yuji; Yamamoto, Gaku","Structures of <i>ap</i>-8-bromo-1,4-dimethyl-9-(2-methylbenzyl)triptycene and <i>sc</i>*(9<i>S</i>*)-8-bromo-1,4-dimethyl-9-(2-methylbenzyl)triptycene","Acta Crystallographica Section C","1994","50","2","297","300","10.1107/S0108270193008467","","","0.71069","MoKα","","","0.083","","","0.063","","","","","1.68","1.68","","","","","has coordinates","190526","2020-10-21","18:00:00",""
"2009800","18.672","0.001","18.672","0.001","40.104","0.007","90","","90","","90","","13982","3","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","hexacarbonyl-1κ^4^C,2κ^2^C-η^5^-cyclopentadienyl-2κC-bis-μ- diphenylphosphanido-1κ^2^P:2κ^2^P-manganesetungsten","","- C35 H25 Mn O6 P2 W -","- C35 H25 Mn O6 P2 W -","- C560 H400 Mn16 O96 P32 W16 -","16","1","NA1073","Flörke, Ulrich; Haupt, Hans-Jürgen","Hexacarbonylcyclopentadienyl-bis-μ-diphenylphosphanido-manganesetungsten, [MnW(C~12~H~10~P)~2~(C~5~H~5~)(CO)~6~]","Acta Crystallographica Section C","1994","50","6","874","876","10.1107/S0108270193013526","","","0.71073","MoKα","","0.1759","0.0684","","0.1939","0.1447","","","","1.066","1.176","1.176","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009961","23.074","0.0019","23.074","0.0019","6.9535","0.0009","90","","90","","90","","3702.1","0.6","293","","293","","","","","","","","","4","I 41/a :2","-I 4ad","88","","6-amino-1,3-dimethyl-5-hydroxoiminomethyluracil","","- C7 H10 N4 O3 -","- C7 H10 N4 O3 -","- C112 H160 N64 O48 -","16","1","HA1109","Low, John N.; Ferguson, George; Moreno-Carretero, Miguel N.; Hueso-Ureña, Francisco","6-Amino-5-hydroxyiminomethyl-1,3-dimethyluracil","Acta Crystallographica Section C","1994","50","8","1328","1329","10.1107/S0108270194003793","","","0.7093","MoKα","","0.094","0.042","","0.064","0.056","","","","","1.56","1.56","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010086","13.2207","0.0003","13.2207","0.0003","13.9464","0.0003","90","","90","","90","","2437.65","0.09","293","","293","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Fe K O6 Si2 -","- Fe K O6 Si2 -","- Fe16 K16 O96 Si32 -","16","1","BR1077","Bell, A.M.T.; Henderson, C.M.B.","Rietveld refinement of the structures of dry-synthesized <i>M</i>Fe^III^Si~2~O~6~ leucites (<i>M</i> = K, Rb, Cs) by synchrotron X-ray powder diffraction","Acta Crystallographica Section C","1994","50","10","1531","1536","10.1107/S0108270194004014","","","1.80067","synchrotron","","","0.045","","","0.154","","","","","1.645","1.645","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010087","13.4586","0.0001","13.4586","0.0001","13.938","0.0001","90","","90","","90","","2524.64","0.03","293","","293","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Fe O6 Rb Si2 -","- Fe O6 Rb Si2 -","- Fe16 O96 Rb16 Si32 -","16","1","BR1077","Bell, A.M.T.; Henderson, C.M.B.","Rietveld refinement of the structures of dry-synthesized <i>M</i>Fe^III^Si~2~O~6~ leucites (<i>M</i> = K, Rb, Cs) by synchrotron X-ray powder diffraction","Acta Crystallographica Section C","1994","50","10","1531","1536","10.1107/S0108270194004014","","","1.80067","synchrotron","","","0.089","","","0.174","","","","","2.898","2.898","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010537","15.856","0.002","15.856","0.002","29.753","0.005","90","","90","","90","","7480.3","1.8","200","2","200","2","","","","","","","","6","I 41/a :2","-I 4ad","88","Oxovanadiumacetate","tetraphenylphosphonium μ~4~-nitrato-κ^4^O-cyclo- tetrakis(μ-acetato-κO:κO')tetra-μ-oxo-tetrakis[oxovanadium(V)]","","- C32 H32 N O19 P V4 -","- C32 H32 N O19 P V4 -","- C256 H256 N8 O152 P8 V32 -","8","0.5","JZ1345","Wulff-Molder, Dirk; Meisel, Manfred","The cyclic vanadylacetate (C~24~H~20~P)[V~4~O~8~(C~2~H~3~O~2~)~4~(NO~3~)]","Acta Crystallographica Section C","2000","56","1","33","34","10.1107/S0108270199012214","","","0.71073","MoKα","","0.064","0.042","","0.112","0.1","","","","1.015","1.126","1.126","","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011118","25.1353","0.0012","25.1353","0.0012","6.2139","0.0004","90","","90","","90","","3925.8","0.4","180","2","180","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","2,2-Dimethyl-3,4-dihydro-6-hydroxy-(2H)-benzo-(1,2-b)-pyran","","- C11 H14 O2 -","- C11 H14 O2 -","- C176 H224 O32 -","16","1","FR1268","Jha, Amitabh; Malhotra, Sanjay; Parmar, Virinder S.; Errington, William","6-Hydroxy-2,2-dimethyl-3,4-dihydro-2<i>H</i>-benzo[<i>b</i>]pyran","Acta Crystallographica Section C","2000","56","7","899","900","10.1107/S0108270100005813","","","0.71073","MoKα","","0.082","0.047","","","","0.115","","","","","","1.024","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011391","22.5868","0.0004","22.5868","0.0004","8.302","0.0001","90","","90","","90","","4235.38","0.12","150","","150","","","","","","","","","3","I 41/a :2","-I 4ad","88","4-(hydroxymethyl)phenanthrene","4-phenanthrenemethanol","","- C15 H12 O -","- C15 H12 O -","- C240 H192 O16 -","16","1","BK1535","Gerkin, Roger E.","Hydrogen bonding and C—H···O interactions in 4-phenanthrenemethanol at 150K","Acta Crystallographica Section C","2000","56","10","1287","1288","10.1107/S0108270100008039","","","0.71073","MoKα","","","0.04","","","","0.102","","","","","","1.92","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2011557","17.4851","0.0007","17.4851","0.0006","16.2878","0.0009","90","","90","","90","","4979.6","0.4","150","2","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","2-Amino-6-chloro-4-(1-phenylethylamino)pyrimidine","","- C12 H13 Cl N4 -","- C12 H13 Cl N4 -","- C192 H208 Cl16 N64 -","16","1","QA0429","Lynch, Daniel E.; McClenaghan, Ian","2-Amino-6-chloro-4-(1-phenylethylamino)pyrimidine","Acta Crystallographica Section C","2000","56","11","e534","e534","10.1107/S0108270100014177","","","0.71073","MoKα","","0.09","0.051","","","","0.134","","","","","","1.012","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2011884","9.9639","0.0006","9.9639","0.0006","9.3806","0.0009","90","","90","","90","","931.3","0.12","298","5","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","Gismondine","","","- Ga5.76 H6.8 K5.76 O35.36 Si10.24 -","- Ga5.76 K5.76 O35.36 Si10.24 -","- Ga5.76 K5.76 O35.36 Si10.24 -","1","0.0625","IZ1009","Tripathi, Akhilesh; Parise, John; Kim, Sun Jin; Lee, Yongjae; Uh, Young Sun","K~5.76~Ga~5.76~Si~10.24~O~32~·3.4H~2~O, a gallosilicate with the zeolite gismondine topology","Acta Crystallographica Section C","2001","57","4","344","346","10.1107/S0108270100021090","","","0.643","Synchrotron","","0.0844","0.0671","","","","0.1558","","","","","","1.131","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2012641","20.598","0.004","20.598","0.004","14.07","0.008","90","","90","","90","","5970","4","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Tetra-μ-acetato-κ^2^O:O'-bis[(4-phenylpyridine-κN)copper(II)]","","- C30 H30 Cu2 N2 O8 -","- C30 H30 Cu2 N2 O8 -","- C240 H240 Cu16 N16 O64 -","8","0.5","JZ1496","Tong, Ming-Liang; Li, Wei; Chen, Xiao-Ming; Zheng, Shao-Liang; Ng, Seik Weng","Tetra-μ-acetato-κ^2^<i>O</i>:<i>O</i>'-bis[(4-phenylpyridine-κ<i>N</i>)copper(II)]","Acta Crystallographica Section C","2002","58","4","m232","m234","10.1107/S0108270102002962","","","0.71073","MoKα","","0.1","0.053","","","0.121","0.14","","","","","","1.028","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2012899","14.7686","0.0003","14.7686","0.0003","13.1319","0.0003","90","","90","","90","","2864.22","0.11","160","1","160","1","","","","","","","","5","I 41/a :2","-I 4ad","88","","tetraphenylarsonium tetraiodothallate(III)","","- C24 H20 As I4 Tl -","- C24 H20 As I4 Tl -","- C96 H80 As4 I16 Tl4 -","4","0.25","SK1564","Linden, Anthony; James, Bruce D.","Tetraphenylarsonium tetraiodothallate(III)","Acta Crystallographica Section C","2002","58","8","m439","m440","10.1107/S0108270102010636","","","0.71073","MoKα","","0.0416","0.0307","","","0.073","0.0776","","","","","","1.064","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2013263","15.655","0.013","15.655","0.005","16.869","0.013","90","","90","","90","","4134","5","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","dipropyl 3,6-diphenyl-1,2-dihydro-s-tetrazine-1,2-dicarbonate","","- C22 H24 N4 O4 -","- C22 H24 N4 O4 -","- C176 H192 N32 O32 -","8","0.5","FR1397","Guo-Wu Rao; Wei-Xiao Hu","Dipropyl 3,6-diphenyl-1,2-dihydro-1,2,4,5-tetrazine-1,2-dicarboxylate","Acta Crystallographica Section C","2003","59","5","o281","o282","10.1107/S0108270103007212","","","0.71073","MoKα","","0.0592","0.0379","","","0.1","0.1114","","","","","","1.052","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2013356","5.3026","0.0012","5.3026","0.0012","11.81","0.005","90","","90","","90","","332.07","0.18","100","2","100","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Ag O4 Tc -","- Ag O4 Tc -","- Ag4 O16 Tc4 -","4","0.25","SK1620","Sarsfield, Mark J.; Sutton, Andrew D.; Livens, Francis R.; May, Iain; Taylor, Robin J.","Raman spectroscopy of silver pertechnetate","Acta Crystallographica Section C","2003","59","6","i45","i46","10.1107/S0108270103006486","","","0.71073","MoKα","","0.0398","0.0391","","","0.0922","0.0926","","","","","","1.454","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2013687","20.5823","0.0018","20.5823","0.0018","26.794","0.004","90","","90","","90","","11351","2","110","2","110","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C32 H41 N3 O -","- C32 H41 N3 O -","- C512 H656 N48 O16 -","16","1","SQ1020","Vladimir N. Nesterov; Tatiana V. Timofeeva; Sergey S. Sarkisov; Alexander Leyderman; Charles Y.-C. Lee; Mikhail Yu. Antipin","3,5-Bis[4-(diethylamino)benzylidene]-1-methyl-4-piperidone and 3,5-bis[4-(diethylamino)cinnamylidene]-1-methyl-4-piperidone: prospective biophotonic materials","Acta Crystallographica Section C","2003","59","11","o605","o608","10.1107/S0108270103020237","","","0.71073","MoKα","","0.1405","0.0676","","","0.1634","0.1909","","","","","","1.059","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2013819","12.7655","0.0005","12.7655","0.0005","24.1122","0.0011","90","","90","","90","","3929.3","0.3","100","2","100","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","5,5'-Di-tert-butyl-2,2'-dihydroxy-3,3'-methylenedibenzaldehyde","","- C23 H28 O4 -","- C23 H28 O4 -","- C184 H224 O32 -","8","0.5","NA1630","Masci, Bernardo; Levi Mortera, Stefano; Seralessandri, Luca; Thuéry, Pierre","5,5'-Di-<i>tert</i>-butyl-2,2'-dihydroxy-3,3'-methylenedibenzaldehyde and 6,6'-di-<i>tert</i>-butyl-8,8'-methylenebis(spiro[4<i>H</i>-1,3-benzodioxin-2,1'-cyclohexane])","Acta Crystallographica Section C","2004","60","2","o107","o109","10.1107/S0108270103027859","","","0.71073","MoKα","","0.0648","0.045","","","0.114","0.1297","","","","","","0.974","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2013916","5.37119","0.00008","5.37119","","11.58104","0.00018","90","","90","","90","","334.109","0.007","1073","","1073","","","","","","","","Synthetic","3","I 41/a :2","-I 4ad","88","cerium niobate","cerium niobium tetraoxide","Fergusonite-(Ce)","- Ce Nb O4 -","- Ce Nb O4 -","- Ce4 Nb4 O16 -","4","0.25","BC1031","Skinner, Stephen J.; Brooks, Ian J. E.; Munnings, Christopher N.","Tetragonal CeNbO~4~ at 1073K in air and <i>in vacuo</i>","Acta Crystallographica Section C","2004","60","4","i37","i39","10.1107/S0108270104003300","","neutron","","neutron","","","","","","","","","","1.81","","","","","","","has coordinates","282548","2023-04-10","20:38:56",""
"2013917","5.37692","0.00008","5.37692","0.00008","11.59514","0.00018","90","","90","","90","","335.23","0.009","1073","","1073","","","","","","","","Synthetic","3","I 41/a :2","-I 4ad","88","cerium niobate","cerium niobium tetraoxide","Fergusonite-(Ce)","- Ce Nb O4 -","- Ce Nb O3.972 -","- Ce4 Nb4 O15.888 -","4","0.25","BC1031","Skinner, Stephen J.; Brooks, Ian J. E.; Munnings, Christopher N.","Tetragonal CeNbO~4~ at 1073K in air and <i>in vacuo</i>","Acta Crystallographica Section C","2004","60","4","i37","i39","10.1107/S0108270104003300","","neutron","","neutron","","","","","","","","","","1.83","","","","","","","has coordinates","282548","2023-04-10","20:38:56",""
"2014002","19.2497","0.001","19.2497","0.001","6.9209","0.0004","90","","90","","90","","2564.5","0.2","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","2-bromoresorcinol","1-Bromo-2,6-dihydroxybenzene","","- C6 H5 Br O2 -","- C6 H5 Br O2 -","- C96 H80 Br16 O32 -","16","1","GD1314","Kirsop, Peter; Storey, John M. D.; Harrison, William T. A.","1-Bromo-2,6-dihydroxybenzene containing <i>R</i>~4~^4^(8) rings and <i>C</i>(2) helices","Acta Crystallographica Section C","2004","60","5","o353","o355","10.1107/S0108270104006882","","","0.71073","MoKα","","0.0413","0.026","","","0.0615","0.0644","","","","","","0.967","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2014195","16.069","0.002","16.069","0.002","11.836","0.004","90","","90","","90","","3056.2","1.2","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Hexa-μ~2~-chloro-μ~4~-oxo-tetrakis[(2-ethyltetrazole-kN^4^)copper(II)]","","- C12 H24 Cl6 Cu4 N16 O -","- C12 H24 Cl6 Cu4 N16 O -","- C48 H96 Cl24 Cu16 N64 O4 -","4","0.25","JZ1637","Lyakhov, Alexander S.; Gaponik, Pavel N.; Degtyarik, Michail M.; Ivashkevich, Ludmila S.","Hexa-μ~2~-chloro-μ~4~-oxo-tetrakis[(2-ethyltetrazole-κ<i>N</i>^4^)copper(II)]","Acta Crystallographica Section C","2004","60","8","m399","m401","10.1107/S0108270104014921","","","0.71073","MoKα","","0.0403","0.0337","","","0.0879","0.0925","","","","","","1.053","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2014217","16.392","0.003","16.392","0.003","22.784","0.006","90","","90","","90","","6122","2","296.2","","","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C12 H40 Br4 Ir2 N6 O2 S6 -","- C12 H40 Br4 Ir2 N6 O2 S6 -","- C96 H320 Br32 Ir16 N48 O16 S48 -","8","0.5","OB1185","Mitsuharu Fujita; Yoshitaro Miyashita; Nagina Amir; Yasunori Yamada; Kiyoshi Fujisawa; Ken-ichi Okamoto","Bis(μ-cystamine-κ^4^<i>N</i>,<i>S</i>:<i>S</i>',<i>N</i>')bis[(2-aminoethanethiolato-κ^2^<i>N</i>,<i>S</i>)iridium(III)] tetrabromide dihydrate","Acta Crystallographica Section C","2004","60","9","m435","m436","10.1107/S0108270104016816","","","0.7107","MoKα","","","0.0465","","","","0.117","","","","","","1.012","","","","has coordinates,has Fobs","199684","2020-10-21","18:00:00",""
"2014438","12.793","0.0007","12.793","0.0007","24.158","0.002","90","","90","","90","","3953.7","0.4","150","2","150","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","5,5'-di-tert-butyl-2,2'-dihydroxy-3,3'-methanediyldibenzaldehyde","","- C23 H28 O4 -","- C23 H28 O4 -","- C184 H224 O32 -","8","0.5","BM1580","Goetz, Sandrine; Barreira Fontecha, Julia; McKee, Vickie","5,5'-Di-<i>tert</i>-butyl-2,2'-dihydroxy-3,3'-methanediyldibenzaldehyde and its allyl-protected dialcohol and dialdehyde precursors","Acta Crystallographica Section C","2004","60","11","o776","o780","10.1107/S010827010402089X","","","0.71073","MoKα","","0.0718","0.0433","","","0.0993","0.1203","","","","","","1.042","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2015065","31.4722","0.0012","31.4722","0.0012","3.656","0.0001","90","","90","","90","","3621.3","0.2","120","2","120","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Glyoxal 4-nitrophenylhydrazone","","- C8 H7 N3 O3 -","- C8 H7 N3 O3 -","- C128 H112 N48 O48 -","16","1","SK1857","Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Wardell, James L.","Glyoxal 4-nitrophenylhydrazone: triple helices linked into a three-dimensional channel structure","Acta Crystallographica Section C","2005","61","8","o493","o495","10.1107/S0108270105020834","","","0.71073","MoKα","","0.0484","0.0368","","","0.0933","0.0975","","","","","","1.062","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015516","12.9","0.005","12.9","0.005","30.33","0.003","90","","90","","90","","5047","3","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","tetrakis(μ-3,5-dinitrobenzoato-κ^2^O:O')bis[(caffeine-κO)copper(II)]","tetrakis(μ-3,5-dinitrobenzoato-κ^2^O:O')bis[(3,7-dihydro-1,3,7- trimethyl-1H-purine-2,6-dione-κO)copper(II)]}","","- C44 H32 Cu2 N16 O28 -","- C44 H32 Cu2 N16 O28 -","- C176 H128 Cu8 N64 O112 -","4","0.25","SF3010","Stachová, Petra; Moncol, Jan; Valigura, Dušan; Lis, Tadeusz","Unusual <i>O</i>-coordination of caffeine in tetrakis(μ-3,5-dinitrobenzoato-κ^2^<i>O</i>:<i>O</i>')bis[(caffeine-κ<i>O</i>)copper(II)]","Acta Crystallographica Section C","2006","62","8","m375","m377","10.1107/S0108270106025467","","","0.71069","MoKα","","0.1408","0.0536","","","0.069","0.0783","","","","","","1.008","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015650","16.4033","0.0011","16.4033","0.0011","15.7192","0.0012","90","","90","","90","","4229.5","0.5","296","","296","","","","","","","","","3","I 41/a :2","-I 4ad","88","","4-amino-3-methyl-5-(p-tolyl)-4H-1,2,4-triazole","","- C10 H12 N4 -","- C10 H12 N4 -","- C160 H192 N64 -","16","1","MY3010","Şahin, Onur; Büyükgüngör, Orhan; Şaşmaz, Selami; Gümrükçüoǧlu, Nurhan; Kantar, Cihan","N—H···N and C—H···π interactions in 4-amino-3-methyl-5-(<i>p</i>-tolyl)-4<i>H</i>-1,2,4-triazole and 4-amino-3-methyl-5-phenyl-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section C","2006","62","11","o643","o646","10.1107/S0108270106037668","","","0.71073","MoKα","","0.0608","0.0407","","","0.1056","0.1149","","","","","","1.012","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016973","18.331","0.0008","18.331","0.0008","15.5123","0.0014","90","","90","","90","","5212.5","0.6","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","(<i>SP</i>-4-4)-[<i>rac</i>-2-(1-aminoethyl)phenyl- κ^2^<i>C</i>^1^,<i>N</i>]chlorido(pyridine-κ<i>N</i>)palladium(II)","","- C13 H15 Cl N2 Pd -","- C13 H15 Cl N2 Pd -","- C208 H240 Cl16 N32 Pd16 -","16","1","LG3003","Calmuschi-Cula, Beatrice; Kalf, Irmgard; Timofte, Claudia; Englert, Ulli","Robust packing in cyclopalladated primary amines: isomorphous crystal structures of four complexes with varying substitution patterns","Acta Crystallographica Section C","2009","65","2","m48","m51","10.1107/S0108270108043631","","","0.71073","MoKα","","0.0504","0.0376","","","0.0695","0.0728","","","","","","1.107","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016974","18.5197","0.0009","18.5197","0.0009","15.7281","0.0016","90","","90","","90","","5394.4","0.7","110","2","110","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","(<i>SP</i>-4-4)-[<i>rac</i>-2-(1-aminoethyl)phenyl- κ^2^<i>C</i>^1^,<i>N</i>]bromido(pyridine-κ<i>N</i>)palladium(II)","","- C13 H15 Br N2 Pd -","- C13 H15 Br N2 Pd -","- C208 H240 Br16 N32 Pd16 -","16","1","LG3003","Calmuschi-Cula, Beatrice; Kalf, Irmgard; Timofte, Claudia; Englert, Ulli","Robust packing in cyclopalladated primary amines: isomorphous crystal structures of four complexes with varying substitution patterns","Acta Crystallographica Section C","2009","65","2","m48","m51","10.1107/S0108270108043631","","","0.71073","MoKα","","0.108","0.0695","","","0.1292","0.1411","","","","","","1.114","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016975","18.5329","0.0013","18.5329","0.0013","18.071","0.003","90","","90","","90","","6206.8","1.2","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","(<i>SP</i>-4-4)-[<i>rac</i>-2-(1-aminoethyl)-5-bromophenyl- κ^2^<i>C</i>^1^,<i>N</i>]bromido(4-methylpyridine-κ<i>N</i>)palladium(II)","","- C14 H16 Br2 N2 Pd -","- C14 H16 Br2 N2 Pd -","- C224 H256 Br32 N32 Pd16 -","16","1","LG3003","Calmuschi-Cula, Beatrice; Kalf, Irmgard; Timofte, Claudia; Englert, Ulli","Robust packing in cyclopalladated primary amines: isomorphous crystal structures of four complexes with varying substitution patterns","Acta Crystallographica Section C","2009","65","2","m48","m51","10.1107/S0108270108043631","","","0.71073","MoKα","","0.0819","0.0422","","","0.0717","0.075","","","","","","0.996","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016976","18.8243","0.0009","18.8243","0.0009","18.3193","0.0017","90","","90","","90","","6491.5","0.7","110","2","110","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","(<i>SP</i>-4-4)-[<i>rac</i>-2-(1-aminoethyl)-5-bromophenyl- κ^2^<i>C</i>^1^,<i>N</i>]iodido(4-methylpyridine-κ<i>N</i>)palladium(II)","","- C14 H16 Br I N2 Pd -","- C14 H16 Br I N2 Pd -","- C224 H256 Br16 I16 N32 Pd16 -","16","1","LG3003","Calmuschi-Cula, Beatrice; Kalf, Irmgard; Timofte, Claudia; Englert, Ulli","Robust packing in cyclopalladated primary amines: isomorphous crystal structures of four complexes with varying substitution patterns","Acta Crystallographica Section C","2009","65","2","m48","m51","10.1107/S0108270108043631","","","0.71073","MoKα","","0.0547","0.0318","","","0.0563","0.0592","","","","","","1.009","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2017350","27.1736","0.001","27.1736","0.001","6.9253","0.0002","90","","90","","90","","5113.7","0.3","90","0.2","90","0.2","","","","","","","","5","I 41/a :2","-I 4ad","88","","6-Chloro-2,5-dihydroxypyridine chloroform 0.125-solvate","","- C5.125 H4.125 Cl1.375 N O2 -","- C5.125 H4.125 Cl1.375 N O2 -","- C164 H132 Cl44 N32 O64 -","32","2","MX3019","Parkin, Sean R.; Behrman, Edward J.","Channel-forming solvates of 6-chloro-2,5-dihydroxypyridine and its solvent-free tautomer 6-chloro-5-hydroxy-2-pyridone","Acta Crystallographica Section C","2009","65","10","o529","o533","10.1107/S0108270109036476","","","0.71073","MoKα","","0.1066","0.0517","","","0.1212","0.1458","","","","","","0.988","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2017351","27.1708","0.0004","27.1708","0.0004","6.9458","0.0001","90","","90","","90","","5127.75","0.13","90","0.2","90","0.2","","","","","","","","5","I 41/a :2","-I 4ad","88","","6-Chloro-2,5-dihydroxypyridine carbon tetrachloride 0.125-solvate","","- C5.125 H4 Cl1.5 N O2 -","- C5.125 H4 Cl1.5 N O2 -","- C164 H128 Cl48 N32 O64 -","32","2","MX3019","Parkin, Sean R.; Behrman, Edward J.","Channel-forming solvates of 6-chloro-2,5-dihydroxypyridine and its solvent-free tautomer 6-chloro-5-hydroxy-2-pyridone","Acta Crystallographica Section C","2009","65","10","o529","o533","10.1107/S0108270109036476","","","1.54178","CuKα","","0.0354","0.0339","","","0.0898","0.0916","","","","","","1.038","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2017352","27.1149","0.001","27.1149","0.001","6.9618","0.0002","90","","90","","90","","5118.4","0.3","90","0.2","90","0.2","","","","","","","","5","I 41/a :2","-I 4ad","88","","6-Chloro-2,5-dihydroxypyridine 1,2 dichloroethane solvate","","- C5.25 H4.5 Cl1.25 N O2 -","- C5 H4 Cl N O2 -","- C160 H128 Cl32 N32 O64 -","32","2","MX3019","Parkin, Sean R.; Behrman, Edward J.","Channel-forming solvates of 6-chloro-2,5-dihydroxypyridine and its solvent-free tautomer 6-chloro-5-hydroxy-2-pyridone","Acta Crystallographica Section C","2009","65","10","o529","o533","10.1107/S0108270109036476","","","0.71073","MoKα","","0.0779","0.051","","","0.1232","0.1331","","","","","","1.01","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2017353","27.2426","0.001","27.2426","0.001","6.9534","0.0003","90","","90","","90","","5160.5","0.3","90","0.2","90","0.2","","","","","","","","5","I 41/a :2","-I 4ad","88","","6-Chloro-2,5-dihydroxypyridine 1,1,2,2-tetrachloroethane solvate","","- C5.25 H4.25 Cl1.5 N O2 -","- C5 H4 Cl N O2 -","- C160 H128 Cl32 N32 O64 -","32","2","MX3019","Parkin, Sean R.; Behrman, Edward J.","Channel-forming solvates of 6-chloro-2,5-dihydroxypyridine and its solvent-free tautomer 6-chloro-5-hydroxy-2-pyridone","Acta Crystallographica Section C","2009","65","10","o529","o533","10.1107/S0108270109036476","","","1.54178","CuKα","","0.037","0.035","","","0.0919","0.093","","","","","","1.091","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2017355","27.4722","0.0002","27.4722","0.0002","7.0495","0.0001","90","","90","","90","","5320.41","0.09","293","0.2","293","0.2","","","","","","","","5","I 41/a :2","-I 4ad","88","","6-Chloro-2,5-dihydroxypyridine 1,1,2,2-tetrachloroethane solvate","","- C5.25 H4.25 Cl1.5 N O2 -","- C5 H4 Cl N O2 -","- C160 H128 Cl32 N32 O64 -","32","2","MX3019","Parkin, Sean R.; Behrman, Edward J.","Channel-forming solvates of 6-chloro-2,5-dihydroxypyridine and its solvent-free tautomer 6-chloro-5-hydroxy-2-pyridone","Acta Crystallographica Section C","2009","65","10","o529","o533","10.1107/S0108270109036476","","","0.71073","MoKα","","0.0805","0.0591","","","0.1835","0.1955","","","","","","1.145","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2018496","22.268","0.004","22.268","0.004","18.398","0.005","90","","90","","90","","9123","3","120","2","120","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","1,5-Bis(4-chlorophenyl)-3-(2-oxo-1,2-dihydroquinolin-3-yl)pentane-1,5-dione‒ 1,5-bis(2-chlorophenyl)-3-(2-oxo-1,2-dihydroquinolin-3-yl)pentane-1,5-dione (84/16)","","- C26 H19 Cl2 N O3 -","- C26 H19 Cl2 N O3 -","- C416 H304 Cl32 N16 O48 -","16","1","FG3252","Insuasty, Daniel; Abonía, Rodrigo; Cobo, Justo; Glidewell, Christopher","Two closely related, and unexpected, quinolinone derivatives: a three-dimensional hydrogen-bonded framework structure and a hydrogen-bonded molecular ribbon of <i>R</i>~2~^2^(18) and <i>R</i>~4~^4^(24) rings","Acta Crystallographica Section C","2012","68","6","o220","o225","10.1107/S0108270112020860","","","0.71073","MoKα","","0.0846","0.0535","","","0.1392","0.1586","","","","","","1.089","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2018511","29.446","0.003","29.446","0.003","4.0228","0.0004","90","","90","","90","","3488","0.6","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","4-bromo-1-(dibromoboryl)benzene","","- C6 H4 B Br3 -","- C6 H4 B Br3 -","- C96 H64 B16 Br48 -","16","1","SK3438","Popp, Sebastian; Ruth, Kai; Lerner, Hans-Wolfram; Bolte, Michael","Structural characteristics of dibromoborylated benzene derivatives","Acta Crystallographica Section C","2012","68","6","o226","o230","10.1107/S0108270112020604","","","0.71073","MoKα","","0.1048","0.0704","","","0.1362","0.1494","","","","","","1.051","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2018926","15.373","0.003","15.373","0.003","13.287","0.002","90","","90","","90","","3140.1","1","298","2","298","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Tetrakis[μ~3~-(pyridin-2-yl)methanolato]-<i>tetrahedro</i>-tetrakis[chloridolead(II)]","","- C24 H24 Cl4 N4 O4 Pb4 -","- C24 H24 Cl4 N4 O4 Pb4 -","- C96 H96 Cl16 N16 O16 Pb16 -","4","0.25","QS3024","Liu, Ting; Pan, Yu-Peng; Wang, Suna; Dou, Jian-Min","Two novel lead(II) complexes of 2-(hydroxymethyl)pyridine: a threefold diamondoid supramolecular network based on Pb~4~O~4~ cores and a two-dimensional (4,4) network based on Pb~2~O~2~ units","Acta Crystallographica Section C","2013","69","4","394","399","10.1107/S0108270113006987","","","0.71073","MoKα","","0.0375","0.026","","","0.0572","0.0609","","","","","","1.14","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019118","30.2283","0.0004","30.2283","0.0004","14.3753","0.0003","90","","90","","90","","13135.4","0.4","200","2","200","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","[Tris(3-anilinocarbonyl-5-methylpyrazol-1-yl-κ<i>N</i>^2^)borato]thallium(I)","","- C33 H31 B N9 O3 Tl -","- C33 H31 B N9 O3 Tl -","- C528 H496 B16 N144 O48 Tl16 -","16","1","EG3122","Sirianni, Eric R.; Yap, Glenn P. A.; Akturk, Eser S.; Theopold, Klaus H.","Improved syntheses, and structural and electronic characterization of carboxamide-substituted Tp^CONHPh,Me^ and Tp^CONH<i>t^-Bu,Me</i> ligands","Acta Crystallographica Section C","2013","69","9","947","953","10.1107/S0108270113015898","","","1.54178","CuKα","","0.033","0.0258","","","0.0652","0.0694","","","","","","1.024","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019208","20.4639","0.0013","20.4639","0.0013","14.3952","0.0014","90","","90","","90","","6028.3","0.8","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","4-(methylsulfonyl)-2-nitro-N-(2-phenylethyl)aniline","4-(methylsulfonyl)-2-nitro-<i>N</i>-(2-phenylethyl)aniline","","- C15 H16 N2 O4 S -","- C15 H16 N2 O4 S -","- C240 H256 N32 O64 S16 -","16","1","CU3041","Wade, Colin B.; Mohanty, Dillip K.; Squattrito, Philip J.; Amato, Nicholas J.; Kirschbaum, Kristin","A series of <i>N</i>-(2-phenylethyl)nitroaniline derivatives as precursors for slow and sustained nitric oxide release agents","Acta Crystallographica Section C","2013","69","11","1383","1389","10.1107/S0108270113025869","","","0.71073","MoKα","","0.0312","0.029","","","0.0842","0.0863","","","","","","1.063","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2019283","24.1125","0.0004","24.1125","0.0004","18.0487","0.0007","90","","90","","90","","10493.7","0.5","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","(S,R)-[Ru^II^(H)(Cl)(<i>trop</i>HN(CH~2~)~3~HN<i>trop</i>)]","Chlorido{(1<i>SR</i>,2<i>RS</i>)-<i>N</i>,<i>N</i>'-bis[(10,11-η)-5<i>H</i>-dibenzo[<i>a</i>,<i>d</i>]cyclohepten-5-amine]propane-1,3-diamine-κ^2^<i>N</i>,<i>N</i>'}hydridoruthenium(II)","","- C33 H31 Cl N2 Ru -","- C33 H31 Cl N2 Ru -","- C528 H496 Cl16 N32 Ru16 -","16","1","FA3321","Santiso-Quinones, Gustavo; Rodriguez-Lugo, Rafael; Sacchetti, Vittorio; Grützmacher, Hansjörg","Ru^II^‒hydride‒<i>trop</i> complexes: X-ray single-crystal determination and quantum-chemical calculations","Acta Crystallographica Section C","2013","69","12","1421","1426","10.1107/S0108270113024505","","","0.71073","MoKα","","0.0662","0.0344","","","0.0662","0.073","","","","","","0.918","","","","has coordinates,has disorder","176760","2020-10-21","18:00:00",""
"2019296","7.6219","0.0003","7.6219","0.0003","13.1632","0.0009","90","","90","","90","","764.69","0.07","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Imidazolidin-2-one","","- C3 H6 N2 O -","- C3 H6 N2 O -","- C24 H48 N16 O8 -","8","0.5","FG3316","Taouss, Christina; Jones, Peter G.; Tindall, Daniel J.","Imidazolidin-2-one: pseudosymmetry and twinning","Acta Crystallographica Section C","2013","69","12","1534","1536","10.1107/S0108270113030746","","","0.71073","MoKα","","0.0349","0.0317","","","0.0769","0.0794","","","","","","1.067","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2019370","18.9089","0.0006","18.9089","0.0006","10.5803","0.0003","90","","90","","90","","3782.9","0.2","295","2","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Tetrabutylammonium Tetrabutylborate","","- C32 H72 B N -","- C32 H72 B N -","- C128 H288 B4 N4 -","4","0.25","ZM5071","Stilinović, Vladimir; Kaitner, Branko","Comparative refinement of correct and incorrect structural models of tetrabutylammonium tetrabutylborate ‒ pitfalls arising from poor-quality data","Acta Crystallographica Section A Foundations of Crystallography","2010","66","4","441","445","10.1107/S0108767310013814","","","1.54184","CuKα","","0.172","0.0643","","","0.2145","0.2649","","","","","","0.749","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2019371","18.958","0.005","18.958","0.005","10.624","0.005","90","","90","","90","","3818","2","295","2","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Tetrabutylammonium Tetrabutylborate","","- C32 H72 B N -","- C32 H72 B N -","- C128 H288 B4 N4 -","4","0.25","ZM5071","Stilinović, Vladimir; Kaitner, Branko","Comparative refinement of correct and incorrect structural models of tetrabutylammonium tetrabutylborate ‒ pitfalls arising from poor-quality data","Acta Crystallographica Section A Foundations of Crystallography","2010","66","4","441","445","10.1107/S0108767310013814","","","0.71073","MoKα","","0.3277","0.0807","","","0.1944","0.2554","","","","","","0.744","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2020752","11.586","0.003","11.586","0.003","13.069","0.002","90","","90","","90","","1754.3","0.7","","","293","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- K4 Mo4 O16 Th -","- K4 Mo4 O16 Th -","- K16 Mo16 O64 Th4 -","4","0.25","","Huyghe, M.; Lee, M. R.; Quarton, M.; Robert, F.","Structure cristalline de K~4~Th(MoO~4~)~4~","Acta Crystallographica, Section C: Crystal Structure Communications","1991","47","9","1797","1799","10.1107/s0108270191003025","","x-ray","0.71069","MoKα","","","0.022","","","0.024","","","","","","","1.6","","","","has coordinates","200783","2020-10-21","18:00:00",""
"2021830","25.9178","0.0006","25.9178","0.0006","9.4186","0.0003","90","","90","","90","","6326.8","0.3","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","{μ-3-[(Carboxylatomethyl)sulfanyl]-5-(pyridin-2-yl)-4<i>H</i>-1,2,4-triazol-4-ido-κ^2^<i>N</i>^1^,<i>N</i>^5^:<i>N</i>^2^,<i>O</i>}bis[diaquanickel(II)] methanol disolvate dihydrate","","- C10 H16 N4 Ni O6 S -","- C10 H16 N4 Ni O6 S -","- C160 H256 N64 Ni16 O96 S16 -","16","1","YP3199","Fang, Zi-Yi; Zhang, Li; Ma, Jian-Ping; Zhao, Long; Wang, Shi-Ling; Xie, Nan-Hua; Liu, Yi-Qin; Guo, Xiao-Ying; Qin, Jie","Dinuclear cobalt and nickel complexes of a mercaptoacetic acid substituted 1,2,4-triazole ligand: syntheses, structures and urease inhibitory studies","Acta Crystallographica Section C","2019","75","12","","","10.1107/S2053229619015602","","x-ray","1.54184","CuKα","","0.041","0.0335","","","0.0809","0.0864","","","","","","1.024","","","","has coordinates,has Fobs","242989","2020-10-21","18:00:00",""
"2101656","5.99986","0.00016","5.99986","0.00016","12.3976","0.0004","90","","90","","90","","446.29","0.02","20","","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","ammonium perrhenate","ammonium rhenium(VII) oxide","","- D4 N O4 Re -","- D4 N O4 Re -","- D16 N4 O16 Re4 -","4","0.25","BR0049","I.P.Swainson; R.J.C.Brown","Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation","Acta Crystallographica Section B","1997","53","1","76","81","10.1107/S0108768196011160","","neutron","1.49978","neutron","","","","","","","","","","","","","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101657","6.00092","0.00016","6.00092","0.00016","12.3989","0.0004","90","","90","","90","","446.5","0.02","40","","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","ammonium perrhenate","ammonium rhenium(VII) oxide","","- D4 N O4 Re -","- D4 N O4 Re -","- D16 N4 O16 Re4 -","4","0.25","BR0049","I.P.Swainson; R.J.C.Brown","Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation","Acta Crystallographica Section B","1997","53","1","76","81","10.1107/S0108768196011160","","neutron","1.49978","neutron","","","","","","","","","","","","","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101658","6.00193","0.00017","6.00193","0.00017","12.4027","0.0004","90","","90","","90","","446.78","0.02","60","","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","ammonium perrhenate","ammonium rhenium(VII) oxide","","- D4 N O4 Re -","- D4 N O4 Re -","- D16 N4 O16 Re4 -","4","0.25","BR0049","I.P.Swainson; R.J.C.Brown","Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation","Acta Crystallographica Section B","1997","53","1","76","81","10.1107/S0108768196011160","","neutron","1.49978","neutron","","","","","","","","","","","","","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101659","6.00313","0.00017","6.00313","0.00017","12.4118","0.0004","90","","90","","90","","447.29","0.02","80","","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","ammonium perrhenate","ammonium rhenium(VII) oxide","","- D4 N O4 Re -","- D4 N O4 Re -","- D16 N4 O16 Re4 -","4","0.25","BR0049","I.P.Swainson; R.J.C.Brown","Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation","Acta Crystallographica Section B","1997","53","1","76","81","10.1107/S0108768196011160","","neutron","1.49978","neutron","","","","","","","","","","","","","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101660","6.00301","0.00018","6.00301","0.00018","12.4258","0.0004","90","","90","","90","","447.78","0.02","100","","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","ammonium perrhenate","ammonium rhenium(VII) oxide","","- D4 N O4 Re -","- D4 N O4 Re -","- D16 N4 O16 Re4 -","4","0.25","BR0049","I.P.Swainson; R.J.C.Brown","Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation","Acta Crystallographica Section B","1997","53","1","76","81","10.1107/S0108768196011160","","neutron","1.49978","neutron","","","","","","","","","","","","","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101661","6.00091","0.00019","6.00091","0.00019","12.4466","0.0005","90","","90","","90","","448.21","0.03","120","","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","ammonium perrhenate","ammonium rhenium(VII) oxide","","- D4 N O4 Re -","- D4 N O4 Re -","- D16 N4 O16 Re4 -","4","0.25","BR0049","I.P.Swainson; R.J.C.Brown","Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation","Acta Crystallographica Section B","1997","53","1","76","81","10.1107/S0108768196011160","","neutron","1.49978","neutron","","","","","","","","","","","","","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101662","5.9956","0.0002","5.9956","0.0002","12.4783","0.0005","90","","90","","90","","448.56","0.03","140","","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","ammonium perrhenate","ammonium rhenium(VII) oxide","","- D4 N O4 Re -","- D4 N O4 Re -","- D16 N4 O16 Re4 -","4","0.25","BR0049","I.P.Swainson; R.J.C.Brown","Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation","Acta Crystallographica Section B","1997","53","1","76","81","10.1107/S0108768196011160","","neutron","1.49978","neutron","","","","","","","","","","","","","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101663","5.98872","0.00014","5.98872","0.00014","12.466","0.0003","90","","90","","90","","447.09","0.018","140","","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","ammonium perrhenate","ammonium rhenium(VII) oxide","","- D4 N O4 Re -","- D4 N O4 Re -","- D16 N4 O16 Re4 -","4","0.25","BR0049","I.P.Swainson; R.J.C.Brown","Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation","Acta Crystallographica Section B","1997","53","1","76","81","10.1107/S0108768196011160","","neutron","1.49935","neutron","","","","","","","","","","","","","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2101664","5.97765","0.00014","5.97765","0.00014","12.516","0.0003","90","","90","","90","","447.225","0.018","160","","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","ammonium perrhenate","ammonium rhenium(VII) oxide","","- D4 N O4 Re -","- D4 N O4 Re -","- D16 N4 O16 Re4 -","4","0.25","BR0049","I.P.Swainson; R.J.C.Brown","Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation","Acta Crystallographica Section B","1997","53","1","76","81","10.1107/S0108768196011160","","neutron","1.49935","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2101665","5.95898","0.00015","5.95898","0.00015","12.5916","0.0004","90","","90","","90","","447.12","0.02","180","","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","ammonium perrhenate","ammonium rhenium(VII) oxide","","- D4 N O4 Re -","- D4 N O4 Re -","- D16 N4 O16 Re4 -","4","0.25","BR0049","I.P.Swainson; R.J.C.Brown","Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation","Acta Crystallographica Section B","1997","53","1","76","81","10.1107/S0108768196011160","","neutron","1.49935","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2101666","5.9324","0.00016","5.9324","0.00016","12.6897","0.0004","90","","90","","90","","446.59","0.02","200","","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","ammonium perrhenate","ammonium rhenium(VII) oxide","","- D4 N O4 Re -","- D4 N O4 Re -","- D16 N4 O16 Re4 -","4","0.25","BR0049","I.P.Swainson; R.J.C.Brown","Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation","Acta Crystallographica Section B","1997","53","1","76","81","10.1107/S0108768196011160","","neutron","1.49935","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2101667","5.91124","0.00018","5.91124","0.00018","12.7765","0.0005","90","","90","","90","","446.45","0.03","220","","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","ammonium perrhenate","ammonium rhenium(VII) oxide","","- D4 N O4 Re -","- D4 N O4 Re -","- D16 N4 O16 Re4 -","4","0.25","BR0049","I.P.Swainson; R.J.C.Brown","Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation","Acta Crystallographica Section B","1997","53","1","76","81","10.1107/S0108768196011160","","neutron","1.49935","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2101668","5.89725","0.00019","5.89725","0.00019","12.8464","0.0005","90","","90","","90","","446.77","0.03","240","","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","ammonium perrhenate","ammonium rhenium(VII) oxide","","- D4 N O4 Re -","- D4 N O4 Re -","- D16 N4 O16 Re4 -","4","0.25","BR0049","I.P.Swainson; R.J.C.Brown","Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation","Acta Crystallographica Section B","1997","53","1","76","81","10.1107/S0108768196011160","","neutron","1.49935","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2101669","5.8805","0.0002","5.8805","0.0002","12.9874","0.0006","90","","90","","90","","449.11","0.03","298","","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","ammonium perrhenate","ammonium rhenium(VII) oxide","","- D4 N O4 Re -","- D4 N O4 Re -","- D16 N4 O16 Re4 -","4","0.25","BR0049","I.P.Swainson; R.J.C.Brown","Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation","Acta Crystallographica Section B","1997","53","1","76","81","10.1107/S0108768196011160","","neutron","1.49935","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2101696","13.684","0.002","13.684","0.002","19.482","0.005","90","","90","","90","","3648","1.2","298","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C4 H8 O35 Si17 -","- C4 O38 Si17 -","- C16 O152 Si68 -","4","0.25","SE0181","Knorr, K.; Depmeier, W.","Room-Temperatrue Structure and Geometrical Analysis of the Cubic‒Tetragonal Phase Transition in Dodecasil 3C-THF","Acta Crystallographica Section B","1997","53","1","18","24","10.1107/S010876819600972X","","","0.71069","MoKα","","","0.034","","","0.094","","","","","1.147","1.147","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102176","16.758","0.002","16.758","0.002","8.865","0.002","90","","90","","90","","2489.6","0.7","150","","150","","","","","","","","","4","I 41/a :2","-I 4ad","88","","2,3,5,6-tetrachloro-trans-1,4-diethynyl-cyclohexa-2,5-diene-1,4-diol","","- C10 H4 Cl4 O2 -","- C10 H4 Cl4 O2 -","- C80 H32 Cl32 O16 -","8","0.5","BM0033","Madhavi, N. N. L.; Desiraju, Gautam R.; Bilton, Claire; Howard, Judith A. K.; Allen, Frank H.","Crystal engineering in the <i>gem</i>-alkynol family: interplay between strong and weak interactions in structures of 2,3,5,6-tetrahalo[F,Cl,Br]-<i>trans</i>-1,4-diethynylcyclohexa-2,5-diene-1,4-diols","Acta Crystallographica Section B","2000","56","6","1063","1070","10.1107/S0108768100011496","","","0.71073","MoKα","","0.059","0.0489","","","0.116","0.1245","","","","","","1.091","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103185","22.409","","22.409","","12.216","","90","","90","","89.99","","6134.43","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","μ-Hydroxy-cyclooctadien(1,5)-rhodium(I)-Dimer [(μ-OH)Rh(COD-1,5)]2","","- C16 H26 O2 Rh2 -","- C16 H26 O2 Rh2 -","- C256 H416 O32 Rh32 -","16","1","BM0047","Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H.","Some 60 new space-group corrections","Acta Crystallographica Section B","2002","58","1","62","77","10.1107/S0108768101017128","","","","","","","","","","","","","","","","","","","","","has coordinates","199518","2020-10-21","18:00:00",""
"2103408","18.7407","0.0008","18.7407","0.0008","9.1004","0.0004","90","","90","","90","","3196.2","0.2","273","","273","","","","","","","","","5","I 41/a :2","-I 4ad","88","","ortho-toluenesulfonamide","","- C7 H9 N O2 S -","- C7 H9 N O2 S -","- C112 H144 N16 O32 S16 -","16","1","BM0052","Tremayne, Maryjane; Seaton, Colin C.; Glidewell, Christopher","Structures of three substituted arenesulfonamides from X-ray powder diffraction data using the differential evolution technique","Acta Crystallographica Section B","2002","58","5","823","834","10.1107/S0108768102011928","","","1.54056","CuKα~1~","","","","","","","","","","3.417","","","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2103752","19.253","0.008","19.253","","22.38","0.009","90","","90","","90","","8296","5","294","","294","","","","","","","","","6","I 41/a :2","-I 4ad","88","bis(1,1,1,5,5,5-hexafluoropentane-2,4-dionato)-bis(4-methylpyrimidine) copper(II)","catena-bis(1,1,1,5,5,5-hexafluoropentane-2,4-dionato)[m-4-methylpyrimidine- N1:N3]copper(II)","","- C15 H8 Cu F12 N2 O4 -","- C15 H8 Cu F12 N2 O4 -","- C240 H128 Cu16 F192 N32 O64 -","16","1","OA0036","Yasui, Masanori; Ishikawa, Yoshimitsu; Ishida, Takayuki; Nogami, Takashi; Iwasaki, Fujiko","Bis(hfac)-copper(II) complexes bridged by pyrimidines showing magnetic interactions","Acta Crystallographica Section B","2001","57","6","772","779","10.1107/S0108768101013568","","","0.71073","MoKα","","0.12","0.0527","","","","0.1796","","","","","","1.028","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2103753","18.808","0.002","18.808","","22.182","0.004","90","","90","","90","","7846.7","1.6","100","","100","","","","","","","","","6","I 41/a :2","-I 4ad","88","bis(1,1,1,5,5,5-hexafluoropentane-2,4-dionato)-bis(4-methylpyrimidine) copper(II)","catena-bis(1,1,1,5,5,5-hexafluoropentane-2,4-dionato)[m-4-methylpyrimidine- N1:N3]copper(II)","","- C15 H8 Cu F12 N2 O4 -","- C15 H8 Cu F12 N2 O4 -","- C240 H128 Cu16 F192 N32 O64 -","16","1","OA0036","Yasui, Masanori; Ishikawa, Yoshimitsu; Ishida, Takayuki; Nogami, Takashi; Iwasaki, Fujiko","Bis(hfac)-copper(II) complexes bridged by pyrimidines showing magnetic interactions","Acta Crystallographica Section B","2001","57","6","772","779","10.1107/S0108768101013568","","","0.71073","MoKα","","0.0345","0.0273","","","","0.0838","","","","","","1.082","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2104891","23.0354","0.0003","23.0354","0.0003","29.6005","0.0003","90","","90","","90","","15706.9","0.3","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","catena-tetrakis(imidazole)-tetrakis(μ~2~-oxo)-dioxo-manganese(ii)-di-vanadium","","- C12 H16 Mn N8 O6 V2 -","- C12 H16 Mn N8 O6 V2 -","- C384 H512 Mn32 N256 O192 V64 -","32","2","GW5007","Chainok, Kittipong; Haller, Kenneth J.; Rae, A. David; Willis, Anthony C.; Williams, Ian D.","Investigation of the structure and phase transitions of the polymeric inorganic‒organic hybrids: [<i>M</i>(Im)~4~V~2~O~6~]~{∞~}; <i>M</i> = Mn, Co, Ni, Im = imidazole","Acta Crystallographica Section B","2011","67","1","41","52","10.1107/S0108768110042941","","","0.71073","MoKα","","0.0422","0.0316","","","","0.0458","","","1.4695","","","1.4695","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2104892","23.0473","0.0003","23.0473","0.0003","29.6521","0.0003","90","","90","","90","","15750.5","0.3","200","2","200","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","catena-tetrakis(imidazole)-tetrakis(μ~2~-oxo)-dioxo-manganese(ii)-di-vanadium","","- C12 H16 Mn N8 O6 V2 -","- C12 H16 Mn N8 O6 V2 -","- C384 H512 Mn32 N256 O192 V64 -","32","2","GW5007","Chainok, Kittipong; Haller, Kenneth J.; Rae, A. David; Willis, Anthony C.; Williams, Ian D.","Investigation of the structure and phase transitions of the polymeric inorganic‒organic hybrids: [<i>M</i>(Im)~4~V~2~O~6~]~{∞~}; <i>M</i> = Mn, Co, Ni, Im = imidazole","Acta Crystallographica Section B","2011","67","1","41","52","10.1107/S0108768110042941","","","0.71073","MoKα","","0.0443","0.0326","","","","0.0463","","","1.4507","","","1.4507","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2104893","23.0645","0.0003","23.0645","0.0003","29.6897","0.0003","90","","90","","90","","15794.1","0.3","279","2","279","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","catena-tetrakis(imidazole)-tetrakis(μ~2~-oxo)-dioxo-manganese(ii)-di-vanadium","","- C12 H16 Mn N8 O6 V2 -","- C12 H16 Mn N8 O6 V2 -","- C384 H512 Mn32 N256 O192 V64 -","32","2","GW5007","Chainok, Kittipong; Haller, Kenneth J.; Rae, A. David; Willis, Anthony C.; Williams, Ian D.","Investigation of the structure and phase transitions of the polymeric inorganic‒organic hybrids: [<i>M</i>(Im)~4~V~2~O~6~]~{∞~}; <i>M</i> = Mn, Co, Ni, Im = imidazole","Acta Crystallographica Section B","2011","67","1","41","52","10.1107/S0108768110042941","","","0.71073","MoKα","","0.0454","0.0348","","","","0.0501","","","1.5603","","","1.5603","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2104896","22.8606","0.0003","22.8606","0.0003","29.2658","0.0003","90","","90","","90","","15294.5","0.3","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","catena-tetrakis(imidazole)-tetrakis(μ~2~-oxo)-dioxo-cobalt(ii)-di-vanadium","","- C12 H16 Co N8 O6 V2 -","- C12 H16 Co N8 O6 V2 -","- C384 H512 Co32 N256 O192 V64 -","32","2","GW5007","Chainok, Kittipong; Haller, Kenneth J.; Rae, A. David; Willis, Anthony C.; Williams, Ian D.","Investigation of the structure and phase transitions of the polymeric inorganic‒organic hybrids: [<i>M</i>(Im)~4~V~2~O~6~]~{∞~}; <i>M</i> = Mn, Co, Ni, Im = imidazole","Acta Crystallographica Section B","2011","67","1","41","52","10.1107/S0108768110042941","","","0.71073","MoKα","","0.0449","0.035","","","","0.0561","","","","","","1.8449","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2104897","22.8863","0.0003","22.8863","0.0003","29.27","0.0003","90","","90","","90","","15331.1","0.3","170","2","170","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","catena-tetrakis(imidazole)-tetrakis(μ~2~-oxo)-dioxo-cobalt(ii)-di-vanadium","","- C12 H16 Co N8 O6 V2 -","- C12 H16 Co N8 O6 V2 -","- C384 H512 Co32 N256 O192 V64 -","32","2","GW5007","Chainok, Kittipong; Haller, Kenneth J.; Rae, A. David; Willis, Anthony C.; Williams, Ian D.","Investigation of the structure and phase transitions of the polymeric inorganic‒organic hybrids: [<i>M</i>(Im)~4~V~2~O~6~]~{∞~}; <i>M</i> = Mn, Co, Ni, Im = imidazole","Acta Crystallographica Section B","2011","67","1","41","52","10.1107/S0108768110042941","","","0.71073","MoKα","","0.0501","0.0399","","","","0.0647","","","","","","2.0952","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105497","9.4384","0.0007","9.4384","0.0007","29.75","0.003","90","","90","","90","","2650.2","0.4","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H32 Cr N8 O12 Rh4 -","- C16 H32 Cr N8 O12 Rh4 -","- C64 H128 Cr4 N32 O48 Rh16 -","4","0.25","RY5054","Ebihara, Masahiro; Fuma, Yasuhiro","Two- and three-dimensional assembled structures constructed from amidate-bridged paddlewheel complexes with group 6 oxometallate ions","Acta Crystallographica Section B","2013","69","5","480","489","10.1107/S2052519213024068","","","0.71069","MoKα","","0.0583","0.045","","","0.0749","0.0776","","","","","","1.275","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105498","9.5725","0.0008","9.5725","0.0008","29.627","0.003","90","","90","","90","","2714.8","0.4","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H32 Mo N8 O12 Rh4 -","- C16 H32 Mo N8 O12 Rh4 -","- C64 H128 Mo4 N32 O48 Rh16 -","4","0.25","RY5054","Ebihara, Masahiro; Fuma, Yasuhiro","Two- and three-dimensional assembled structures constructed from amidate-bridged paddlewheel complexes with group 6 oxometallate ions","Acta Crystallographica Section B","2013","69","5","480","489","10.1107/S2052519213024068","","","0.71069","MoKα","","0.0781","0.0608","","","0.0876","0.0913","","","","","","1.298","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105499","9.5905","0.0008","9.5905","0.0008","29.625","0.003","90","","90","","90","","2724.8","0.4","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H32 N8 O12 Rh4 W -","- C16 H32 N8 O12 Rh4 W -","- C64 H128 N32 O48 Rh16 W4 -","4","0.25","RY5054","Ebihara, Masahiro; Fuma, Yasuhiro","Two- and three-dimensional assembled structures constructed from amidate-bridged paddlewheel complexes with group 6 oxometallate ions","Acta Crystallographica Section B","2013","69","5","480","489","10.1107/S2052519213024068","","","0.71069","MoKα","","0.0759","0.0504","","","0.0771","0.0816","","","","","","1.234","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105500","9.4232","0.0005","9.4232","0.0005","30.168","0.003","90","","90","","90","","2678.8","0.3","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H32 Cr N8 O12 Ru4 -","- C16 H32 Cr N8 O12 Ru4 -","- C64 H128 Cr4 N32 O48 Ru16 -","4","0.25","RY5054","Ebihara, Masahiro; Fuma, Yasuhiro","Two- and three-dimensional assembled structures constructed from amidate-bridged paddlewheel complexes with group 6 oxometallate ions","Acta Crystallographica Section B","2013","69","5","480","489","10.1107/S2052519213024068","","","0.71069","MoKα","","0.0425","0.0383","","","0.0653","0.0663","","","","","","1.329","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105501","9.5504","0.0005","9.5504","0.0005","29.933","0.003","90","","90","","90","","2730.2","0.3","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H32 Mo N8 O12 Ru4 -","- C16 H32 Mo N8 O12 Ru4 -","- C64 H128 Mo4 N32 O48 Ru16 -","4","0.25","RY5054","Ebihara, Masahiro; Fuma, Yasuhiro","Two- and three-dimensional assembled structures constructed from amidate-bridged paddlewheel complexes with group 6 oxometallate ions","Acta Crystallographica Section B","2013","69","5","480","489","10.1107/S2052519213024068","","","0.71069","MoKα","","0.0825","0.0559","","","0.0968","0.1047","","","","","","1.023","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105502","9.5668","0.0007","9.5668","0.0007","29.98","0.003","90","","90","","90","","2743.9","0.4","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H32 N8 O12 Ru4 W -","- C16 H32 N8 O12 Ru4 W -","- C64 H128 N32 O48 Ru16 W4 -","4","0.25","RY5054","Ebihara, Masahiro; Fuma, Yasuhiro","Two- and three-dimensional assembled structures constructed from amidate-bridged paddlewheel complexes with group 6 oxometallate ions","Acta Crystallographica Section B","2013","69","5","480","489","10.1107/S2052519213024068","","","0.7107","MoKα","","0.0421","0.0397","","","0.0687","0.0693","","","","","","1.257","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2106091","5.775","","5.775","","13.252","","90","","90","","90","","441.962","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","N H4 Tc O4","","- H4 N O4 Tc -","- H4 N O4 Tc -","- H16 N4 O16 Tc4 -","4","0.25","","Faggiani, R.; Lock, C.J.L.; Poce, J.","The structure of ammonium pertechnetate at 295, 208 and 141K","Acta Crystallographica B (24,1968-38,1982)","1980","36","","231","233","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106559","16.488","","16.488","","10.663","","90","","90","","90","","2898.78","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","Na6 (Pd (S O3)4) (H2 O)2","","- H4 Na6 O14 Pd S4 -","- H2 Na6 O14 Pd S4 -","- H16 Na48 O112 Pd8 S32 -","8","0.5","","Messer, D.; Breitinger, D.K.; Haegler, W.","Hexasodium tetrasulfitopalladate(II) dihydrate, Na6 Pd (S O3)4 (H2 O)2: A structure with a pronounced rod packing","Acta Crystallographica B (24,1968-38,1982)","1981","37","","19","23","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106705","5.66","","5.66","","12.677","","90","","90","","90","","406.115","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","K Re O4","","- K O4 Re -","- K O4 Re -","- K4 O16 Re4 -","4","0.25","","Lock, C.J.L.; Turner, G.","A reinvestigation of the crystal structure of potassium perrhenate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1764","1765","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106754","13.696","","13.696","","5.981","","90","","90","","90","","1121.92","","","","","","","","","","","","","2","I 41/a :2","-I 4ad","88","","","","- Nb O2 -","- Nb O2 -","- Nb32 O64 -","32","2","","Cheetham, A.K.; Rao, C.N.R.","A neutron diffraction study of niobium dioxide","Acta Crystallographica B (24,1968-38,1982)","1976","32","","1579","1580","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2108653","19.1124","0.0003","19.1124","0.0003","34.4165","0.0006","90","","90","","90","","12571.8","0.4","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- F120 Ga20 K60 -","- F120 Ga20 K60 -","- F480 Ga80 K240 -","4","0.25","","King, Graham","New examples of non-cooperative octahedral tilting in a double perovskite: phase transitions in K~3~GaF~6~","Acta Crystallographica Section B","2020","76","5","","","10.1107/S2052520620009695","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","255583","2020-10-21","18:00:00",""
"2108713","28.1674","0.0005","28.1674","0.0005","4.15209","0.00011","90","","90","","90","","3294.28","0.12","296","0.1","296","0.1","","","","","","","","4","I 41/a :2","-I 4ad","88","","3-methyl-6-azido-1,2,4-triazolo[4,3-b]pyridazine","","- C6 H5 N7 O0.3 -","- C6 H5 N7 O0.3 -","- C96 H80 N112 O4.8 -","16","1","","Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej","Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds","Acta Crystallographica Section B","2020","76","6","","","10.1107/S2052520620014493","","x-ray","1.54184","CuKα","","0.0407","0.0371","","","0.1033","0.1077","","","","","","1.048","","","","has coordinates,has Fobs","259226","2020-11-24","05:11:14",""
"2108714","28.1659","0.0003","28.1659","0.0003","4.12335","0.00008","90","","90","","90","","3271.13","0.08","250","0.1","250","0.1","","","","","","","","4","I 41/a :2","-I 4ad","88","","3-methyl-6-azido-1,2,4-triazolo[4,3-b]pyridazine","","- C6 H5 N7 O0.4 -","- C6 H5 N7 O0.4 -","- C96 H80 N112 O6.4 -","16","1","","Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej","Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds","Acta Crystallographica Section B","2020","76","6","","","10.1107/S2052520620014493","","x-ray","1.54184","CuKα","","0.0374","0.0346","","","0.0974","0.1009","","","","","","1.037","","","","has coordinates","259226","2020-11-24","05:11:14",""
"2108715","28.1314","0.0004","28.1314","0.0004","4.09378","0.0001","90","","90","","90","","3239.72","0.1","200","0.1","200","0.1","","","","","","","","4","I 41/a :2","-I 4ad","88","","3-methyl-6-azido-1,2,4-triazolo[4,3-b]pyridazine","","- C6 H5 N7 O0.4 -","- C6 H5 N7 O0.4 -","- C96 H80 N112 O6.4 -","16","1","","Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej","Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds","Acta Crystallographica Section B","2020","76","6","","","10.1107/S2052520620014493","","x-ray","1.54184","CuKα","","0.0376","0.0351","","","0.0976","0.1009","","","","","","1.043","","","","has coordinates,has Fobs","259226","2020-11-24","05:11:14",""
"2108716","28.1081","0.0004","28.1081","0.0004","4.06918","0.00011","90","","90","","90","","3214.92","0.11","150","0.1","150","0.1","","","","","","","","4","I 41/a :2","-I 4ad","88","","3-methyl-6-azido-1,2,4-triazolo[4,3-b]pyridazine","","- C6 H5 N7 O0.4 -","- C6 H5 N7 O0.4 -","- C96 H80 N112 O6.4 -","16","1","","Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej","Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds","Acta Crystallographica Section B","2020","76","6","","","10.1107/S2052520620014493","","x-ray","1.54184","CuKα","","0.0374","0.0351","","","0.0947","0.0971","","","","","","1.04","","","","has coordinates,has Fobs","259226","2020-11-24","05:11:14",""
"2108717","28.0757","0.0005","28.0757","0.0005","4.04859","0.00012","90","","90","","90","","3191.28","0.12","100","0.1","100","0.1","","","","","","","","4","I 41/a :2","-I 4ad","88","","3-methyl-6-azido-1,2,4-triazolo[4,3-b]pyridazine","","- C6 H5 N7 O0.4 -","- C6 H5 N7 O0.4 -","- C96 H80 N112 O6.4 -","16","1","","Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej","Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds","Acta Crystallographica Section B","2020","76","6","","","10.1107/S2052520620014493","","x-ray","1.54184","CuKα","","0.0368","0.0353","","","0.0965","0.098","","","","","","1.048","","","","has coordinates,has Fobs","259226","2020-11-24","05:11:14",""
"2108718","28.275","0.003","28.275","0.003","4.1124","0.0012","90","","90","","90","","3287.8","1.1","296","2","296","2","100000","","100000","","","","","4","I 41/a :2","-I 4ad","88","","3-methyl-6-azido-1,2,4-triazolo[4,3-b]pyridazine","","- C6 H5 N7 O0.5 -","- C6 H5 N7 O0.5 -","- C96 H80 N112 O8 -","16","1","","Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej","Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds","Acta Crystallographica Section B","2020","76","6","","","10.1107/S2052520620014493","","x-ray","0.71073","MoKα","","0.1997","0.0798","","","0.1513","0.1986","","","","","","1.089","","","","has coordinates","259226","2020-11-24","05:11:14",""
"2108719","28.18","0.006","28.18","0.006","4.0701","0.0017","90","","90","","90","","3232.1","1.7","296","2","296","2","230000","","230000","","","","","4","I 41/a :2","-I 4ad","88","","3-methyl-6-azido-1,2,4-triazolo[4,3-b]pyridazine","","- C6 H5 N7 O0.6 -","- C6 H5 N7 O0.6 -","- C96 H80 N112 O9.6 -","16","1","","Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej","Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds","Acta Crystallographica Section B","2020","76","6","","","10.1107/S2052520620014493","","x-ray","0.71073","MoKα","","0.1858","0.0827","","","0.1868","0.234","","","","","","1.075","","","","has coordinates","259226","2020-11-24","05:11:14",""
"2108720","27.972","0.006","27.972","0.006","3.9991","0.0008","90","","90","","90","","3129","1.1","296","2","296","2","580000","","580000","","","","","4","I 41/a :2","-I 4ad","88","","3-methyl-6-azido-1,2,4-triazolo[4,3-b]pyridazine","","- C6 H5 N7 O0.5 -","- C6 H5 N7 O0.5 -","- C96 H80 N112 O8 -","16","1","","Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej","Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds","Acta Crystallographica Section B","2020","76","6","","","10.1107/S2052520620014493","","x-ray","0.71073","MoKα","","0.3085","0.0843","","","0.1658","0.2482","","","","","","0.963","","","","has coordinates","259226","2020-11-24","05:11:14",""
"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",""
"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",""
"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",""
"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",""
"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",""
"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",""
"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",""
"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",""
"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",""
"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",""
"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",""
"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",""
"2206551","17.23","0.007","17.23","0.007","9.812","0.004","90","","90","","90","","2913","2","292","2","292","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Tetrakis(3,5-dimethoxyphenyl)silane","","- C32 H36 O8 Si -","- C32 H36 O8 Si -","- C128 H144 O32 Si4 -","4","0.25","SJ6115","Saied, Okba; Maris, Thierry; Simard, Michel; Wuest, James D.","Tetrakis(3,5-dimethoxyphenyl)silane","Acta Crystallographica Section E","2005","61","8","o2563","o2566","10.1107/S1600536805021847","","","1.5418","CuKα","","0.0553","0.0488","","","0.1453","0.149","","","","","","1.059","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206686","25.5382","0.0008","25.5382","0.0008","8.4031","0.0004","90","","90","","90","","5480.5","0.4","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","2-(2-bromo-4-chloroanilino)-2-phenylethanol","","- C14 H13 Br Cl N O -","- C14 H13 Br Cl N O -","- C224 H208 Br16 Cl16 N16 O16 -","16","1","FL6179","Mack, Eric T.; Brown, Matthew J.; Krause, Jeanette A.; Lieberman, Deborah L.; Pinhas, Allan R.","2-(2-Bromo-4-chloroanilino)-2-phenylethanol","Acta Crystallographica Section E","2005","61","9","o2810","o2812","10.1107/S1600536805024244","","","1.54178","CuKα","","0.0241","0.0232","","","0.0607","0.0614","","","","","","1.104","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2206935","18.296","0.004","18.296","0.004","15.728","0.003","90","","90","","90","","5264.8","1.9","298","2","298","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","Bis(benzimidazol-2-yl)methane","","- C15 H12 N4 -","- C15 H12 N4 -","- C240 H192 N64 -","16","1","CV6580","Gui-Yun Duan; Ya-Wei Sun; Jun-Zhi Liu; Jian-Wu Wang","Bis(benzimidazol-2-yl)methane","Acta Crystallographica Section E","2005","61","10","o3476","o3477","10.1107/S1600536805030229","","","0.71073","MoKα","","0.0555","0.0416","","","0.1159","0.1303","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207934","20.373","0.003","20.373","0.003","8.618","0.002","90","","90","","90","","3577","1.1","292","2","292","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","7-(Hydroxymethyl)-1a,7b-dihydro-1H-cyclopropa[a]naphthalene","","- C12 H12 O -","- C12 H12 O -","- C192 H192 O16 -","16","1","WW6448","Gu, Shao-Jin; Jing, Lin-Hai; Zhang, Huan-Xia; Lei, Gang; Qin, Da-Bin","7-(Hydroxymethyl)-1a,7b-dihydro-1<i>H</i>-cyclopropa[<i>a</i>]naphthalene","Acta Crystallographica Section E","2006","62","1","o286","o287","10.1107/S1600536805039450","","","0.71073","MoKα","","0.1822","0.0582","","","0.1342","0.1678","","","","","","0.922","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2208151","17.856","0.007","17.856","0.007","9.955","0.002","90","","90","","90","","3174","1.9","293","2","295","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","2-(Hydroxymethyl)-1,2-benzothiazol-3(2H)-one","","- C8 H7 N O2 S -","- C8 H7 N O2 S -","- C128 H112 N16 O32 S16 -","16","1","RZ6161","Feng-Ling Xu; Qiang Lin","2-(Hydroxymethyl)-1,2-benzothiazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2006","62","2","o496","o497","10.1107/S1600536805042753","","","0.71073","MoKα","","0.0715","0.058","","","0.0976","0.1054","","","","","","1.123","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2208262","12.1117","0.0019","12.1117","0.0019","24.475","0.006","90","","90","","90","","3590.3","1.2","223","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Hexaimidazolium tetrachloromanganese(II) hexachloromanganese(II)","","- C18 H30 Cl10 Mn2 N12 -","- C18 H30 Cl10 Mn2 N12 -","- C72 H120 Cl40 Mn8 N48 -","4","0.25","BT2012","Zhang, Hui; Chen, Pu; Fang, Liang","Hexaimidazolium tetrachloromanganate(II) hexachloromanganate(II)","Acta Crystallographica Section E","2006","62","3","m658","m660","10.1107/S1600536806006751","","","0.71073","MoKα","","0.0556","0.0359","","","0.0879","0.095","","","","","","1.091","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2208397","22.6201","0.0008","22.6201","0.0008","16.3918","0.0012","90","","90","","90","","8387.2","0.7","295","2","","","","","","","","","","3","I 41/a :2","-I 4ad","88","9,9'-Diethyl-3,3'-dicarbazolyl","9,9'-Diethyl-3,3'-di-9H-carbazolyl","","- C28 H24 N2 -","- C28 H24 N2 -","- C448 H384 N32 -","16","1","OM2002","Asker, Erol; Masnovi, John","9,9'-Diethyl-3,3'-di-9<i>H</i>-carbazolyl","Acta Crystallographica Section E","2006","62","3","o1133","o1135","10.1107/S160053680600571X","","","0.71073","MoKα","","","0.0604","","","","0.1352","","","","","","0.859","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2208703","31.3142","0.0014","31.3142","0.0014","12.6792","0.0007","90","","90","","90","","12433","1","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Octabutanol(dodecaoxidododecaphenyl[18.4.0]dodecasiloxane)tetracopper(II) tetrasodium(I)","","- C104 H140 Cu4 Na4 O32 Si12 -","- C104 H140 Cu4 Na4 O32 Si12 -","- C416 H560 Cu16 Na16 O128 Si48 -","4","0.25","SG2008","Bauch, Christian; Zherlitsyna, Larissa; Auner, Norbert; Bolte, Michael","Octabutanol(dodecaoxidododecaphenyl[18.4.0]dodecasiloxane)tetracopper(II)tetrasodium(I)","Acta Crystallographica Section E","2006","62","4","m705","m707","10.1107/S1600536806007021","","","0.71073","MoKα","","0.0602","0.0458","","","0.1267","0.1333","","","","","","1.011","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2209033","5.3875","0.0002","5.3875","0.0002","11.9811","0.0004","90","","90","","90","","347.75","0.02","293","2","293","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","Europium molybdate","","- Eu0.96 Mo O4 -","- Eu0.96 Mo O4 -","- Eu3.84 Mo4 O16 -","4","0.25","WM2012","Gall, P.; Gougeon, P.","The scheelite-type europium molybdate Eu~0.96~MoO~4~","Acta Crystallographica Section E","2006","62","5","i120","i121","10.1107/S1600536806012803","","","0.71069","MoKα","","0.0335","0.0158","","","0.0265","0.0306","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2209049","30.7601","0.0008","30.7601","0.0008","6.6023","0.0004","90","","90","","90","","6247","0.4","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","N-methyl-N-cis-styrylcinnamamide hydrate","N-Methyl-N-cis-styrylcinnamamide monohydrate","","- C18 H19 N O2 -","- C18 H19 N O2 -","- C288 H304 N16 O32 -","16","1","XU2017","Xue-Song Huang; Shi-Yi Ou; Shu-Ze Tang","<i>N</i>-Methyl-<i>N</i>-<i>cis</i>-styrylcinnamamide monohydrate, a compound of Clausenaminade from <i>Clausena lansium</i> (Lour.) Skeels","Acta Crystallographica Section E","2006","62","5","o1987","o1988","10.1107/S1600536806013663","","","0.71073","MoKα","","0.081","0.042","","","0.095","0.123","","","","","","1","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2209784","12.7635","0.0008","12.7635","0.0008","10.8158","0.0006","90","","90","","90","","1761.97","0.18","110","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate","","- C18 H20 O10 -","- C18 H20 O10 -","- C72 H80 O40 -","4","0.25","CF2047","Keblys, Vita E.; Fronczek, Frank R.; Newkome, George R.; Watkins, Steven F.; Weis, Claus D.","Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate","Acta Crystallographica Section E","2006","62","8","o3280","o3281","10.1107/S1600536806025980","","","0.71073","MoKα","","","0.042","","","","0.127","","","","","","1.061","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2210352","21.525","0.005","21.525","0.005","17.396","0.004","90","","90","","90","","8060","3","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","2-(1H-1,3-Benzimidazol-2-ylsulfanyl)-1-(4-methylphenyl)ethanone semicarbazone","","- C17 H17 N5 O S -","- C17 H17 N5 O S -","- C272 H272 N80 O16 S16 -","16","1","OB2042","N. Kiruthiga; S. Athimoolam; S. Saravanan; S. Muthusubramanian; S. Natarajan","2-(1<i>H</i>-1,3-Benzimidazol-2-ylsulfanyl)-1-(4-methylphenyl)ethanone semicarbazone","Acta Crystallographica Section E","2006","62","9","o3897","o3899","10.1107/S1600536806031485","","","0.71069","MoKα","","0.2135","0.0711","","","0.175","0.2107","","","","","","0.851","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2210414","23.986","0.005","23.986","0.005","13.842","0.005","90","","90","","90","","7964","4","273","2","273","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Tetra-μ~3~-iodo-tetrakis[(tri-p-tolylphosphine-κP)silver(I)]","","- C84 H84 Ag4 I4 P4 -","- C84 H84 Ag4 I4 P4 -","- C336 H336 Ag16 I16 P16 -","4","0.25","WN2055","Meijboom, Reinout; Muller, Alfred; Roodt, Andreas","Tetra-μ~3~-iodo-tetrakis[(tri-<i>p</i>-tolylphosphine-κ<i>P</i>)silver(I)]","Acta Crystallographica Section E","2006","62","9","m2162","m2164","10.1107/S1600536806031400","","","0.71069","MoKα","","","0.0166","","","","0.0668","","","","","","1.417","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2210720","12.26","0.02","12.26","0.02","31.65","0.04","90","","90","","90","","4757","13","123","","","","","","","","","","","6","I 41/a :2","-I 4ad","88","","cyclo-Tetrakis[4-(aminomethyl)-5-(hydroxymethyl)-2-methylpyridin-3-olato- κN^1^:κ^2^N^4^,O^3^]tetrakis[chloropalladium(II)] nonahydrate","","- C32 H62 Cl4 N8 O17 Pd4 -","- C32 H62 Cl4 N8 O17 Pd4 -","- C128 H248 Cl16 N32 O68 Pd16 -","4","0.25","NG2082","Odoko, Mamiko; Nishikawa, Naoki; Okabe, Nobuo","<i>cyclo</i>-Tetrakis[4-(aminomethyl)-5-(hydroxymethyl)-2-methylpyridin-3-olato-κ<i>N</i>^1^:κ^2^<i>N</i>^4^,<i>O</i>^3^]tetrakis[chloropalladium(II)] nonahydrate","Acta Crystallographica Section E","2006","62","10","m2419","m2421","10.1107/S1600536806034623","","","0.7107","MoKα","","","0.0666","","","","0.2257","","","","","","1.126","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2210930","14.9585","0.0004","14.9585","","14.2034","0.0004","90","","90","","90","","3178.11","0.12","295","2","295","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Poly[bis(μ~2~-1H-imidazolyl-1,3-diyldiacetato-κ^4^O,O':O''',O'''')cadmium(II)]","","- C14 H14 Cd N4 O8 -","- C14 H14 Cd N4 O8 -","- C112 H112 Cd8 N32 O64 -","8","0.5","CI2185","Zhang, Xian-Fa; Gao, Shan; Huo, Li-Hua; Ng, Seik Weng","Poly[bis(μ~2~-1<i>H</i>-imidazolyl-1,3-diyldiacetato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>''',<i>O</i>'''')cadmium(II)]","Acta Crystallographica Section E","2006","62","11","m2910","m2912","10.1107/S1600536806041407","","","0.71073","MoKα","","0.028","0.023","","","0.051","0.053","","","","","","1.08","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211300","21.579","0.003","21.579","0.003","17.342","0.005","90","","90","","90","","8075","3","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","Bis[μ-8-(pyrimidin-2-ylsulfanylmethyl)quinoline- κ^2^N,S]bis[(acetonitrile)silver(I)] bis(trifluoromethanesulfonate)","","- C34 H28 Ag2 F6 N8 O6 S4 -","- C34 H28 Ag2 F6 N8 O6 S4 -","- C272 H224 Ag16 F48 N64 O48 S32 -","8","0.5","BI2101","Song, Rui-Feng; Wang, Yu-Hong; Li, Jian-Rong","Bis[μ-8-(pyrimidin-2-ylsulfanylmethyl)quinoline-κ^2^<i>N</i>,<i>S</i>]bis[(acetonitrile)silver(I)] bis(trifluoromethanesulfonate)","Acta Crystallographica Section E","2006","62","12","m3437","m3438","10.1107/S1600536806048525","","","0.71073","MoKα","","0.0713","0.0378","","","0.0837","0.1013","","","","","","1.027","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212588","23.2759","0.0002","23.2759","0.0002","16.1785","0.0002","90","","90","","90","","8764.99","0.15","295","2","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","2-{5-[N-(4-tert-Butylbenzyl)carbamoyl]-3-phenyl-1H-pyrazol-1-yl}acetic acid","","- C23 H25 N3 O3 -","- C23 H25 N3 O3 -","- C368 H400 N48 O48 -","16","1","HG2176","Yan-Qing Ge; Yong Xia; Wen-Liang Dong; Fang Wei; Bao-Xiang Zhao","2-{5-[<i>N</i>-(4-<i>tert</i>-Butylbenzyl)carbamoyl]-3-phenyl-1<i>H</i>-pyrazol-1-yl}acetic acid","Acta Crystallographica Section E","2007","63","3","o1287","o1288","10.1107/S1600536807005971","","","0.71073","MoKα","","0.076","0.0466","","","0.1183","0.1355","","","","","","1.034","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212675","22.513","0.003","22.513","0.003","15.529","0.004","90","","90","","90","","7871","3","295","2","295","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","N-[1-(Benzylaminocarbonyl)-2-(4-chlorophenyl)ethyl]benzamide","","- C23 H19 Cl N2 O2 -","- C23 H19 Cl N2 O2 -","- C368 H304 Cl16 N32 O32 -","16","1","RZ2118","Li-Rong Wen; Peng Liu; Ming Li","<i>N</i>-[1-(Benzylaminocarbonyl)-2-(4-chlorophenyl)ethyl]benzamide","Acta Crystallographica Section E","2007","63","3","o1212","o1214","10.1107/S1600536807005429","","","0.71073","MoKα","","0.0928","0.0563","","","0.1291","0.1478","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213269","19.734","0.003","19.734","0.003","16.293","0.005","90","","90","","90","","6345","2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Poly[bis(μ~3~-3-amino-1,2,4-triazolato)(μ~2~glutarato)dizinc]","","- C9 H12 N8 O4 Zn2 -","- C9 H12 N8 O4 Zn2 -","- C144 H192 N128 O64 Zn32 -","16","1","DN2135","Zhi-Qiang Zheng; Chong-Wu Liu; Bin Lin","Poly[bis(μ~3~-3-amino-1,2,4-triazolato)(μ~2~-glutarato)dizinc(II)]","Acta Crystallographica Section E","2007","63","5","m1252","m1253","10.1107/S1600536807014882","","","0.71073","MoKα","","","0.0353","","","0.0901","0.0912","","","","","","1.072","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213464","21.628","0.005","21.628","0.005","9.858","0.005","90","","90","","90","","4611","3","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Tetrakis{μ~3~-1-[(2-oxidoethyl)iminomethyl]-2-naphtholato}tetracopper(II)","","- C52 H44 Cu4 N4 O8 -","- C52 H44 Cu4 N4 O8 -","- C208 H176 Cu16 N16 O32 -","4","0.25","LH2368","Jian-Fang Dong; Lian-Zhi Li; Tao Xu; Hui Cui; Da-Qi Wang","Tetrakis{μ~3~-1-[(2-oxidoethyl)iminomethyl]-2-naphtholato}tetracopper(II)","Acta Crystallographica Section E","2007","63","5","m1501","m1502","10.1107/S1600536807019654","","","0.71073","MoKα","","0.0824","0.053","","","0.0937","0.1018","","","","","","1.083","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213554","19.093","0.004","19.093","0.004","16.916","0.006","90","","90","","90","","6167","3","150","1","150","1","","","","","","","","5","I 41/a :2","-I 4ad","88","","Dipyridine[5,10,15,20-tetrakis(4-carboxyphenyl)porphyrinato]cobalt(II) pyridine tetrasolvate monohydrate","","- C78 H60 Co N10 O9 -","- C78 H58 Co N10 O9 -","- C312 H232 Co4 N40 O36 -","4","0.25","SJ2266","Li, Zong-Sheng; Chai, Jian-She","Dipyridine[5,10,15,20-tetrakis(4-carboxyphenyl)porphyrinato]cobalt(II) pyridine tetrasolvate monohydrate","Acta Crystallographica Section E","2007","63","5","m1533","m1535","10.1107/S1600536807015061","","","0.71073","MoKα","","0.1517","0.097","","","0.2435","0.3257","","","","","","1.076","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213924","22.5161","0.001","22.5161","0.001","6.34","0.0006","90","","90","","90","","3214.2","0.4","100","2","100","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","(2,3-Dihydro-1,4-benzodioxin-2-yl)methanol","","- C9 H10 O3 -","- C9 H10 O3 -","- C144 H160 O48 -","16","1","PK2014","Díaz Gavilán, Mónica; Choquesillo-Lazarte, Duane; Campos, Joaquín M.","(2,3-Dihydro-1,4-benzodioxin-2-yl)methanol","Acta Crystallographica Section E","2007","63","6","o2940","o2940","10.1107/S1600536807016625","","","0.71073","MoKα","","0.045","0.041","","","0.106","0.108","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214219","17.455","0.003","17.455","0.003","38.952","0.003","90","","90","","90","","11868","3","298","2","298","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Tetrakis(1,10-phenanthroline)calcium(II) bis(perchlorate) 4-(dimethylamino)benzaldehyde disolvate","","- C66 H54 Ca Cl2 N10 O10 -","- C66 H54 Ca Cl2 N10 O10 -","- C528 H432 Ca8 Cl16 N80 O80 -","8","0.5","HB2432","Xi-Shi Tai; Jie Yin; Ming-Yang Hao","Tetrakis(1,10-phenanthroline)calcium(II) bis(perchlorate) 4-(dimethylamino)benzaldehyde disolvate","Acta Crystallographica Section E","2007","63","7","m1827","m1827","10.1107/S1600536807027055","","","0.71073","MoKα","","0.2233","0.0785","","","0.1998","0.3877","","","","","","1.126","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214278","22.9526","0.0007","22.9526","0.0007","12.7318","0.0007","90","","90","","90","","6707.4","0.5","291","2","292","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","3-(4-Fluorophenyl)-2-morpholinoquinazolin-4(3H)-one","","- C18 H16 F N3 O2 -","- C18 H16 F N3 O2 -","- C288 H256 F16 N48 O32 -","16","1","IS2172","Chang-Quan Cai; Hong Luo; Ping He; Zhen-Zhen Yang","3-(4-Fluorophenyl)-2-morpholinoquinazolin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","7","o3196","o3196","10.1107/S1600536807027535","","","0.71073","MoKα","","0.075","0.0592","","","0.1482","0.1582","","","","","","1.062","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214510","23.996","0.002","23.996","0.002","13.1605","0.001","90","","90","","90","","7577.9","1.1","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","cyclo-Tetrakis[μ-<i>N</i>-(2-hydroxybenzoyl)-<i>N</i>'-(2-hydroxy-3-\ methoxybenzylidene)hydrazinate(2-)]tetracobalt(II)} <i>N</i>,<i>N</i>-dimethylformamide tetrasolvate","","- C72 H76 Co4 N12 O20 -","- C72 H76 Co4 N12 O20 -","- C288 H304 Co16 N48 O80 -","4","0.25","BI2200","Gao, Yu-Xiang; Wang, Li-Bin; Niu, Yan-Ling; Hao, Lu-Jiang","<i>cyclo</i>-Tetrakis[μ-<i>N</i>-(2-hydroxybenzoyl)-<i>N</i>'-(2-hydroxy-3-methoxybenzylidene)hydrazinate(2‒)]tetracobalt(II) <i>N</i>,<i>N</i>-dimethylformamide tetrasolvate","Acta Crystallographica Section E","2007","63","8","m2128","m2128","10.1107/S1600536807033338","","","0.71073","MoKα","","0.0845","0.0407","","","0.1009","0.1356","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214520","24.1202","0.001","24.1202","0.001","13.093","0.002","90","","90","","90","","7617.3","1.2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","<i>cyclo</i>-Tetrakis[μ-<i>N</i>-(2-hydroxybenzoyl)-<i>N</i>'-(2-hydroxy-3-\ methoxybenzylidene)hydrazine(2-)]tetrazinc(II)} <i>N</i>,<i>N</i>-dimethylformamide tetrasolvate","","- C72 H76 N12 O20 Zn4 -","- C72 H76 N12 O20 Zn4 -","- C288 H304 N48 O80 Zn16 -","4","0.25","BI2214","Gao, Yu-Xiang; Wang, Li-Bin; Niu, Yan-Ling","<i>cyclo</i>-Tetrakis[μ-<i>N</i>-(2-hydroxybenzoyl)-<i>N</i>'-(2-hydroxy-3-methoxybenzylidene)hydrazine(2‒)]tetrazinc(II) <i>N</i>,<i>N</i>-dimethylformamide tetrasolvate","Acta Crystallographica Section E","2007","63","8","m2180","m2180","10.1107/S1600536807034514","","","0.71073","MoKα","","0.0931","0.0457","","","0.114","0.1538","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214747","27.04","0.002","27.04","0.002","14.3178","0.0018","90","","90","","90","","10468.6","1.7","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","[μ-1,2-Disalicyloylhydrazine(2-)- κ^3^N,O,O':κ^3^N',O'',O''']bis[tripyridinenickel(II)] pyridine disolvate","","- C54 H48 N10 Ni2 O4 -","- C54 H48 N10 Ni2 O4 -","- C432 H384 N80 Ni16 O32 -","8","0.5","HY2070","Yuting Chen; Jian-Min Dou; Da-Cheng Li; Da-Qi Wang; Yue-Hua Zhu","[μ-1,2-Disalicyloylhydrazine(2‒)-κ^3^<i>N</i>,<i>O</i>,<i>O</i>':κ^3^<i>N</i>',<i>O</i>'',<i>O</i>''']bis[tripyridinenickel(II)] pyridine disolvate","Acta Crystallographica Section E","2007","63","8","m2118","m2118","10.1107/S1600536807033582","","","0.71073","MoKα","","0.0916","0.0529","","","0.1328","0.1516","","","","","","1.024","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215054","12.4177","0.0014","12.4177","0.0014","33.389","0.006","90","","90","","90","","5148.6","1.2","292","2","292","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Bis[2-(1H-benzimidazol-2-yl-κN^3^)-4,6-dibromophenolato-κO]nickel(II)","","- C26 H14 Br4 N4 Ni O2 -","- C26 H14 Br4 N4 Ni O2 -","- C208 H112 Br32 N32 Ni8 O16 -","8","0.5","CI2430","Yu Wu; Bin Xie; Like Zou; Jian-Shen Feng; Zongqiu Hu","Bis[2-(1<i>H</i>-benzimidazol-2-yl-κ<i>N</i>^3^)-4,6-dibromophenolato-κ<i>O</i>]nickel(II)","Acta Crystallographica Section E","2007","63","9","m2298","m2298","10.1107/S1600536807038214","","","0.71073","MoKα","","0.1348","0.0652","","","0.1552","0.1798","","","","","","0.953","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215112","17.209","0.003","17.209","0.003","16.836","0.003","90","","90","","90","","4986","1.5","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Tetrakis(μ~3~-2-{[1,1-bis(hydroxymethyl)-2-\ oxidoethyl]iminomethyl}phenolato)tetracopper(II)","","- C44 H52 Cu4 N4 O16 -","- C44 H52 Cu4 N4 O16 -","- C176 H208 Cu16 N16 O64 -","4","0.25","HB2463","Jian-Fang Dong; Lian-Zhi Li; Hong-Yu Xu; Da-Qi Wang","Tetrakis(μ~3~-2-{[1,1-bis(hydroxymethyl)-2-oxidoethyl]iminomethyl}phenolato)tetracopper(II)","Acta Crystallographica Section E","2007","63","9","m2300","m2300","10.1107/S1600536807037920","","","0.71073","MoKα","","0.0354","0.0275","","","0.072","0.0753","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215195","12.1767","0.0003","12.1767","0.0003","41.055","0.003","90","","90","","90","","6087.3","0.5","193","2","193","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Diaqua[2,6-bis(2,6-diethyl-4-sulfonatophenyl)-3,5-dimethyl-2,6-\ diazoniaheptan-4-ido]sodium(I)","","- C25 H37 N2 Na O8 S2 -","- C25 H33 N2 Na O8 S2 -","- C200 H264 N16 Na8 O64 S16 -","8","0.5","LH2437","Guo, Xu-Ming; Wang, Qi-Bao; Harms, Klaus; Sun, Hong-Jian","Diaqua[2,6-bis(2,6-diethyl-4-sulfonatophenyl)-3,5-dimethyl-2,6-diazoniaheptan-4-ido]sodium(I)","Acta Crystallographica Section E","2007","63","9","m2316","m2316","10.1107/S1600536807038305","","","0.71073","MoKα","","0.1091","0.0641","","","0.1689","0.1863","","","","","","1.012","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215271","12.5113","0.0006","12.5113","0.0006","13.4435","0.0009","90","","90","","90","","2104.3","0.2","100","0.1","100","0.1","","","","","","","","6","I 41/a :2","-I 4ad","88","","Tetrakis(N-methylthiourea-κS)copper(I) iodide","","- C8 H24 Cu I N8 S4 -","- C8 H24 Cu I N8 S4 -","- C32 H96 Cu4 I4 N32 S16 -","4","0.25","SJ2330","Muhammad Mufakkar; Saeed Ahmad; Islam Ullah Khan; Hoong-Kun Fun; Suchada Chantrapromma","Tetrakis(<i>N</i>-methylthiourea-κ<i>S</i>)copper(I) iodide","Acta Crystallographica Section E","2007","63","9","m2384","m2384","10.1107/S160053680704024X","","","0.71073","MoKα","","0.0479","0.034","","","0.0773","0.0853","","","","","","1.024","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215458","21.9895","0.0017","21.9895","0.0017","24.035","0.003","90","","90","","90","","11621.8","1.9","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","(E)-2,4,6-Triisopropyl-N-[2- (2-pyridylmethyleneamino)cyclohexyl]benzenesulfonamide acetonitrile hemisolvate","","- C28 H40.5 N3.5 O2 S -","- C28 H39 N3.5 O2 S -","- C448 H624 N56 O32 S16 -","16","1","ER2029","Cheng Wang; Jin-Cai Wu","(<i>E</i>)-2,4,6-Triisopropyl-<i>N</i>-[2-(2-pyridylmethyleneamino)cyclohexyl]benzenesulfonamide acetonitrile hemisolvate","Acta Crystallographica Section E","2007","63","10","o4064","o4064","10.1107/S1600536807039918","","","0.71073","MoKα","","0.1116","0.0618","","","0.1829","0.2158","","","","","","1.042","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2215776","24.1627","0.0005","24.1627","0.001","13.0428","0.0005","90","","90","","90","","7614.9","0.5","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","<i>cyclo</i>-Tetrakis[μ-<i>N</i>-(2-hydroxybenzoyl)-<i>N</i>'-(2-hydroxy-3-\ methoxybenzylidene)hydrazinato(2-)]tetranickel(II) <i>N</i>,<i>N</i>-dimethylformamide tetrasolvate","","- C72 H76 N12 Ni4 O20 -","- C72 H76 N12 Ni4 O20 -","- C288 H304 N48 Ni16 O80 -","4","0.25","BI2239","Guan, Guizhi; Gao, Yuxiang; Wang, Lixia; Wang, Tao","<i>cyclo</i>-Tetrakis[μ-<i>N</i>-(2-hydroxybenzoyl)-<i>N</i>'-(2-hydroxy-3-methoxybenzylidene)hydrazinato(2{-})]tetranickel(II) <i>N</i>,<i>N</i>-dimethylformamide tetrasolvate","Acta Crystallographica Section E","2007","63","11","m2662","m2662","10.1107/S1600536807048325","","","0.71073","MoKα","","0.0899","0.0415","","","0.1084","0.1479","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216169","12.7307","0.0007","12.7307","0.0007","19.5433","0.0018","90","","90","","90","","3167.4","0.4","130","","130","","","","","","","","","6","I 41/a :2","-I 4ad","88","","Poly[di-μ~2~-chlorido-μ~4~-hexamethylenetetramine-\ bis[chlorido(methanol-κO)cadmium(II)]]","","- C8 H20 Cd2 Cl4 N4 O2 -","- C8 H18 Cd2 Cl4 N4 O2 -","- C64 H144 Cd16 Cl32 N32 O16 -","8","0.5","XU2326","Yun Chen; Yu-Ling Wang; Shao-Ming Ying; Shuang-Lian Cai","Poly[di-μ~2~-chlorido-μ~4~-hexamethylenetetramine-bis[chlorido(methanol-κ<i>O</i>)cadmium(II)]]","Acta Crystallographica Section E","2007","63","11","m2751","m2751","10.1107/S1600536807046715","","","0.71073","MoKα","","0.0661","0.0518","","","0.0902","0.0969","","","","","","1.099","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216323","15.3161","0.0009","15.3161","0.0009","13.2602","0.0008","90","","90","","90","","3110.6","0.3","170","2","170","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Hexabromido-tetrakis(μ~3~-4-pyridiniumthiolato-κ^3^S)hexacopper(I)","","- C20 H20 Br6 Cu6 N4 S4 -","- C20 H20 Br6 Cu6 N4 S4 -","- C80 H80 Br24 Cu24 N16 S16 -","4","0.25","BT2621","Wriedt, Mario; Jeß, Inke; Näther, Christian","Hexabromidotetrakis(μ~3~-4-pyridiniumthiolato-κ^3^<i>S</i>:<i>S</i>:<i>S</i>)hexacopper(I)","Acta Crystallographica Section E","2007","63","12","m3145","m3145","10.1107/S1600536807059855","","","0.71073","MoKα","","0.0431","0.0324","","","0.0723","0.0763","","","","","","1.032","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216807","21.896","0.003","21.896","0.003","14.059","0.002","90","","90","","90","","6740.4","1.6","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Ethyl [(n-butylammonio)(2-hydroxyphenyl)methyl]phosphonate","","- C13 H22 N O4 P -","- C13 H22 N O4 P -","- C208 H352 N16 O64 P16 -","16","1","SU2022","Zhang, Xiaoyan; Ge, Chunhua; Zhang, Xiangdong; Liu, Qitao","Ethyl [(<i>n</i>-butylammonio)(2-hydroxyphenyl)methyl]phosphonate","Acta Crystallographica Section E","2007","63","12","o4778","o4778","10.1107/S1600536807059168","","","0.71073","MoKα","","0.1138","0.0697","","","0.2121","0.2425","","","","","","1.035","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2217081","21.11","0.003","21.11","0.003","24.585","0.006","90","","90","","90","","10956","3","298","2","298","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","[1,2-Bis(diisopropylphosphino)-1,2-dicarba-closo-dodecaborane-\ κ^2^P,P']dichloridomercury(II)","","- C14 H38 B10 Cl2 Hg P2 -","- C14 H38 B10 Cl2 Hg P2 -","- C224 H608 B160 Cl32 Hg16 P32 -","16","1","HB2648","Fangfang Su; Qingliang Guo; Jianmin Dou; Dacheng Li; Daqi Wang","[1,2-Bis(diisopropylphosphino)-1,2-dicarba-<i>closo</i>-dodecaborane-κ^2^<i>P</i>,<i>P</i>']dichloridomercury(II)","Acta Crystallographica Section E","2008","64","1","m134","m134","10.1107/S1600536807065130","","","0.71073","MoKα","","0.0581","0.0378","","","0.0726","0.0768","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2217235","21.9827","0.001","21.9827","0.001","10.1569","0.0006","90","","90","","90","","4908.2","0.4","293","2","293","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","2,2',6,6'-Tetramethyl-4,4'-bipyridine","","- C14 H16 N2 -","- C14 H16 N2 -","- C224 H256 N32 -","16","1","OM2191","Fu, Li-Hai","2,2',6,6'-Tetramethyl-4,4'-bipyridine","Acta Crystallographica Section E","2008","64","1","o127","o127","10.1107/S1600536807063040","","","0.71073","MoKα","","0.0715","0.0514","","","0.1509","0.1645","","","","","","1.057","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2217718","16.6855","0.0003","16.6855","0.0003","21.8961","0.0008","90","","90","","90","","6096","0.3","180","2","180","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","(±)-N-[4-Acetyl-5-methyl-5-(4-methylcyclohex-3-enyl)-4,5-dihydro-\ 1,3,4-thiadiazol-2-yl]acetamide","","- C14 H21 N3 O2 S -","- C14 H21 N3 O2 S -","- C224 H336 N48 O32 S16 -","16","1","BG2164","Mohammed, Tebbaa; Mazoir, Noureddine; Daran, Jean-Claude; Berraho, Moha; Benharref, Ahmed","(±)-<i>N</i>-[4-Acetyl-5-methyl-5-(4-methylcyclohex-3-enyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide","Acta Crystallographica Section E","2008","64","3","o610","o611","10.1107/S1600536808004728","","","0.71073","MoKα","","0.0503","0.0366","","","0.0951","0.1128","","","","","","1.113","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2218187","18.754","0.002","18.754","0.002","15.4395","0.0015","90","","90","","90","","5430.3","1","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Tetrakis(μ~3~-2-{[1,1-bis(hydroxymethyl)-2-oxidoethyl]iminomethyl}- 6-methoxyphenolato)tetranickel(II) tetrahydrate","","- C48 H68 N4 Ni4 O24 -","- C48 H68 N4 Ni4 O24 -","- C192 H272 N16 Ni16 O96 -","4","0.25","LH2612","Guo, Yujing; Li, Lianzhi; Liu, Yan; Dong, Jianfang; Wang, Daqi","Tetrakis(μ~3~-2-{[1,1-bis(hydroxymethyl)-2-oxidoethyl]iminomethyl}-6-methoxyphenolato)tetranickel(II) tetrahydrate","Acta Crystallographica Section E","2008","64","5","m675","m676","10.1107/S1600536808009872","","","0.71073","MoKα","","0.088","0.0655","","","0.1694","0.194","","","","","","1.076","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2218349","19.588","0.003","19.588","0.003","29.877","0.006","90","","90","","90","","11463","3","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Tris[2-(propyliminomethyl)phenolato-κ^2^N,O]cobalt(III)","","- C30 H36 Co N3 O3 -","- C30 H36 Co N3 O3 -","- C480 H576 Co16 N48 O48 -","16","1","CF2198","Li, Sheng; Wang, Shou-Bin; Tang, Kun; Ma, Yuan-Fang","Tris[2-(propyliminomethyl)phenolato-κ^2^<i>N</i>,<i>O</i>]cobalt(III)","Acta Crystallographica Section E","2008","64","6","m823","","10.1107/S1600536808014074","","","0.71073","MoKα","","0.0859","0.0474","","","0.0851","0.0922","","","","","","0.996","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2218637","19.369","0.002","19.369","0.002","30.216","0.003","90","","90","","90","","11336","2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Tris[2-(propyliminomethyl)phenolato-κ^2^<i>N</i>,<i>O</i>]iron(III)","","- C30 H36 Fe N3 O3 -","- C30 H36 Fe N3 O3 -","- C480 H576 Fe16 N48 O48 -","16","1","CF2206","Hao, Lujiang; Mu, Chunhua; Kong, Binbin","Tris[2-(propyliminomethyl)phenolato-κ^2^<i>N</i>,<i>O</i>]iron(III)","Acta Crystallographica Section E","2008","64","7","m955","","10.1107/S1600536808018540","","","0.71073","MoKα","","0.0848","0.0468","","","0.0918","0.0993","","","","","","0.998","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2219540","15.53","0.003","15.53","0.003","25.308","0.002","90","","90","","90","","6103.8","1.7","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","<i>N</i>'-(5-Bromo-2-methoxybenzylidene)-2-hydroxybenzohydrazide","","- C15 H13 Br N2 O3 -","- C15 H13 Br N2 O3 -","- C240 H208 Br16 N32 O48 -","16","1","CI2679","Lu, Jiu-Fu","<i>N</i>'-(5-Bromo-2-methoxybenzylidene)-2-hydroxybenzohydrazide","Acta Crystallographica Section E","2008","64","10","o2048","","10.1107/S1600536808030900","","","0.71073","MoKα","","0.2056","0.0679","","","0.1615","0.2261","","","","","","0.993","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2219941","25.4806","0.0003","25.4806","0.0003","7.3497","0.0002","90","","90","","90","","4771.87","0.15","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","ethyl 3,7-dichloroquinoline-8-carboxylate","Ethyl 3,7-dichloroquinoline-8-carboxylate","","- C12 H9 Cl2 N O2 -","- C12 H9 Cl2 N O2 -","- C192 H144 Cl32 N16 O32 -","16","1","LX2075","Zhu, Fengxia; An, Li-Tao; Xia, Min; Zhou, Jian-Feng","Ethyl 3,7-dichloroquinoline-8-carboxylate","Acta Crystallographica Section E","2008","64","11","o2241","","10.1107/S1600536808034995","","","0.71073","MoKα","","0.0836","0.0429","","","0.1003","0.1169","","","","","","1.055","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2220046","17.313","0.003","17.313","0.003","15.749","0.005","90","","90","","90","","4720.6","1.9","273","2","273","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","<i>N</i>'-[(5-Methylfuran-2-yl)methylene]isonicotinohydrazide","","- C12 H11 N3 O2 -","- C12 H11 N3 O2 -","- C192 H176 N48 O32 -","16","1","AT2662","Liu, Li; Jian, Fang-Fang","<i>N</i>'-[(5-Methylfuran-2-yl)methylene]isonicotinohydrazide","Acta Crystallographica Section E","2008","64","12","o2370","","10.1107/S1600536808037276","","","0.71073","MoKα","","0.0587","0.0411","","","0.1048","0.1167","","","","","","1.042","","","","has coordinates,has Fobs","201978","2020-10-21","18:00:00",""
"2220311","20.0707","0.001","20.0707","0.001","15.438","0.0017","90","","90","","90","","6218.9","0.8","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Poly[[bis[3,10-bis(2-hydroxyethyl)-1,3,5,8,10,12-hexaazacyclotetradecane]tetra- μ-cyanido-tetracyanidodicopper(II)molybdenum(IV)] tetrahydrate]","","- C32 H68 Cu2 Mo N20 O8 -","- C32 H68 Cu2 Mo N20 O8 -","- C128 H272 Cu8 Mo4 N80 O32 -","4","0.25","PV2114","Zhou, Hu; Chen, Ying-Ying; Liu, Wen-Yan; Yuan, Ai-Hua","Poly[bis[3,10-bis(2-hydroxyethyl)-1,3,5,8,10,12-hexaazacyclotetradecane]tetra-μ-cyanido-tetracyanidodicopper(II)molybdenum(IV)] tetrahydrate]","Acta Crystallographica Section E","2008","64","12","m1528","","10.1107/S1600536808036131","","","0.71073","MoKα","","0.058","0.0433","","","0.1034","0.1028","","","","","","1.057","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2220324","22.813","0.002","22.813","0.002","12.0742","0.0016","90","","90","","90","","6283.8","1.1","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","<i>tert</i>-Butyl 4-carbamoyl-3-methoxyimino-4-methylpiperidine-1-carboxylate","","- C13 H23 N3 O4 -","- C13 H23 N3 O4 -","- C208 H368 N48 O64 -","16","1","RZ2260","Wang, Juxian; Liu, Mingliang; Cao, Jue; Wang, Yucheng","<i>tert</i>-Butyl 4-carbamoyl-3-methoxyimino-4-methylpiperidine-1-carboxylate","Acta Crystallographica Section E","2008","64","12","o2294","","10.1107/S1600536808036106","","","0.71073","MoKα","","0.0685","0.0393","","","0.1004","0.1128","","","","","","1.009","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2220914","12.0548","0.0017","12.0548","0.0017","31.899","0.006","90","","90","","90","","4635.5","1.3","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","4-Methyl-2-n-propyl-1<i>H</i>-benzimidazole-6-carboxylic acid","","- C12 H14 N2 O2 -","- C12 H14 N2 O2 -","- C192 H224 N32 O32 -","16","1","SJ2567","Xu, Bing; Yong, Ling; Wang, Dan; Zhang, Ren; Li, Xiang","4-Methyl-2-<i>n</i>-propyl-1<i>H</i>-benzimidazole-6-carboxylic acid","Acta Crystallographica Section E","2009","65","2","o226","","10.1107/S1600536808043420","","","0.71073","MoKα","","0.1131","0.0724","","","0.1726","0.195","","","","","","1.003","","","","has coordinates,has Fobs","201978","2020-10-21","18:00:00",""
"2221092","18.586","0.003","18.586","0.003","15.183","0.003","90","","90","","90","","5244.8","1.6","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","<i>N</i>'-(2-Chloro-5-nitrobenzylidene)isonicotinohydrazide","","- C13 H9 Cl N4 O3 -","- C13 H9 Cl N4 O3 -","- C208 H144 Cl16 N64 O48 -","16","1","HG2481","Zhi, Feng","<i>N</i>'-(2-Chloro-5-nitrobenzylidene)isonicotinohydrazide","Acta Crystallographica Section E","2009","65","3","o623","","10.1107/S1600536809006588","","","0.71073","MoKα","","0.1017","0.0536","","","0.1112","0.1306","","","","","","1.033","","","","has coordinates,has Fobs","201978","2020-10-21","18:00:00",""
"2221474","16.5157","0.0009","16.5157","0.0009","24.401","0.003","90","","90","","90","","6655.8","1","273","2","273","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","<i>N</i>'-(Diphenylmethylene)-2-hydroxybenzohydrazide","","- C20 H16 N2 O2 -","- C20 H16 N2 O2 -","- C320 H256 N32 O32 -","16","1","RK2128","Li, Yanfei; Chen, Chunhua; Yang, Rongdong; Zhao, Rengao","<i>N</i>'-(Diphenylmethylene)-2-hydroxybenzohydrazide","Acta Crystallographica Section E","2009","65","4","o659","","10.1107/S1600536809006916","","","0.71073","MoKα","","0.1149","0.0717","","","0.2178","0.2551","","","","","","1.014","","","","has coordinates,has Fobs","201978","2020-10-21","18:00:00",""
"2221571","12.8282","0.0005","12.8282","0.0005","22.9016","0.0017","90","","90","","90","","3768.7","0.3","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","3-Amino-5-methyl-5-(4-pyridyl)hydantoin","3-amino-5-methyl-5-(4-pyridyl)imidazolidene-2,4-dione","","- C9 H10 N4 O2 -","- C9 H10 N4 O2 -","- C144 H160 N64 O32 -","16","1","AT2752","Varbanov, Hristo; Buyukliev, Rossen; Bakalova, Adriana; Roller, Alexander","3-Amino-5-methyl-5-(4-pyridyl)hydantoin","Acta Crystallographica Section E","2009","65","5","o953","","10.1107/S1600536809011404","","","0.71073","MoKα","","0.0615","0.0455","","","0.117","0.127","","","","","","1.029","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2222217","13.4289","0.0008","13.4289","0.0008","23.127","0.003","90","","90","","90","","4170.6","0.6","291","2","291","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","3,3'-Di-<i>tert</i>-butyl-5,5'-dimethoxybiphenyl-2,2'-diol","","- C22 H30 O4 -","- C22 H30 O4 -","- C176 H240 O32 -","8","0.5","AT2819","Du, Zhong-Xiang; Wang, Ling-Zhi","3,3'-Di-<i>tert</i>-butyl-5,5'-dimethoxybiphenyl-2,2'-diol","Acta Crystallographica Section E","2009","65","7","o1664","","10.1107/S1600536809023071","","","0.71073","MoKα","","0.0531","0.0405","","","0.1013","0.1123","","","","","","1.039","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2222293","16.6224","0.0005","16.6224","0.0005","19.9508","0.0007","90","","90","","90","","5512.5","0.3","295","2","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","<i>N</i>-(2,6-Dimethylphenyl)-4-methylbenzamide","","- C16 H17 N O -","- C16 H17 N O -","- C256 H272 N16 O16 -","16","1","DN2462","Gowda, B. Thimme; Tokarčík, Miroslav; Kožíšek, Jozef; Sowmya, B. P.; Fuess, Hartmut","<i>N</i>-(2,6-Dimethylphenyl)-4-methylbenzamide","Acta Crystallographica Section E","2009","65","7","o1612","","10.1107/S1600536809022648","","","0.71073","MoKα","","0.0998","0.0384","","","0.0946","0.1083","","","","","","0.99","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2222304","28.639","0.005","28.639","0.005","10.15","0.003","90","","90","","90","","8325","3","298","1","298","1","101","2","","","","","","4","I 41/a :2","-I 4ad","88","","<i>N</i>-[3-(2,6-Dimethylanilino)-1-methylbut-2-enylidene]-2,6-dimethylanilinium chloride","","- C21 H27 Cl N2 -","- C21 H27 Cl N2 -","- C336 H432 Cl16 N32 -","16","1","FL2243","Jiménez-Pérez, Víctor M.; Bernès, Sylvain; Munõz, Blanca M.; Kharisov, Boris I.; Vela, Andrea V.","<i>N</i>-[3-(2,6-Dimethylanilino)-1-methylbut-2-enylidene]-2,6-dimethylanilinium chloride","Acta Crystallographica Section E","2009","65","7","o1671","o1672","10.1107/S1600536809020571","","","0.71073","MoKα","","0.1522","0.062","","","0.1393","0.171","","","","","","1.117","","","","has coordinates,has Fobs","201978","2020-10-21","18:00:00",""
"2222645","34.129","0.017","34.129","0.017","14.45","0.006","90","","90","","90","","16831","14","273","2","273","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Aqua(furan-2-carboxylato-κ<i>O</i>)(furan-2-carboxylato- κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) methanol hemisolvate","","- C22.5 H18 Cu N2 O7.5 -","- C22.5 H18 Cu N2 O7.5 -","- C720 H576 Cu32 N64 O240 -","32","2","CV2568","Li, Yanfei; Sun, Junshan; Feng, Shanghua; Xue, Ruigang; Wang, Jun","Aqua(furan-2-carboxylato-κ<i>O</i>)(furan-2-carboxylato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) methanol hemisolvate","Acta Crystallographica Section E","2009","65","8","m858","","10.1107/S1600536809024428","","","0.71073","MoKα","","0.1305","0.055","","","0.1411","0.169","","","","","","0.967","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2223057","18.67","0.003","18.67","0.003","9.057","0.001","90","","90","","90","","3157","0.8","299","2","299","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","<i>o</i>-Toluenesulfonamide","","- C7 H9 N O2 S -","- C7 H9 N O2 S -","- C112 H144 N16 O32 S16 -","16","1","FL2262","Gowda, B. Thimme; Foro, Sabine; Shakuntala, K.; Fuess, Hartmut","<i>o</i>-Toluenesulfonamide: a redetermination","Acta Crystallographica Section E","2009","65","9","o2258","","10.1107/S1600536809033686","","","1.5418","CuKα","","0.0419","0.0388","","","0.0979","0.1006","","","","","","1.07","","","","has coordinates,has Fobs","201978","2020-10-21","18:00:00",""
"2223474","31.3159","0.001","31.3159","0.001","8.1662","0.0005","90","","90","","90","","8008.5","0.6","291","2","291","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Dichlorido(2,9-dipropoxy-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)","","- C18 H20 Cd Cl2 N2 O2 -","- C18 H20 Cd Cl2 N2 O2 -","- C288 H320 Cd16 Cl32 N32 O32 -","16","1","LH2892","Niu, Cao-Yuan; Zheng, Xian-Fu; Dang, Yu-Li","Dichlorido(2,9-dipropoxy-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)","Acta Crystallographica Section E","2009","65","10","m1245","","10.1107/S1600536809038124","","","0.71073","MoKα","","0.0643","0.0385","","","0.0875","0.1014","","","","","","1.015","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2223752","16.6012","0.0015","16.6012","0.0015","20.775","0.002","90","","90","","90","","5725.6","0.9","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Bis(2-hydroxybenzaldehyde oximato-κ<i>O</i>)triphenylantimony(V)","","- C32 H27 N2 O4 Sb -","- C32 H27 N2 O4 Sb -","- C256 H216 N16 O32 Sb8 -","8","0.5","GK2230","Dong, Lei; Yin, Handong; Wen, Liyuan; Wang, Daqi","Bis(2-hydroxybenzaldehyde oximato-κ<i>O</i>)triphenylantimony(V)","Acta Crystallographica Section E","2009","65","11","m1438","","10.1107/S1600536809043542","","","0.71073","MoKα","","0.0632","0.0307","","","0.0641","0.085","","","","","","1.092","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2223809","18.6994","0.0008","18.6994","0.0008","15.7223","0.0012","90","","90","","90","","5497.6","0.5","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","<i>N</i>'-[(<i>E</i>)-4-Hydroxy-3-methoxybenzylidene]benzohydrazide","","- C15 H14 N2 O3 -","- C15 H14 N2 O3 -","- C240 H224 N32 O48 -","16","1","HB5175","Shafiq, Zahid; Yaqub, Muhammad; Tahir, M. Nawaz; Hussain, Abid; Iqbal, M. Saeed","<i>N</i>'-[(<i>E</i>)-4-Hydroxy-3-methoxybenzylidene]benzohydrazide","Acta Crystallographica Section E","2009","65","11","o2898","","10.1107/S1600536809044122","","","0.71073","MoKα","","0.1199","0.0477","","","0.1213","0.151","","","","","","0.993","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2223912","18.021","0.003","18.021","0.003","14.983","0.003","90","","90","","90","","4865.8","1.5","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Ethyl 3-(2,4-dichlorobenzylidene)carbazate","","- C10 H10 Cl2 N2 O2 -","- C10 H10 Cl2 N2 O2 -","- C160 H160 Cl32 N32 O32 -","16","1","LH2929","Li, Yu-Feng; Liu, Hai-Xing; Jian, Fang-Fang","Ethyl 3-(2,4-dichlorobenzylidene)carbazate","Acta Crystallographica Section E","2009","65","11","o2919","","10.1107/S1600536809044420","","","0.71073","MoKα","","0.0518","0.0464","","","0.1175","0.1212","","","","","","1.088","","","","has coordinates,has Fobs","201978","2020-10-21","18:00:00",""
"2224800","5.2545","0.0005","5.2545","0.0005","11.4029","0.0015","90","","90","","90","","314.83","0.06","298","2","298","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Sodium dysprosium(III) bis[tungstate(VI)]","","- Dy Na O8 W2 -","- Dy Na O8 W2 -","- Dy2 Na2 O16 W4 -","2","0.125","WM2287","Zhao, Dan; Li, Feifei; Cheng, Wendan; Zhang, Hao","Scheelite-type NaDy(WO~4~)~2~","Acta Crystallographica Section E","2010","66","1","i2","","10.1107/S1600536809052271","","","0.71073","MoKα","","0.0289","0.0236","","","0.0533","0.0556","","","","","","0.869","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2225068","9.4048","0.0003","9.4048","0.0003","23.685","0.001","90","","90","","90","","2094.94","0.13","299","2","299","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","<i>N</i>-(2,6-Dimethylphenyl)succinimide","","- C12 H13 N O2 -","- C12 H13 N O2 -","- C96 H104 N8 O16 -","8","0.5","NG2713","Saraswathi, B. S.; Gowda, B. Thimme; Foro, Sabine; Fuess, Hartmut","<i>N</i>-(2,6-Dimethylphenyl)succinimide","Acta Crystallographica Section E","2010","66","2","o325","","10.1107/S160053680905555X","","","0.71073","MoKα","","0.0613","0.0576","","","0.1433","0.1501","","","","","","1.106","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2225831","5.1816","0.0008","5.1816","0.0008","11.288","0.003","90","","90","","90","","303.07","0.1","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Sodium erbium bis(molybdate)","","- Er Mo2 Na O8 -","- Er Mo2 Na O8 -","- Er2 Mo4 Na2 O16 -","2","0.125","FB2187","Zhao, Dan; Li, Feifei; Cheng, Wendan; Zhang, Hao","Scheelite-type NaEr(MoO~4~)~2~","Acta Crystallographica Section E","2010","66","5","i36","","10.1107/S160053681001264X","","","0.71073","MoKα","","0.038","0.0323","","","0.0848","0.0885","","","","","","0.84","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2227073","19.5263","0.0005","19.5263","0.0005","17.9952","0.0004","90","","90","","90","","6861.1","0.3","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","(<i>E</i>)-1-(2,5-Dimethyl-3-thienyl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one","","- C18 H20 O4 S -","- C18 H20 O4 S -","- C288 H320 O64 S16 -","16","1","SI2278","Asiri, Abdullah M.; Khan, Salman A.; Tahir, M. Nawaz","(<i>E</i>)-1-(2,5-Dimethyl-3-thienyl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2010","66","8","o2099","","10.1107/S1600536810028709","","","0.71073","MoKα","","0.0632","0.04","","","0.0959","0.1133","","","","","","1.05","","","","has coordinates,has Fobs","201978","2020-10-21","18:00:00",""
"2227270","22.267","0.0009","22.267","0.0009","9.70106","0.0001","90","","90","","90","","4810","0.3","110","2","110","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Tetra-μ~3~-methanolato-tetrakis[(2-formyl-6- methoxyphenolato)methanolnickel(II)]","","- C40 H56 Ni4 O20 -","- C40 H56 Ni4 O20 -","- C160 H224 Ni16 O80 -","4","0.25","BT5390","Ayikoe, Kouassi; Butcher, Ray J.; Gultneh, Yilma","Tetra-μ~3~-methanolato-tetrakis[(2-formyl-6-methoxyphenolato)methanolnickel(II)]","Acta Crystallographica Section E","2010","66","11","m1487","m1488","10.1107/S1600536810043497","","","0.71073","MoKα","","0.0493","0.0315","","","0.0785","0.0809","","","","","","0.991","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2227614","15.186","0.002","15.186","0.002","19.858","0.004","90","","90","","90","","4579.5","1.3","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","(<i>Z</i>)-<i>N</i>-[3-(Phenylsulfonyl)thiazolidin-2-ylidene]cyanamide","","- C10 H9 N3 O2 S2 -","- C10 H9 N3 O2 S2 -","- C160 H144 N48 O32 S32 -","16","1","HG2727","Hou, Jian","(<i>Z</i>)-<i>N</i>-[3-(Phenylsulfonyl)thiazolidin-2-ylidene]cyanamide","Acta Crystallographica Section E","2010","66","11","o2871","","10.1107/S1600536810041371","","","0.71073","MoKα","","0.0498","0.048","","","0.1417","0.143","","","","","","1.255","","","","has coordinates,has Fobs","201978","2020-10-21","18:00:00",""
"2228027","25.5498","0.0002","25.5498","0.0002","9.3792","0.0001","90","","90","","90","","6122.67","0.09","295","2","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","1H-imidazole","4,5-Dimethyl-1,2-diphenyl-1<i>H</i>-imidazole monohydrate","","- C17 H18 N2 O -","- C17 H18 N2 O -","- C272 H288 N32 O16 -","16","1","TK2693","Gayathri, P.; Thiruvalluvar, A.; Saravanan, K.; Jayabharathi, J.; Butcher, R. J.","4,5-Dimethyl-1,2-diphenyl-1<i>H</i>-imidazole monohydrate","Acta Crystallographica Section E","2010","66","9","o2219","","10.1107/S1600536810030072","","","1.54184","CuKα","","0.0494","0.0432","","","0.1287","0.134","","","","","","1.084","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2229787","24.5799","0.0008","24.5799","0.0008","10.9601","0.0006","90","","90","","90","","6621.8","0.5","296","","296","","","","","","","","","6","I 41/a :2","-I 4ad","88","","<i>N</i>-[2-(4-Bromophenyl)-5-methyl-4-oxo-1,3-thiazolidin-3-yl]pyridine-3- carboxamide","","- C16 H14 Br N3 O2 S -","- C16 H14 Br N3 O2 S -","- C256 H224 Br16 N48 O32 S16 -","16","1","OM2414","Akkurt, Mehmet; Çelik, Ísmail; Demir, Hale; Özkırımlı, Sumru; Büyükgüngör, Orhan","<i>N</i>-[2-(4-Bromophenyl)-5-methyl-4-oxo-1,3-thiazolidin-3-yl]pyridine-3-carboxamide","Acta Crystallographica Section E","2011","67","4","o914","o915","10.1107/S1600536811009603","","","0.71073","MoKα","","0.1361","0.0584","","","0.0981","0.1189","","","","","","1.021","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2230744","20.377","0.0001","20.377","0.0001","36.9066","0.0007","90","","90","","90","","15324.4","0.3","100","1","100","1","","","","","","","","4","I 41/a :2","-I 4ad","88","2,2'-(Thiophen-3-ylmethanetriyl)bis(3-hydroxy-5,5-dimethylcyclohex-2-enone)","3-hydroxy-2-[(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)(thiophen- 3-yl)methyl]-5,5-dimethylcyclohex-2-en-1-one","","- C21 H26 O4 S -","- C21 H26 O4 S -","- C672 H832 O128 S32 -","32","2","IS2734","Asad, Mohammad; Oo, Chuan-Wei; Osman, Hasnah; Rosli, Mohd Mustaqim; Fun, Hoong-Kun","3-Hydroxy-2-[(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)(thiophen-3-yl)methyl]-5,5-dimethylcyclohex-2-en-1-one","Acta Crystallographica Section E","2011","67","7","o1813","","10.1107/S160053681102407X","","","0.71073","MoKα","","0.0613","0.0488","","","0.1235","0.1319","","","","","","1.047","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2230759","32.0959","0.0007","32.0959","0.0007","13.7578","0.0005","90","","90","","90","","14172.6","0.7","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","3-(5<i>H</i>-dibenzo[<i>a</i>,<i>d</i>]cyclohepten-5-ylidene)- <i>N</i>,<i>N</i>-dimethylpropanaminium chloride","","- C20 H22 Cl N -","- C20 H22 Cl N -","- C640 H704 Cl32 N32 -","32","2","JH2300","Siddegowda, M. S.; Jasinski, Jerry P.; Golen, James A.; Yathirajan, H. S.; Swamy, M. T.","Cyclobenzaprinium chloride","Acta Crystallographica Section E","2011","67","7","o1846","","10.1107/S1600536811024676","","","0.71073","MoKα","","0.0932","0.0707","","","0.1791","0.1981","","","","","","1.029","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2230801","28.136","0.007","28.136","0.007","7.669","0.002","90","","90","","90","","6071","3","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Di-μ-nitrito-κ^4^<i>O</i>:<i>O</i>-bis[bis(1-ethyl-1<i>H</i>- imidazole-κ<i>N</i>^3^)(nitrito-κ<i>O</i>)copper(II)]","","- C20 H32 Cu2 N12 O8 -","- C20 H32 Cu2 N12 O8 -","- C160 H256 Cu16 N96 O64 -","8","0.5","MW2004","Zhu, Run-Qiang","Di-μ-nitrito-κ^4^<i>O</i>:<i>O</i>-bis[bis(1-ethyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)(nitrito-κ<i>O</i>)copper(II)]","Acta Crystallographica Section E","2011","67","7","m869","","10.1107/S1600536811020745","","","0.71073","MoKα","","0.0535","0.0487","","","0.1234","0.1268","","","","","","1.151","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2231023","16.4706","0.0008","16.4706","0.0008","19.8709","0.0009","90","","90","","90","","5390.6","0.4","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","<i>N</i>-(2,6-Dichlorophenyl)-4-methylbenzamide","","- C14 H11 Cl2 N O -","- C14 H11 Cl2 N O -","- C224 H176 Cl32 N16 O16 -","16","1","BT6816","Rodrigues, Vinola Z.; Foro, Sabine; Gowda, B. Thimme","<i>N</i>-(2,6-Dichlorophenyl)-4-methylbenzamide","Acta Crystallographica Section E","2011","67","8","o2123","","10.1107/S1600536811028935","","","0.71073","MoKα","","0.08","0.0423","","","0.1064","0.1204","","","","","","1.006","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2231407","23.8136","0.001","23.8136","0.001","12.624","0.0009","90","","90","","90","","7158.9","0.7","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","1,7,8,9,10,10-Hexachloro-4-(thiophen-2-ylmethyl)-4- azatricyclo[5.2.1.0^2,6^]dec-8-ene-3,5-dione","","- C14 H7 Cl6 N O2 S -","- C14 H7 Cl6 N O2 S -","- C224 H112 Cl96 N16 O32 S16 -","16","1","BT5586","Manohar, R.; Harikrishna, M.; Ramanathan, C. R.; SureshKumar, M.; Gunasekaran, K.","1,7,8,9,10,10-Hexachloro-4-(thiophen-2-ylmethyl)-4-azatricyclo[5.2.1.0^2,6^]dec-8-ene-3,5-dione","Acta Crystallographica Section E","2011","67","9","o2391","","10.1107/S1600536811032788","","","0.71073","MoKα","","0.0815","0.0371","","","0.068","0.0745","","","","","","0.821","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2231570","13.8502","0.0007","13.8502","0.0007","26.28","0.003","90","","90","","90","","5041.2","0.7","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","<i>cyclo</i>-Tetrakis(μ-3-acetyl-4-methyl-1<i>H</i>-pyrazole-5-carboxylato- κ^4^<i>N</i>^2^,<i>O</i>^3^:<i>N</i>^1^,<i>O</i>^5^)tetrakis[aquacopper(II)] tetradecahydrate","","- C28 H60 Cu4 N8 O30 -","- C28 H60 Cu4 N8 O30 -","- C112 H240 Cu16 N32 O120 -","4","0.25","JH2318","Malinkin, Sergey; Golenya, Irina A.; Pavlenko, Vadim A.; Haukka, Matti; Iskenderov, Turganbay S.","<i>cyclo</i>-Tetrakis(μ-3-acetyl-4-methyl-1<i>H</i>-pyrazole-5-carboxylato-κ^4^<i>N</i>^2^,<i>O</i>^3^:<i>N</i>^1^,<i>O</i>^5^)tetrakis[aquacopper(II)] tetradecahydrate","Acta Crystallographica Section E","2011","67","9","m1260","m1261","10.1107/S1600536811030832","","","0.71073","MoKα","","0.0476","0.0337","","","0.0877","0.0965","","","","","","1.056","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2232004","13.5513","0.0012","13.5513","","24.566","0.003","90","","90","","90","","4511.2","0.7","150","2","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","4-(6-Chloroimidazo[1,2-<i>b</i>]pyridazin-3-yl)benzonitrile","","- C13 H7 Cl N4 -","- C13 H7 Cl N4 -","- C208 H112 Cl16 N64 -","16","1","NG5227","Zhao, Yiliang; Ng, Clarissa K. L.","4-(6-Chloroimidazo[1,2-<i>b</i>]pyridazin-3-yl)benzonitrile","Acta Crystallographica Section E","2011","67","10","o2710","","10.1107/S1600536811037901","","","0.71073","MoKα","","0.072","0.0429","","","0.1236","0.1411","","","","","","1.081","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2232032","23.3474","0.0007","23.3474","0.0007","12.8536","0.0007","90","","90","","90","","7006.5","0.5","295","2","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","2-Methyl-3-{2-nitro-1-[2-(prop-2-yn-1-yloxy)phenyl]ethyl}-1<i>H</i>-indole","","- C20 H18 N2 O3 -","- C20 H18 N2 O3 -","- C320 H288 N32 O48 -","16","1","RK2291","Narayanan, P.; Sethusankar, K.; Ramachandiran, K.; Perumal, P. T.","2-Methyl-3-{2-nitro-1-[2-(prop-2-yn-1-yloxy)phenyl]ethyl}-1<i>H</i>-indole","Acta Crystallographica Section E","2011","67","10","o2658","","10.1107/S1600536811036907","","","0.71073","MoKα","","0.0809","0.0491","","","0.1219","0.1487","","","","","","1.03","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2232402","11.3337","0.0016","11.3337","","8.9121","0.0018","90","","90","","90","","1144.8","0.3","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Poly[tetraaquadi-μ~4~-oxalato-lutetium(III)potassium]","","- C4 H8 K Lu O12 -","- C4 H8 K Lu O12 -","- C16 H32 K4 Lu4 O48 -","4","0.25","NG5233","Zhang, Feng-Ming; Sun, Tao-Zhu; Hou, Guang-Feng; Yan, Peng-Fei; Li, Guang-Ming","Poly[tetraaquadi-μ~4~-oxalato-lutetium(III)potassium]","Acta Crystallographica Section E","2011","67","11","m1591","","10.1107/S1600536811042061","","","0.71073","MoKα","","0.0174","0.0143","","","0.0338","0.0348","","","","","","1.132","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2232768","5.2871","0.0003","5.2871","0.0003","11.5729","0.0007","90","","90","","90","","323.5","0.03","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","sodium neodymium(III) molybdate(VI)","sodium neodymium(III) <i>ortho</i>-oxidomolybdate(vi)","","- Mo2 Na Nd O8 -","- Mo2 Na Nd O8 -","- Mo4 Na2 Nd2 O16 -","2","0.125","HP2019","Schleid, Thomas; Hartenbach, Ingo","Scheelite-type sodium neodymium(III) <i>ortho</i>-oxidomolybdate(VI), NaNd[MoO~4~]~2~","Acta Crystallographica Section E","2011","67","12","i71","","10.1107/S1600536811046976","","","0.71069","MoKα","","0.0343","0.0201","","","0.0389","0.0444","","","","","","0.985","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2232775","11.3502","0.0016","11.3502","0.0016","8.9142","0.0018","90","","90","","90","","1148.4","0.3","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Poly[tetraaquadi-μ~4~-oxalato-potassiumytterbium(III)]","","- C4 H8 K O12 Yb -","- C4 H8 K O12 Yb -","- C16 H32 K4 O48 Yb4 -","4","0.25","HY2482","Zhang, Feng-Ming; Hou, Guang-Feng; Yan, Peng-Fei; Li, Guang-Ming","Poly[tetraaquadi-μ~4~-oxalato-potassiumytterbium(III)]","Acta Crystallographica Section E","2011","67","12","m1719","","10.1107/S1600536811046022","","","0.71073","MoKα","","0.0197","0.0166","","","0.0377","0.039","","","","","","0.94","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2233624","12.8412","0.0002","12.8412","0.0002","27.2647","0.0007","90","","90","","90","","4495.85","0.15","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Poly[[aqua-μ~6~-benzene-1,2,3-tricarboxylato-μ~3~-hydroxido-dizinc] hemihydrate]","","- C9 H7 O8.5 Zn2 -","- C9 H7 O8.5 Zn2 -","- C144 H112 O136 Zn32 -","16","1","SU2346","Ma, Chao-Hong; Liu, Qiang; Wang, Xiu-Yan; Dong, Xian-Wu; Li, Yu-Jie","Poly[[aqua-μ~6~-benzene-1,2,3-tricarboxylato-μ~3~-hydroxido-dizinc] hemihydrate]","Acta Crystallographica Section E","2012","68","2","m103","m104","10.1107/S1600536811055358","","","0.71073","MoKα","","0.0591","0.0348","","","0.0847","0.0895","","","","","","0.937","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2233965","25.3105","0.0004","25.3105","0.0004","6.0995","0.0002","90","","90","","90","","3907.47","0.16","298.6","0.6","298.6","0.6","","","","","","","","3","I 41/a :2","-I 4ad","88","","2,3-Dihydro-1<i>H</i>-cyclopenta[<i>b</i>]naphthalen-1-ol","","- C13 H12 O -","- C13 H12 O -","- C208 H192 O16 -","16","1","QM2052","Çelik, Ísmail; Akkurt, Mehmet; Tutar, Ahmet; Erenler, Ramazan; García-Granda, Santiago","2,3-Dihydro-1<i>H</i>-cyclopenta[<i>b</i>]naphthalen-1-ol","Acta Crystallographica Section E","2012","68","3","o687","","10.1107/S1600536812005181","","","1.5418","CuKα","","0.0485","0.0439","","","0.1196","0.1259","","","","","","1.042","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2234229","19.12","0.009","19.12","0.009","15.421","0.003","90","","90","","90","","5638","4","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","{2-[(2-Aminocyclohexyl)iminomethyl]phenolato}dioxidovanadium(V)","","- C13 H17 N2 O3 V -","- C13 H17 N2 O3 V -","- C208 H272 N32 O48 V16 -","16","1","HB6676","Sun, Xin-Zhi","{2-[(2-Aminocyclohexyl)iminomethyl]phenolato}dioxidovanadium(V)","Acta Crystallographica Section E","2012","68","4","m476","","10.1107/S1600536812011592","","","0.71073","MoKα","","0.1798","0.0992","","","0.1699","0.2025","","","","","","1.078","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2234376","26.17","0.004","26.17","0.004","5.7775","0.0016","90","","90","","90","","3956.8","1.4","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","1-(2-Hydroxyethyl)-3-phenylthiourea","","- C9 H12 N2 O S -","- C9 H12 N2 O S -","- C144 H192 N32 O16 S16 -","16","1","RK2342","Abdelhamid, Antar A.; Mohamed, Shaaban K.; Akkurt, Mehmet; Singh, Kuldip; Potgieter, Herman","1-(2-Hydroxyethyl)-3-phenylthiourea","Acta Crystallographica Section E","2012","68","4","o1162","","10.1107/S160053681201183X","","","0.71073","MoKα","","0.0679","0.0478","","","0.1027","0.1096","","","","","","0.976","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2234672","15.6635","0.0002","15.6635","0.0002","27.1833","0.0006","90","","90","","90","","6669.29","0.19","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Tetrakis[μ~3~-4-nitro-<i>N</i>-(5-phenyl-1,3,4-oxadiazol-2- yl)benzamidato]tetrakis[methanolsodium(I)]","","- C64 H52 N16 Na4 O20 -","- C64 H52 N16 Na4 O20 -","- C256 H208 N64 Na16 O80 -","4","0.25","HP2035","Yin, Guo-Jie; Zhang, Qing; Li, Dong","Tetrakis[μ~3~-4-nitro-<i>N</i>-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamidato]tetrakis[methanolsodium(I)]","Acta Crystallographica Section E","2012","68","5","m570","","10.1107/S1600536812014791","","","0.71073","MoKα","","0.0564","0.0399","","","0.0968","0.1057","","","","","","1.023","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2235233","21.196","0.011","21.196","0.011","11.581","0.007","90","","90","","90","","5203","5","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Tetra-μ~3~-iodido-tetrakis{[ethyl 2-(1<i>H</i>-benzimidazol-1-yl)acetate-κ<i>N</i>^3^]copper(I)}","","- C44 H48 Cu4 I4 N8 O8 -","- C44 H48 Cu4 I4 N8 O8 -","- C176 H192 Cu16 I16 N32 O32 -","4","0.25","RZ2757","Yang, Lili; Zhang, Zhengyi","Tetra-μ~3~-iodido-tetrakis{[ethyl 2-(1<i>H</i>-benzimidazol-1-yl)acetate-κ<i>N</i>^3^]copper(I)}","Acta Crystallographica Section E","2012","68","6","m796","","10.1107/S160053681202257X","","","0.71073","MoKα","","0.0331","0.0232","","","0.0498","0.0533","","","","","","1.034","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2235245","21.407","0.002","21.407","0.002","13.626","0.003","90","","90","","90","","6244.2","1.6","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","<i>cyclo</i>-Tetrakis{μ-<i>N</i>'-[(8-oxidoquinolin-7- yl)methylidene]isonicotinohydrazidato}tetrazinc tetrahydrate","","- C64 H48 N16 O12 Zn4 -","- C64 H48 N16 O12 Zn4 -","- C256 H192 N64 O48 Zn16 -","4","0.25","SU2415","Wu, Xiang-Wen; Li, Qing-Long; Ma, Jian-Ping; Dong, Yu-Bin","<i>cyclo</i>-Tetrakis{μ-<i>N</i>'-[(8-oxidoquinolin-7-yl)methylidene]isonicotinohydrazidato}tetrazinc tetrahydrate","Acta Crystallographica Section E","2012","68","6","m727","m728","10.1107/S1600536812018995","","","0.71073","MoKα","","0.0505","0.036","","","0.0802","0.0868","","","","","","1.03","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2236456","22.902","0.0006","22.902","0.0006","18.326","0.0006","90","","90","","90","","9612","0.5","296","2","296","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","5-Chloro-<i>N</i>-{4-oxo-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl}-\ 3-phenyl-1<i>H</i>-indole-2-carboxamide","","- C25 H17 Cl F3 N3 O2 S -","- C25 H17 Cl F3 N3 O2 S -","- C400 H272 Cl16 F48 N48 O32 S16 -","16","1","LH5532","Akkurt, Mehmet; Çelik, İsmail; Gürbüzel, Füsun Kazan; Özkırımlı, Sumru; Büyükgüngör, Orhan","5-Chloro-<i>N</i>-{4-oxo-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl}-3-phenyl-1<i>H</i>-indole-2-carboxamide","Acta Crystallographica Section E","2012","68","10","o2969","o2970","10.1107/S1600536812039347","","","0.71073","MoKα","","0.1314","0.0731","","","0.1807","0.2095","","","","","","1.052","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2236773","16.591","0.0006","16.591","0.0006","9.7939","0.0003","90","","90","","90","","2695.88","0.16","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","4-Morpholinecarboxamidine","","- C5 H11 N3 O -","- C5 H11 N3 O -","- C80 H176 N48 O16 -","16","1","ZL2510","Tiritiris, Ioannis","4-Morpholinecarboxamidine","Acta Crystallographica Section E","2012","68","11","o3118","","10.1107/S1600536812042201","","","0.71073","MoKα","","0.0497","0.0371","","","0.0839","0.0905","","","","","","1.062","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2236991","26.991","0.007","26.991","0.007","7.8345","0.0019","90","","90","","90","","5708","3","111","2","111","2","","","","","","","","6","I 41/a :2","-I 4ad","88","N-Tosyl-5-chloroindole","5-Chloro-1-(4-methylphenylsulfonyl)-1<i>H</i>-indole","","- C15 H12 Cl N O2 S -","- C15 H12 Cl N O2 S -","- C240 H192 Cl16 N16 O32 S16 -","16","1","PV2597","Hassam, Mohammad; Smith, Vincent J.","5-Chloro-1-(4-methylphenylsulfonyl)-1<i>H</i>-indole","Acta Crystallographica Section E","2012","68","12","o3357","","10.1107/S1600536812046466","","","0.71073","MoKα","","0.0559","0.0386","","","0.0919","0.1007","","","","","","1.056","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2237422","5.3599","0.0003","5.3599","0.0003","11.9425","0.0007","90","","90","","90","","343.09","0.03","293","2","293","2","","","","","","","","3","I 41/a :2","-I 4ad","88","lanthanum(III) molybdate(VI)","Lanthanum(III) <i>ortho</i>-tetraoxidomolybdate(VI)","","- La0.667 Mo O4 -","- La0.6676 Mo O4 -","- La2.6704 Mo4 O16 -","4","0.25","WM2715","Schustereit, Tanja; Schleid, Thomas; Hartenbach, Ingo","The defect scheelite-type lanthanum(III) <i>ortho</i>-oxidomolybdate(VI) La~0.667~[MoO~4~]","Acta Crystallographica Section E","2013","69","2","i7","","10.1107/S1600536813000731","","","0.71073","MoKα","","0.0339","0.0162","","","0.0289","0.0322","","","","","","0.982","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237534","19.7898","0.0008","19.7898","0.0008","12.4416","0.0011","90","","90","","90","","4872.6","0.5","295","","295","","","","","","","","","5","I 41/a :2","-I 4ad","88","","<i>N</i>-[(1<i>E</i>)-5-(3-Chlorophenyl)-3-methylcyclohex-2-en-1-ylidene]hydroxylamine","","- C13 H14 Cl N O -","- C13 H14 Cl N O -","- C208 H224 Cl16 N16 O16 -","16","1","NK2191","Ganesh, G.; Murugavel, K.; Kannan, P. S.; Amirthaganesan, S.; SubbiahPandi, A.","<i>N</i>-[(1<i>E</i>)-5-(3-Chlorophenyl)-3-methylcyclohex-2-en-1-ylidene]hydroxylamine","Acta Crystallographica Section E","2013","69","3","o449","","10.1107/S1600536813004698","","","0.71073","MoKα","","0.1024","0.0803","","","0.2168","0.2417","","","","","","1.053","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2238196","15.4435","0.0002","15.4435","0.0002","21.0395","0.0003","90","","90","","90","","5017.96","0.12","100","1","100","1","","","","","","","","4","I 41/a :2","-I 4ad","88","","2-Amino-4-methylpyridinium 3-hydroxybenzoate","","- C13 H14 N2 O3 -","- C13 H14 N2 O3 -","- C208 H224 N32 O48 -","16","1","IS5282","Khalib, Nuridayanti Che; Thanigaimani, Kaliyaperumal; Arshad, Suhana; Razak, Ibrahim Abdul","2-Amino-4-methylpyridinium 3-hydroxybenzoate","Acta Crystallographica Section E","2013","69","7","o1120","","10.1107/S1600536813016310","","","0.71073","MoKα","","0.0726","0.0596","","","0.1237","0.1298","","","","","","1.095","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238681","14.6401","0.0002","14.6401","0.0002","17.7899","0.0003","90","","90","","90","","3812.95","0.1","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Dichloridodiphenylbis(thiourea-κ<i>S</i>)tin(IV)","","- C14 H18 Cl2 N4 S2 Sn -","- C14 H18 Cl2 N4 S2 Sn -","- C112 H144 Cl16 N32 S16 Sn8 -","8","0.5","WM2764","Sow, Yaya; Diop, Libasse; Molloy, Kieran C.; Kociok-Köhn, Gabriele","Dichloridodiphenylbis(thiourea-κ<i>S</i>)tin(IV)","Acta Crystallographica Section E","2013","69","10","m539","m540","10.1107/S1600536813024343","","","0.71073","MoKα","","0.0259","0.0193","","","0.0476","0.0513","","","","","","1.059","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238852","15.8871","0.0001","15.8871","0.0001","15.93","0.0002","90","","90","","90","","4020.73","0.06","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","2,2,2-Trifluoro-<i>N</i>-(2-iodophenyl)acetamide","","- C8 H5 F3 I N O -","- C8 H5 F3 I N O -","- C128 H80 F48 I16 N16 O16 -","16","1","FF2122","Ruchun, Yang; Hui, Zhang; BanPeng, Cao","2,2,2-Trifluoro-<i>N</i>-(2-iodophenyl)acetamide","Acta Crystallographica Section E","2013","69","12","o1749","","10.1107/S1600536813029851","","","0.71073","MoKα","","0.0788","0.0437","","","0.0833","0.1046","","","","","","1.059","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2239073","20.5587","0.0014","20.5587","0.0014","18.01","0.002","90","","90","","90","","7612.1","1.1","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Tetrakis(μ~3~-2-{[1,1-bis(hydroxymethyl)-2-oxidoethyl]iminomethyl}-6-nitrophenolato)tetracopper(II)","","- C44 H48 Cu4 N8 O24 -","- C44 H48 Cu4 N8 O24 -","- C176 H192 Cu16 N32 O96 -","4","0.25","","Chygorin, Eduard N.; Smal, Yuri O.; Kokozay, Vladimir N.; Omelchenko, Irina V.","Tetrakis(μ~3~-2-{[1,1-bis(hydroxymethyl)-2-oxidoethyl]iminomethyl}-6-nitrophenolato)tetracopper(II)","Acta Crystallographica Section E","2014","70","2","m54","m55","10.1107/S1600536814000798","","","0.71073","MoKα","","0.1551","0.0752","","","0.1563","0.1844","","","","","","0.801","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2239464","12.578","0.0011","12.578","0.0011","25.053","0.003","90","","90","","90","","3963.5","0.7","173","2","173","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","Tetrakis(2,3,5,5-tetramethylhexen-2-yl)silane","","- C40 H76 Si -","- C40 H76 Si -","- C160 H304 Si4 -","4","0.25","ZS2287","Meyer-Wegner, Frank; Bolte, Michael; Lerner, Hans-Wolfram","Tetrakis(2,3,5,5-tetramethylhexen-2-yl)silane","Acta Crystallographica Section E","2014","70","3","o376","","10.1107/S1600536814004322","","","0.71073","MoKα","","0.0723","0.0511","","","0.1266","0.1359","","","","","","1.081","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2240632","19.221","0.003","19.221","","10.5812","0.0018","90","","90","","90","","3909.2","0.9","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","3-Methyl-5-trimethylsilyl-1<i>H</i>-pyrazole","","- C7 H14 N2 Si -","- C7 H14 N2 Si -","- C112 H224 N32 Si16 -","16","1","ZL2621","Ferrence, Gregory M.; Kocher, Joshua L.","Crystal structure of 3-methyl-5-trimethylsilyl-1<i>H</i>-pyrazole","Acta Crystallographica Section E","2015","71","6","o397","","10.1107/S2056989015008567","","","0.71073","MoKα","","0.0646","0.0461","","","","0.1211","","","","","","1.106","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2241097","18.7108","0.0003","18.7108","0.0003","15.38","0.0003","90","","90","","90","","5384.45","0.16","200","2","200","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Tetrakis(μ~3~-2-{[1,1-bis(hydroxymethyl)-2-oxidoethyl]iminomethyl}-6-methoxyphenolato)tetrakis[aquacopper(II)]","","- C48 H68 Cu4 N4 O24 -","- C48 H68 Cu4 N4 O24 -","- C192 H272 Cu16 N16 O96 -","4","0.25","SJ5474","Buvaylo, Elena A.; Vassilyeva, Olga Yu.; Skelton, Brian W.","Crystal structure of tetrakis(μ~3~-2-{[1,1-bis(hydroxymethyl)-2-oxidoethyl]iminomethyl}-6-methoxyphenolato)tetrakis[aquacopper(II)]: a redetermination at 200K","Acta Crystallographica Section E","2015","71","10","1203","1206","10.1107/S2056989015017314","","","0.71073","MoKα","","0.0832","0.0763","","","0.1905","0.1951","","","","","","1.119","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"2242257","5.3325","0.0001","5.3325","0.0001","11.8503","0.0003","90","","90","","90","","336.97","0.012","296","2","296","2","","","","","","","","3","I 41/a :2","-I 4ad","88","sodium pertechnetate","Sodium tetraoxidotechnetate(VII)","","- Na O4 Tc -","- Na O4 Tc -","- Na4 O16 Tc4 -","4","0.25","WM5391","German, Konstantin E.; Grigoriev, Mikhail S.; Garashchenko, Bogdan L.; Kopytin, Alexander V.; Tyupina, Ekaterina A.","Redetermination of the crystal structure of NaTcO~4~ at 100 and 296K based on single-crystal X-ray data","Acta Crystallographica Section E","2017","73","7","1037","1040","10.1107/S2056989017008362","","","0.71073","MoKα","","0.0087","0.0081","","","0.0184","0.0186","","","","","","1.161","","","","has coordinates,has Fobs","199215","2020-10-21","18:00:00",""
"2243307","9.2846","0.0007","9.2846","0.0007","38.069","0.004","90","","90","","90","","3281.7","0.5","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Bis(4'-chloro-2,2':6',2''-terpyridyl)cobalt(II) dichloride tetrahydrate","","- C30 H28 Cl4 Co N6 O4 -","- C30 H28 Cl4 Co N6 O4 -","- C120 H112 Cl16 Co4 N24 O16 -","4","0.25","HB7878","Thippeswamy, B.; Suchetan, P. A.; Mahadevan, K. M.; Nagabhushana, H.; Vijayakumar, G. R.","Crystal structure and photoluminescent properties of bis(4'-chloro-2,2':6',2''-terpyridyl)cobalt(II) dichloride tetrahydrate","Acta Crystallographica Section E","2020","76","4","496","499","10.1107/S205698902000287X","","","0.71073","MoKα","","0.0604","0.0438","","","0.118","0.1274","","","","","","1.075","","","","has coordinates,has Fobs","249115","2020-10-21","18:00:00",""
"2244121","11.6365","0.0003","11.6365","0.0003","16.304","0.0004","90","","90","","90","","2207.69","0.1","300","2","300","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Nonastrontium dilanthanum tetrakis[orthotungstate(VI)]","","- La2 O24 Sr9 W4 -","- La2.0002 O24 Sr8.9998 W4 -","- La8.0008 O96 Sr35.9992 W16 -","4","0.25","WM5650","Simura, Rayko; Watanabe, Tomoki; Yamane, Hisanori","Sr~9~La~2~(WO~6~)~4~ containing [WO~6~] octahedra","Acta Crystallographica Section E","2022","78","8","","","10.1107/S2056989022006648","","","0.71073","MoKα","","0.028","0.0252","","","0.0458","0.0464","","","","","","1.366","","","","has coordinates,has Fobs","276583","2022-07-06","01:49:36",""
"2244224","27.7071","0.0011","27.7071","0.0011","9.4575","0.0004","90","","90","","90","","7260.4","0.5","193","2","193","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","<i>N</i>,<i>N</i>'-Diphenyl-2-[1-(propylamino)ethylidene]propanediamide","","- C20 H23 N3 O2 -","- C20 H23 N3 O2 -","- C320 H368 N48 O32 -","16","1","PK2679","Herbig, Marcus; Böhme, Uwe","Two polymorphs of <i>N</i>,<i>N</i>'-diphenyl-2-[1-(propyl-amino)-ethyl-idene]propanedi-amide.","Acta crystallographica. Section E, Crystallographic communications","2023","79","Pt 4","308","312","10.1107/S2056989023002141","","","0.71073","MoKα","","0.0851","0.0516","","","0.1113","0.1321","","","","","","1.067","","","","has coordinates,has disorder,has Fobs","283580","2023-05-06","10:45:35",""
"2300126","21.5111","0.0007","21.5111","0.0007","13.2377","0.0009","90","","90","","90","","6125.4","0.5","298","2","298","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C20 H14 N2 O -","- C20 H14 N2 O -","- C320 H224 N32 O16 -","16","1","KK5009","Zeng, He-Ping; Wang, Ting-Ting; Xu, Dan-Feng; Cai, Yue-Peng; Chen, Dong-Feng","Synthesis, crystal structure and biological activity of 2-[2-(quinolin-2-yl)vinyl]-8-hydroxyquinoline and 2-[2-(quinolin-4-yl)vinyl]-8-hydroxyquinoline","Journal of Applied Crystallography","2007","40","3","471","475","10.1107/S0021889807007704","","","0.71073","MoKα","","0.1103","0.0534","","","0.1359","0.1682","","","","","","1.002","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2300196","5.2039","0.0002","5.2039","0.0002","11.2838","0.0009","90","","90","","90","","305.57","0.03","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- Na O8 W2 Y0.95 Yb0.05 -","- Na O8 W2 Y0.95 Yb0.05 -","- Na2 O16 W4 Y1.9 Yb0.1 -","2","0.125","AJ5103","Fan, Jiandong; Zhang, Huaijin; Yu, Wentao; Yu, Haohai; Wang, Jiyang; Jiang, Minhua","A Yb^3+^-doped NaY(WO~4~)~2~ crystal grown by the Czochralski technique","Journal of Applied Crystallography","2008","41","3","584","591","10.1107/S0021889808008649","","","0.71073","MoKα","","0.0306","0.0279","","","0.0636","0.0645","","","","","","1.23","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2300457","5.50729","0.00009","5.50729","","12.4789","0.0004","90","","90","","90","","378.488","0.014","298","","298","","","","","","","","Scheelite","4","I 41/a :2","-I 4ad","88","Barium strontium molybdate","","","- Ba0.41 Mo O4 Sr0.59 -","- Ba0.40845 Mo O4 Sr0.59155 -","- Ba1.6338 Mo4 O16 Sr2.3662 -","4","0.25","AJ5215","Nogueira, I. C.; Cavalcante, L. S.; Pereira, P. F. S.; de Jesus, M. M.; Rivas Mercury, J. M.; Batista, N. C.; Li, M. Siu; Longo, E.","Rietveld refinement, morphology and optical properties of (Ba~1{-~<i>x</i>}Sr<i>~x~</i>)MoO~4~ crystals","Journal of Applied Crystallography","2013","46","5","1434","1446","10.1107/S0021889813020335","powder diffraction","x-ray","1.5405","CuKα","","0.0609","0.0485","","","0.0835","","0.03355","","1.72","","","1.37","","","","has coordinates","264551","2021-04-26","18:28:38",""
"2300458","5.54906","0.00005","5.54906","","12.66803","0.00022","90","","90","","90","","390.075","0.008","298","","298","","","","","","","","Scheelite","4","I 41/a :2","-I 4ad","88","Barium strontium molybdate","","","- Ba0.73 Mo O4 Sr0.27 -","- Ba0.727 Mo O4 Sr0.273 -","- Ba2.908 Mo4 O16 Sr1.092 -","4","0.25","AJ5215","Nogueira, I. C.; Cavalcante, L. S.; Pereira, P. F. S.; de Jesus, M. M.; Rivas Mercury, J. M.; Batista, N. C.; Li, M. Siu; Longo, E.","Rietveld refinement, morphology and optical properties of (Ba~1{-~<i>x</i>}Sr<i>~x~</i>)MoO~4~ crystals","Journal of Applied Crystallography","2013","46","5","1434","1446","10.1107/S0021889813020335","powder diffraction","x-ray","1.5405","CuKα","","0.0658","0.0555","","","0.0898","","0.03415","","1.83","","","1.36","","","","has coordinates","264551","2021-04-26","18:28:39",""
"2300459","5.584828","0.000021","5.584828","","12.82922","0.00009","90","","90","","90","","400.147","0.003","298","","298","","","","","","","","Scheelite","3","I 41/a :2","-I 4ad","88","Barium molybdate","","","- Ba Mo O4 -","- Ba Mo O4 -","- Ba4 Mo4 O16 -","4","0.25","AJ5215","Nogueira, I. C.; Cavalcante, L. S.; Pereira, P. F. S.; de Jesus, M. M.; Rivas Mercury, J. M.; Batista, N. C.; Li, M. Siu; Longo, E.","Rietveld refinement, morphology and optical properties of (Ba~1{-~<i>x</i>}Sr<i>~x~</i>)MoO~4~ crystals","Journal of Applied Crystallography","2013","46","5","1434","1446","10.1107/S0021889813020335","powder diffraction","x-ray","1.5405","CuKα","","0.0656","0.0555","","","0.092","","0.04185","","1.66","","","1.4","","","","has coordinates","264551","2021-04-26","18:28:39",""
"2300460","5.402647","0.000022","5.402647","","12.04112","0.00008","90","","90","","90","","351.463","0.003","298","","298","","","","","","","","Scheelite","3","I 41/a :2","-I 4ad","88","Strontium molybdate","","","- Mo O4 Sr -","- Mo O4 Sr -","- Mo4 O16 Sr4 -","4","0.25","XX","Nogueira, I. C.; Cavalcante, L. S.; Pereira, P. F. S.; de Jesus, M. M.; Rivas Mercury, J. M.; Batista, N. C.; Li, M. Siu; Longo, E.","Rietveld refinement, morphology and optical properties of (Ba~1{-~<i>x</i>}Sr<i>~x~</i>)MoO~4~ crystals","Journal of Applied Crystallography","2013","46","5","1434","1446","10.1107/S0021889813020335","powder diffraction","x-ray","1.5405","CuKα","","0.0483","0.0462","","","0.0701","","0.02266","","1.52","","","1.45","","","","has coordinates","264551","2021-04-26","18:28:39",""
"2300461","5.45711","0.00005","5.45711","","12.25476","0.00023","90","","90","","90","","364.947","0.008","298","","298","","","","","","","","Scheelite","4","I 41/a :2","-I 4ad","88","Barium strontium molybdate","","","- Ba0.19 Mo O4 Sr0.81 -","- Ba0.19285 Mo O4 Sr0.80715 -","- Ba0.7714 Mo4 O16 Sr3.2286 -","4","0.25","AJ5215","Nogueira, I. C.; Cavalcante, L. S.; Pereira, P. F. S.; de Jesus, M. M.; Rivas Mercury, J. M.; Batista, N. C.; Li, M. Siu; Longo, E.","Rietveld refinement, morphology and optical properties of (Ba~1{-~<i>x</i>}Sr<i>~x~</i>)MoO~4~ crystals","Journal of Applied Crystallography","2013","46","5","1434","1446","10.1107/S0021889813020335","powder diffraction","x-ray","1.5405","CuKα","","0.0629","0.0447","","","0.0859","","0.02686","","1.92","","","1.37","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2300576","11.6416","0.0004","11.6416","0.0004","16.4524","0.0009","90","","90","","90","","2229.74","0.16","473","","473","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Mo4 O23.12 Sr11 -","- Mo4 O23.12 Sr11 -","- Mo16 O92.48 Sr44 -","4","0.25","","López, Carlos A.; Pedregosa, José C.; Fernández-Díaz, María T.; Alonso, José A.","High-temperature dynamic octahedral tilting in the ionic conductor Sr~11~Mo~4~O~23~","Journal of Applied Crystallography","2016","49","1","78","84","10.1107/S160057671502261X","powder diffraction","","1.594","ConstantWavelengthNeutronDiffraction","","","","","","","","","8.5682","3.5825","","","","","","","has coordinates,has Fobs","176657","2020-10-21","18:00:00",""
"2300577","11.6696","0.0004","11.6696","0.0004","16.4869","0.0009","90","","90","","90","","2245.18","0.16","673","","673","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Mo4 O23.16 Sr11 -","- Mo4 O23.16 Sr11 -","- Mo16 O92.64 Sr44 -","4","0.25","","López, Carlos A.; Pedregosa, José C.; Fernández-Díaz, María T.; Alonso, José A.","High-temperature dynamic octahedral tilting in the ionic conductor Sr~11~Mo~4~O~23~","Journal of Applied Crystallography","2016","49","1","78","84","10.1107/S160057671502261X","powder diffraction","","1.594","ConstantWavelengthNeutronDiffraction","","","","","","","","","7.0763","3.1381","","","","","","","has coordinates,has Fobs","176657","2020-10-21","18:00:00",""
"2300578","11.7075","0.0003","11.7075","0.0003","16.5548","0.0008","90","","90","","90","","2269.09","0.14","873","","873","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Mo4 O21.84 Sr11 -","- Mo4 O21.84 Sr11 -","- Mo16 O87.36 Sr44 -","4","0.25","","López, Carlos A.; Pedregosa, José C.; Fernández-Díaz, María T.; Alonso, José A.","High-temperature dynamic octahedral tilting in the ionic conductor Sr~11~Mo~4~O~23~","Journal of Applied Crystallography","2016","49","1","78","84","10.1107/S160057671502261X","powder diffraction","","1.594","ConstantWavelengthNeutronDiffraction","","","","","","","","","11.1079","2.9203","","","","","","","has coordinates,has Fobs","176657","2020-10-21","18:00:00",""
"2300579","11.7466","0.0003","11.7466","0.0003","16.6088","0.0008","90","","90","","90","","2291.73","0.14","1073","","1073","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Mo4 O21.92 Sr11 -","- Mo4 O21.92 Sr11 -","- Mo16 O87.68 Sr44 -","4","0.25","","López, Carlos A.; Pedregosa, José C.; Fernández-Díaz, María T.; Alonso, José A.","High-temperature dynamic octahedral tilting in the ionic conductor Sr~11~Mo~4~O~23~","Journal of Applied Crystallography","2016","49","1","78","84","10.1107/S160057671502261X","powder diffraction","","1.594","ConstantWavelengthNeutronDiffraction","","","","","","","","","10.7211","2.651","","","","","","","has coordinates,has Fobs","176657","2020-10-21","18:00:00",""
"2310359","14.884","","14.884","","6.547","","90","","90","","90","","1450.38","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Li U F5","","- F5 Li U -","- F5 Li U -","- F80 Li16 U16 -","16","1","","Brunton, G.","The Crystal Structure of Li U F5","Acta Crystallographica (1,1948-23,1967)","1966","21","","814","817","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2311028","9.16","","9.16","","18.167","","90","","90","","90","","1524.31","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","K3 (U O2) F5","","- F5 K3 O2 U -","- F5 K3 O2 U -","- F40 K24 O16 U8 -","8","0.5","","Zachariasen, W.H.","Crystal chemical studies of the 5f-Series of elements. XX. The crystal structure of tri-potassium uranyl fluoride","Acta Crystallographica (1,1948-23,1967)","1954","7","","783","787","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2311030","9.22","","9.22","","18.34","","90","","90","","90","","1559.05","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","K3 (U F7)","","- F7 K3 U -","- F7 K3 U -","- F56 K24 U8 -","8","0.5","","Zachariasen, W.H.","Crystal chemical studies of the 5f-series of elements. XXII. The crystal structure of K3 U F7","Acta Crystallographica (1,1948-23,1967)","1954","7","","792","794","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2311035","15.82","","15.82","","5.72","","90","","90","","90","","1431.56","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","C O Cl2","","- C Cl2 O -","- C Cl2 O -","- C16 Cl32 O16 -","16","1","","Zaslow, B.; Atoji, M.; Lipscomb, W.N.","The Crystal Structure of Phosgene, C O Cl2","Acta Crystallographica (1,1948-23,1967)","1952","5","","833","837","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2311236","26.7145","0.0014","26.7145","0.0014","10.116","0.0005","90","","90","","90","","7219.4","0.6","150","2","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","<i>N</i>-(2-{<i>N</i>'-[(1<i>E</i>)-2-Hydroxybenzylidene]hydrazinecarbonyl}phenyl)benzamide","","- C21 H17 N3 O3 -","- C21 H17 N3 O3 -","- C336 H272 N48 O48 -","16","1","XU5789","Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Potgieter, Herman; Albayati, Mustafa R.","A new polymorph of N-(2-{N'-[(1E)-2-hy-droxy-benzyl-idene]hydrazinecarbon-yl}phen-yl)benzamide.","Acta crystallographica. Section E, Structure reports online","2014","70","Pt 6","o645","6","10.1107/S1600536814010010","","","0.71073","MoKα","","0.0681","0.0456","","","0.0938","0.1074","","","","","","1.04","","","","has coordinates","245709","2020-10-21","18:00:00",""
"2311594","9.544","0.002","9.544","0.002","23.361","0.005","90","","90","","90","","2127.9","0.8","250","2","250","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Triaqua(4-chloropyridine-2,6-dicarboxylato)nickel(II)","","- C7 H8 Cl N Ni O7 -","- C7 H8 Cl N Ni O7 -","- C56 H64 Cl8 N8 Ni8 O56 -","8","0.5","WM5493","Kremer, Marius; Englert, Ulli","Zn and Ni complexes of pyridine-2,6-di-carboxyl-ates: crystal field stabilization matters!","Acta crystallographica. Section E, Crystallographic communications","2019","75","Pt 6","903","911","10.1107/S2056989019007461","","","0.71073","MoKα","","0.0577","0.0501","","","0.1245","0.1274","","","","","","1.143","","","","has coordinates,has disorder","246005","2020-10-21","18:00:00",""
"2311847","16.2034","0.0014","16.2034","","28.698","0.002","90","","90","","90","","7534.7","0.8","100","2","100","2","","","","","","","","7","I 41/a :2","-I 4ad","88","Ni_TFDIB","<i>trans</i>-Tetrakis(4-vinylpyridine-κ<i>N</i>)bis(thiocyanato-κ<i>N</i>)nickel(II)‒2,3,5,6-tetrafluoro-1,4-diiodobenzene (1/1)","","- C36 H28 F4 I2 N6 Ni S2 -","- C36 H28 F4 I2 N6 Ni S2 -","- C288 H224 F32 I16 N48 Ni8 S16 -","8","0.5","YP3107","Şerb, Mihaela-Diana; Merkens, Carina; Kalf, Irmgard; Englert, Ulli","Halogen bonds on demand: I···S contacts in cocrystals of trans-bis(thiocyanato-κN)tetrakis(4-vinylpyridine-κN)nickel(II) and 2,3,5,6-tetrafluoro-1,4-diiodobenzene.","Acta crystallographica. Section C, Structural chemistry","2015","71","Pt 11","991","995","10.1107/S2053229615019002","","","0.71073","MoKα","","0.0549","0.0359","","","0.0691","0.0772","","","","","","1.03","","","","has coordinates","246136","2020-10-21","18:00:00",""
"3500130","26.1308","0.0002","26.1308","0.0002","5.4539","0.0001","90","","90","","90","","3724.02","0.08","150","","150.15","","","","","","","","","3","I 41/a :2","-I 4ad","88","tetrakis[(3,5-dimethoxybenzyloxy) methyl]methane","","","- C41 H52 O12 -","- C41 H52 O12 -","- C164 H208 O48 -","4","0.25","","Maris, Thierry; Laliberté, Dominic; Wuest, James D.","tetrakis[(3,5-dimethoxybenzyloxy) methyl]methane","Personal communication to COD","2022","","","","","","","","1.54178","CuKα","","0.0388","0.0312","","","0.0755","0.0807","","","","","","1.035","","","","has coordinates,has Fobs","278488","2022-10-07","17:24:24",""
"4000114","17.221","0.0007","17.221","0.0007","40.9649","0.0017","90","","90","","90","","12148.7","0.9","223","2","223","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C26 H33.5 Cl2 Cu N4 O2.75 -","- C26 H28 Cl2 Cu N4 O2.75 -","- C416 H448 Cl32 Cu16 N64 O44 -","16","1","","","","Chemistry of Materials","2002","","","","","10.1021/cm011235s","","","0.71073","MoKα","","0.121","0.0991","","0.2678","0.2555","","","","1.059","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4000430","16.994","0.004","16.994","0.004","11.133","0.003","90","","90","","90","","3215.3","1.5","168","2","168","2","","","","","","","","4","I 41/a :2","-I 4ad","88","(5) Zn4(OMBuc)4(Et)4","","","- C28 H56 O4 Zn4 -","- C28 H56 O4 Zn4 -","- C112 H224 O16 Zn16 -","4","0.25","","","","Chemistry of Materials","2004","","","","","10.1021/cm0493997","","","0.71073","MoKα","","0.0372","0.0277","","","0.0624","0.0665","","","","","","1.072","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000444","17.491","0.005","17.491","0.005","11.197","0.004","90","","90","","90","","3425.7","1.7","168","2","168","2","","","","","","","","4","I 41/a :2","-I 4ad","88","(13) Zn4(OTHF)4(Et)4","","","- C28 H56 O8 Zn4 -","- C28 H56 O8 Zn4 -","- C112 H224 O32 Zn16 -","4","0.25","","","","Chemistry of Materials","2004","","","","","10.1021/cm0493997","","","0.71073","MoKα","","0.1062","0.0868","","","0.2291","0.2527","","","","","","1.056","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001277","16.7862","0.0002","16.7862","0.0002","21.3384","0.0005","90","","90","","90","","6012.66","0.17","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","TIF-5Zn","TIF-5Zn","","- C12 H18 N4 O3 Zn -","- C12 H12 N4 O0.99 Zn -","- C192 H192 N64 O15.84 Zn16 -","16","1","","Wu, Tao; Bu, Xianhui; Zhang, Jian; Feng, Pingyun","New Zeolitic Imidazolate Frameworks: From Unprecedented Assembly of Cubic Clusters to Ordered Cooperative Organization of Complementary Ligands","Chemistry of Materials","2008","20","24","7377","","10.1021/cm802400f","","","0.71073","MoKα","","0.1254","0.0938","","","0.2741","0.2959","","","","","","1.175","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001278","16.6286","0.0002","16.6286","0.0002","21.4148","0.0004","90","","90","","90","","5921.41","0.15","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","TIF-5Co","TIF-5Co","","- C12 H18 Co N4 O3 -","- C12 H12 Co N4 O -","- C192 H192 Co16 N64 O16 -","16","1","","Wu, Tao; Bu, Xianhui; Zhang, Jian; Feng, Pingyun","New Zeolitic Imidazolate Frameworks: From Unprecedented Assembly of Cubic Clusters to Ordered Cooperative Organization of Complementary Ligands","Chemistry of Materials","2008","20","24","7377","","10.1021/cm802400f","","","0.71073","MoKα","","0.0896","0.0652","","","0.1927","0.2156","","","","","","1.077","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001303","5.3954","0.0004","5.3954","","12.0264","0.0018","90","","90","","90","","350.09","0.06","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Mo O4 Sr -","- Mo O4 Sr -","- Mo4 O16 Sr4 -","4","0.25","","Bernuy-Lopez, Carlos; Allix, Mathieu; Bridges, Craig A.; Claridge, John B.; Rosseinsky, Matthew J.","Sr2MgMoO6-δ: Structure, Phase Stability, and Cation Site Order Control of Reduction","Chemistry of Materials","2007","19","5","1035","","10.1021/cm0624116","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001306","5.4113","0.0015","5.4113","","12.056","0.006","90","","90","","90","","353","0.2","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Mo O4 Sr -","- Mo O4 Sr -","- Mo4 O16 Sr4 -","4","0.25","","Bernuy-Lopez, Carlos; Allix, Mathieu; Bridges, Craig A.; Claridge, John B.; Rosseinsky, Matthew J.","Sr2MgMoO6-δ: Structure, Phase Stability, and Cation Site Order Control of Reduction","Chemistry of Materials","2007","19","5","1035","","10.1021/cm0624116","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001684","9.5974","0.0017","9.5974","","13.581","0.004","90","","90","","90","","1250.9","0.4","","","298","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- B4 H20 K2 Mg N4 -","- B4 H20 K2 Mg N4 -","- B16 H80 K8 Mg4 N16 -","4","0.25","","Chua, Yong Shen; Li, Wen; Wu, Guotao; Xiong, Zhitao; Chen, Ping","From Exothermic to Endothermic Dehydrogenation ‒ Interaction of Monoammoniate of Magnesium Amidoborane and Metal Hydrides","Chemistry of Materials","2012","24","18","3574","","10.1021/cm301662q","powder diffraction","x-ray","1.5406","CuKα","","","","","","","","0.16372","","1.31","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001685","9.4134","0.0017","9.4134","","12.7221","0.0023","90","","90","","90","","1127.3","0.3","","","298","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- B4 H20 Mg N4 Na2 -","- B4 H20 Mg N4 Na2 -","- B16 H80 Mg4 N16 Na8 -","4","0.25","","Chua, Yong Shen; Li, Wen; Wu, Guotao; Xiong, Zhitao; Chen, Ping","From Exothermic to Endothermic Dehydrogenation ‒ Interaction of Monoammoniate of Magnesium Amidoborane and Metal Hydrides","Chemistry of Materials","2012","24","18","3574","","10.1021/cm301662q","powder diffraction","x-ray","1.5406","CuKα","","","","","","","","0.13414","","0.97","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001935","11.4235","0.0016","11.4235","0.0016","13.445","0.003","90","","90","","90","","1754.5","0.5","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Ca Mg3 N4 Si -","- Ca Mg3 N4 Si -","- Ca16 Mg48 N64 Si16 -","16","1","","Schmiechen, Sebastian; Schneider, Hajnalka; Wagatha, Peter; Hecht, Cora; Schmidt, Peter J.; Schnick, Wolfgang","Toward New Phosphors for Application in Illumination-Grade White pc-LEDs: The Nitridomagnesosilicates Ca[Mg3SiN4]:Ce3+, Sr[Mg3SiN4]:Eu2+, and Eu[Mg3SiN4]","Chemistry of Materials","2014","26","8","2712","","10.1021/cm500610v","","","0.71073","MoKα","","0.0494","0.0403","","","0.1063","0.1096","","","","","","1.044","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001936","11.4951","0.0016","11.4951","0.0016","13.512","0.003","90","","90","","90","","1785.4","0.5","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Mg3 N4 Si Sr -","- Mg3 N4 Si Sr -","- Mg48 N64 Si16 Sr16 -","16","1","","Schmiechen, Sebastian; Schneider, Hajnalka; Wagatha, Peter; Hecht, Cora; Schmidt, Peter J.; Schnick, Wolfgang","Toward New Phosphors for Application in Illumination-Grade White pc-LEDs: The Nitridomagnesosilicates Ca[Mg3SiN4]:Ce3+, Sr[Mg3SiN4]:Eu2+, and Eu[Mg3SiN4]","Chemistry of Materials","2014","26","8","2712","","10.1021/cm500610v","","","0.71073","MoKα","","0.0483","0.0362","","","0.1024","0.1113","","","","","","1.088","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001937","11.5105","0.0004","11.5105","0.0004","13.5519","0.0004","90","","90","","90","","1795.51","0.1","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Eu Mg3 N4 Si -","- Eu Mg3 N4 Si -","- Eu16 Mg48 N64 Si16 -","16","1","","Schmiechen, Sebastian; Schneider, Hajnalka; Wagatha, Peter; Hecht, Cora; Schmidt, Peter J.; Schnick, Wolfgang","Toward New Phosphors for Application in Illumination-Grade White pc-LEDs: The Nitridomagnesosilicates Ca[Mg3SiN4]:Ce3+, Sr[Mg3SiN4]:Eu2+, and Eu[Mg3SiN4]","Chemistry of Materials","2014","26","8","2712","","10.1021/cm500610v","","","0.71073","MoKα","","0.0185","0.0163","","","0.0392","0.0403","","","","","","1.013","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001979","11.16","0.0016","11.16","0.0016","12.865","0.003","90","","90","","90","","1602.3","0.5","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","Clacium litho nitridoaluminate","Clacium litho nitridoaluminate","","- Al3 Ca Li N4 -","- Al3 Ca Li N4 -","- Al48 Ca16 Li16 N64 -","16","1","","Pust, Philipp; Wochnik, Angela S.; Baumann, Elen; Schmidt, Peter J.; Wiechert, Detlef; Scheu, Christina; Schnick, Wolfgang","Ca[LiAl3N4]:Eu2+—A Narrow-Band Red-Emitting Nitridolithoaluminate","Chemistry of Materials","2014","26","11","3544","","10.1021/cm501162n","","","0.71073","MoKα","","0.0341","0.0303","","","0.0762","0.0787","","","","","","1.072","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002028","41.199","0.004","41.199","0.004","5.776","0.0005","90","","90","","90","","9803.9","1.6","298","2","298","2","","","","","","","","2","I 41/a :2","-I 4ad","88","","","","- C34 H24 -","- C34 H24 -","- C544 H384 -","16","1","","Zhang, Guo-Feng; Wang, Hongfeng; Aldred, Matthew P.; Chen, Tao; Chen, Ze-Qiang; Meng, Xianggao; Zhu, Ming-Qiang","General Synthetic Approach toward Geminal-Substituted Tetraarylethene Fluorophores with Tunable Emission Properties: X-ray Crystallography, Aggregation-Induced Emission and Piezofluorochromism","Chemistry of Materials","2014","26","15","4433","","10.1021/cm501414b","","","0.71073","MoKα","","0.1109","0.0481","","","0.1062","0.1342","","","","","","1.008","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4003154","23.781","0.005","23.781","0.005","11.844","0.003","90","","90","","90","","6698","3","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H30 Cu N10 O8 P2 -","- C32 H30 Cu N10 O8 P2 -","- C256 H240 Cu8 N80 O64 P16 -","8","0.5","","Srivastava, Anant Kumar; Divya, Pillutla; Praveenkumar, B.; Boomishankar, Ramamoorthy","Potentially Ferroelectric {CuIIL2}n Based Two-Dimensional Framework Exhibiting High Polarization and Guest-Assisted Dielectric Anomaly","Chemistry of Materials","2015","27","15","5222","","10.1021/acs.chemmater.5b01267","","","0.71073","MoKα","","0.0912","0.0436","","","0.085","0.1003","","","","","","1.005","","","","has coordinates","231395","2020-10-21","18:00:00",""
"4020307","23.3036","0.0009","23.3036","0.0009","8.5915","0.0006","90","","90","","90","","4665.7","0.4","273","2","273","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C12 H18 O -","- C12 H18 O -","- C192 H288 O16 -","16","1","","Daniele Casarini; Carmine Coluccini; Lodovico Lunazzi; Andrea Mazzanti","Stereolabile and Configurationally Stable Atropisomers of Hindered Aryl Carbinols.","Journal of Organic Chemistry","2005","70","","5098","5102","10.1021/jo050382x","","","","","","","","","","","","","","","","","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4020500","23.604","0.004","23.604","0.004","13.515","0.003","90","","90","","90","","7530","2","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C10 H15 Cl O -","- C10 H15 Cl O -","- C320 H480 Cl32 O32 -","32","2","","María E. González Núñez; Jorge Royo; Rossella Mello; Minerva Báguena; Jaime Martínez Ferrer; Carmen Ramírez de Arellano; Gregorio Asensio; G. K. Surya Prakash","Oxygenation of Alkane C-H Bonds with Methyl(trifluoromethyl)dioxirane: Effect of the Substituents and the Solvent on the Reaction Rate","Journal of Organic Chemistry","2005","70","","7919","7924","10.1021/jo0509511","","","","","","","","","","","","","","","","","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4020709","18.068","0.002","18.068","0.004","25.243","0.004","90","","90","","90","","8241","2","298","","","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C13 H20 Cl K N2 O12 -","- C13 H18 Cl K N2 O12 -","- C208 H288 Cl16 K16 N32 O192 -","16","1","","Aneta Bogdanova; Marc W. Perkovic; Vladimir V. Popik","Structure and Photochemistry of 18-Diazo-1,4,7,10,13,16-hexaoxacyclononadeca-17,19-dione and Its Sodium and Potassium Complexes. Control of the Ground-State Conformation of 2-Diazo-1,3-dicarbonyl Fragment via Host-Guest Complexation","Journal of Organic Chemistry","2005","70","","9867","9873","10.1021/jo051594x","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4020862","27.7337","0.001","27.7337","0.001","10.4865","0.0004","90","","90","","90","","8065.8","0.5","220","2","220","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C73 H104 N20 O20 -","- C73 H104 N20 O20 -","- C292 H416 N80 O80 -","4","0.25","","Dominic Laliberté; Thierry Maris; James D. Wuest","Molecular Tectonics. Porous Hydrogen-Bonded Networks Built from Derivatives of Pentaerythrityl Tetraphenyl Ether","Journal of Organic Chemistry","2004","69","","1776","1787","10.1021/jo035311h","","","","","","","","","","","","","","","","","","","","","has coordinates","178386","2020-10-21","18:00:00",""
"4021719","19.1714","0.0002","19.1714","0.0002","23.39","0.0003","90","","90","","90","","8596.82","0.17","150","","150","","","","","","","","synthesis as described","5","I 41/a :2","-I 4ad","88","","","","- C22 H30 N2 O2 Os -","- C22 H30 N2 O2 Os -","- C352 H480 N32 O32 Os16 -","16","1","","Timothy J. Donohoe; Robert M. Harris; Sam Butterworth; Jeremy N. Burrows; Andrew Cowley; Jeremy S. Parker","New Osmium-Based Reagent for the Dihydroxylation of Alkenes","Journal of Organic Chemistry","2006","71","","4481","4489","10.1021/jo060301c","","","0.71073","MoKα","","0.0431","0.0272","","0.051","0.0299","0.0299","","","","","","1.0711","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4021726","29.7596","0.0018","29.7596","0.0018","14.0373","0.0016","90","","90","","90","","12431.9","1.8","292","2","292","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C32 H37 N5 O6 -","- C32 H37 N5 O6 -","- C512 H592 N80 O96 -","16","1","","Zhi-Guo Wang; Bao-Han Zhou; Yun-Feng Chen; Guo-Dong Yin; Yi-Tao Li; An-Xin Wu; Lyle Isaacs","Substituent Effects Control the Self-Association of Molecular Clips in the Crystalline State","Journal of Organic Chemistry","2006","71","","4502","4508","10.1021/jo0603375","","","0.71073","MoKα","","0.0769","0.0452","","","0.1179","0.1302","","","","","","0.928","","","","has coordinates","178395","2020-10-21","18:00:00",""
"4021780","26.953","0.003","26.953","0.003","9.978","0.003","90","","90","","90","","7249","2","295","2","293","2","","","","","","","","2","I 41/a :2","-I 4ad","88","","9,10,diphenylphenanthrene","","- C26 H18 -","- C26 H18 -","- C416 H288 -","16","1","","Chao Chen; Chanjuan Xi; Yuanyuan Liu; Xiaoyin Hong","Generation of Benzocyclobutadiene Derivatives from Zirconaindene Derivatives","Journal of Organic Chemistry","2006","71","","5373","5376","10.1021/jo060334s","","","0.71073","MoKα","","0.3153","0.08","","","0.0889","0.1412","","","","","","0.795","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022515","17.628","0.003","17.628","0.003","23.372","0.005","90","","90","","90","","7262.5","2.4","143","1","143","2","","","","","","","","6","I 41/a :2","-I 4ad","88","meso-tetra-(4-methoxycarbonyl-phenyl)tetranaphthaloporphyrin","","","- C86 H56 Cl4 N4 O8 Pd -","- C84 H52 N4 O8 Pd -","- C336 H208 N16 O32 Pd4 -","4","0.25","","Olga S. Finikova; Andrei V. Cheprakov; Patrick J. Carroll; Sergei A. Vinogradov","Novel Route to Functionalized Tetraaryltetra[2,3]naphthaloporphyrins via Oxidative Aromatization","Journal of Organic Chemistry","2003","68","","7517","7520","10.1021/jo0347819","","","0.71069","MoKα","","0.09","0.0817","","0.2624","0.2561","","","","0.884","0.919","0.919","","","","","has coordinates","178404","2020-10-21","18:00:00",""
"4023072","10.7984","0.0002","10.7984","0.0002","11.9281","0.0002","90","","90","","90","","1390.88","0.04","100","2","100","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C8 H8 N2 -","- C8 H8 N2 -","- C64 H64 N16 -","8","0.5","","Sanjeev K. Dey; David A. Lightner","1,1'-Bipyrroles: Synthesis and Stereochemistry","Journal of Organic Chemistry","2007","72","","9395","9397","10.1021/jo7016789","","","0.71073","MoKα","","0.037","0.0352","","","0.1065","0.1091","","","","","","1.074","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4024695","15.3","0.002","15.3","0.002","14.684","0.003","90","","90","","90","","3437.4","1","113","2","113","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C37 H49 N7 O8 -","- C37 H49 N7 O8 -","- C148 H196 N28 O32 -","4","0.25","","Bo Yao; De-Xian Wang; Han-Yuan Gong; Zhi-Tang Huang; Mei-Xiang Wang","Synthesis, Structure, and Reactions of NH-Bridged Calix[m]arene[n]pyridines","Journal of Organic Chemistry","2009","74","","5361","5368","10.1021/jo900826n","","","0.71073","MoKα","","0.0512","0.047","","","0.1156","0.119","","","","","","1.075","","","","has coordinates","178425","2020-10-21","18:00:00",""
"4024745","27.784","0.0018","27.784","0.0018","21.975","0.0013","90","","90","","90","","16963.6","1.9","293","2","295","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C38 H30 Br4 N10 O4 -","- C38 H30 Br4 N10 O4 -","- C608 H480 Br64 N160 O64 -","16","1","","Qingyi Li; Paul Hurley; Hui Ding; Andrew G. Roberts; Radha Akella; Patrick G. Harran","Exploring Symmetry-Based Logic for a Synthesis of Palau'amine","Journal of Organic Chemistry","2009","74","","5909","5919","10.1021/jo900755r","","","0.71073","MoKα","","0.1336","0.0899","","","0.2017","0.2214","","","","","","1.062","","","","has coordinates","178426","2020-10-21","18:00:00",""
"4025064","26.262","0.003","26.262","0.003","5.8835","0.0007","90","","90","","90","","4057.8","0.8","100","","100","","","","","","","","synthesis","3","I 41/a :2","-I 4ad","88","","","","- C12 H14 O2 -","- C12 H14 O2 -","- C192 H224 O32 -","16","1","","Christian Brand; Gesche Rauch; Michele Zanoni; Birger Dittrich; Daniel B. Werz","Synthesis of [n,5]-Spiroketals by Ring Enlargement of Donor-Acceptor-Substituted Cyclopropane Derivatives","Journal of Organic Chemistry","2009","74","","8779","8786","10.1021/jo901902g","","","0.71073","","","0.0731","0.0304","","","","0.0288","","","","","","1.8176","","","","has coordinates","178429","2020-10-21","18:00:00",""
"4025192","17.002","0.003","17.002","0.003","31.216","0.011","90","","90","","90","","9024","4","133","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","2-tert-Butyl-3,4,5-triphenyl-6-(trifluoromethyl)pyridine","","- C28 H24 F3 N -","- C28 H24 F3 N -","- C448 H384 F48 N16 -","16","1","","Tilman Lechel; Jyotirmayee Dash; Paul Hommes; Dieter Lentz; Hans-Ulrich Reissig","Three-Component Synthesis of Perfluoroalkyl- or Perfluoroaryl-Substituted 4-Hydroxypyridine Derivatives and Their Palladium-Catalyzed Coupling Reactions","Journal of Organic Chemistry","2010","75","","726","732","10.1021/jo9022183","","","0.71073","MoKα","","0.0971","0.0675","","","0.1788","0.2104","","","","","","1.092","","","","has coordinates","255805","2020-10-21","18:00:00",""
"4026641","13.107","0.0002","13.107","0.0002","30.351","0.0007","90","","90","","90","","5214.1","0.16","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","pzmet","","","- C22 H29 N7 O8 -","- C22 H29 N7 O8 -","- C176 H232 N56 O64 -","8","0.5","","Felipe Reviriego; Pilar Navarro; Vicente J. Arán; Maria Luisa Jimeno; Enrique García-España; Julio Latorre; Maria J. R. Yunta","Hydrogen-Bond-Mediated Self-Assembly of 26-Membered Diaza Tetraester Crowns of 3,5-Disubstituted 1H-Pyrazole. Dimerization Study in the Solid State and in CDCl3 Solution","Journal of Organic Chemistry","2011","76","","8223","8231","10.1021/jo2012835","","","0.71073","MoKα","","0.0979","0.0584","","","0.1892","0.2266","","","","","","1.047","","","","has coordinates,has disorder","178445","2020-10-21","18:00:00",""
"4027786","23.0609","0.0009","23.0609","0.0009","27.0102","0.0009","90","","90","","90","","14364.2","0.9","120","","120","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C33 H29.5 N O4 -","- C33 H29.5 N O4 -","- C528 H472 N16 O64 -","16","1","","Mikhail A. Filatov; Stanislav Baluschev; Iliyana Z. Ilieva; Volker Enkelmann; Tzenka Miteva; Katharina Landfester; Sergey E. Aleshchenkov; Andrei V. Cheprakov","Tetraaryltetraanthra[2,3]porphyrins: Synthesis, Structure, and Optical Properties","Journal of Organic Chemistry","2012","77","","11119","11131","10.1021/jo302135q","","","0.71073","MoKα","","0.0941","0.0407","","0.1145","0.0584","0.0584","","","","","","0.9801","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4028838","30.901","0.004","30.901","0.004","8.0232","0.0011","90","","90","","90","","7661.1","1.8","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C22 H15 I N2 O -","- C22 H15 I N2 O -","- C352 H240 I16 N32 O16 -","16","1","","Wen-Juan Hao; Jian-Qiang Wang; Xiao-Ping Xu; Shi-Lei Zhang; Shun-Yi Wang; Shun-Jun Ji","I2/O2-Promoted Domino Reactions of Isatins or 3-Hydroxyindolin-2-one Derivatives with Enaminones","Journal of Organic Chemistry","2013","78","","12362","12373","10.1021/jo401773j","","","0.7107","MoKα","","0.1324","0.1149","","","0.4048","0.422","","","","","","1.105","","","","has coordinates","178467","2020-10-21","18:00:00",""
"4029060","31.296","0.005","31.296","0.005","18.216","0.003","90","","90","","90","","17841","5","298","2","298","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 N3 O9.44 S Si -","- C32 H40 N3 O9.324 S Si -","- C512 H640 N48 O149.184 S16 Si16 -","16","1","","Feng, Yiqing; Majireck, Max M.; Weinreb, Steven M.","Total syntheses of the monoterpene indole alkaloids (±)-alstilobanine A and E and (±)-angustilodine.","The Journal of organic chemistry","2014","79","1","7","24","10.1021/jo402495q","","","0.71073","MoKα","","0.2274","0.1145","","","0.3291","0.3987","","","","","","1.018","","","","has coordinates","178469","2020-10-21","18:00:00",""
"4029730","27.975","0.005","27.975","0.005","48.786","0.017","90","","90","","90","","38180","16","150","2","150","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C66 H70 F12 N8 O20 Ru4 S4 -","- C66 H70 F12 N8 O20 Ru4 S4 -","- C1056 H1120 F192 N128 O320 Ru64 S64 -","16","1","","Shanmugaraju, Sankarasekaran; Samanta, Dipak; Mukherjee, Partha Sarathi","Self-assembly of Ru(4) and Ru(8) assemblies by coordination using organometallic Ru(II)(2) precursors: Synthesis, characterization and properties.","Beilstein journal of organic chemistry","2012","8","","313","322","10.3762/bjoc.8.34","","","0.71073","MoKα","","0.3104","0.1152","","","0.2819","0.4337","","","","","","1.04","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4030369","15.424","0.002","15.424","0.002","13.692","0.004","90","","90","","90","","3257.3","1.1","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C44 H27 N5 Ni O2 -","- C44 H27 N5 Ni O2 -","- C176 H108 N20 Ni4 O8 -","4","0.25","","Akhigbe, Joshua; Luciano, Michael; Zeller, Matthias; Brückner, Christian","Mono- and Bisquinoline-Annulated Porphyrins from Porphyrin β,β'-Dione Oximes.","The Journal of organic chemistry","2014","80","1","499","","10.1021/jo502511j","","","0.71073","MoKα","","0.1318","0.0504","","","0.1189","0.1478","","","","","","1.012","","","","has coordinates,has disorder","178482","2020-10-21","18:00:00",""
"4030719","20.24","0.01","20.24","0.01","46.88","0.03","90","","90","","90","","19205","18","","","298","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C60 H147 N5 O42 W12 -","- C60 N5 O42 W12 -","- C480 N40 O336 W96 -","8","0.5","","Seguin, L.; Gerand, B.; Nowogrocki, G.","Structure of an hydrated tetrapropylammonium polytungstate H3W12O40[N(C3H7)4]5.2H2O","European Journal of Solid State and Inorganic Chemistry","1995","32","","181","194","","","x-ray","0.71069","MoKα","","","0.039","","","0.039","","","","","","","","","","","has coordinates","178486","2020-10-21","18:00:00",""
"4030885","9.353","0.001","9.353","0.001","5.743","0.001","90","","90","","90","","502.39","0.12","","","293","","","","","","","","","2","I 41/a :2","-I 4ad","88","","","","- Li Si -","- Li Si -","- Li16 Si16 -","16","1","","Evers, J.; Oehlinger, G.; Sextl, G.","LiSi, a unique Zintl phase - although stable; it long evaded synthesis","European Journal of Solid State and Inorganic Chemistry","1997","34","","773","774","","","x-ray","1.5418","CuKα","","","0.071","","","0.071","","","","","","","","","","","has coordinates","178487","2020-10-21","18:00:00",""
"4030886","9.764","0.003","9.764","0.003","5.784","0.003","90","","90","","90","","551.4","0.4","","","293","","","","","","","","","2","I 41/a :2","-I 4ad","88","","","","- Ge Li -","- Ge Li -","- Ge16 Li16 -","16","1","","Evers, J.; Oehlinger, G.; Sextl, G.","LiSi, a unique Zintl phase - although stable; it long evaded synthesis","European Journal of Solid State and Inorganic Chemistry","1997","34","","773","774","","","x-ray","1.5418","CuKα","","","","","","","","","","","","","","","","","has coordinates","178487","2020-10-21","18:00:00",""
"4034598","19.0715","0.0007","19.0715","0.0007","18.6402","0.0011","90","","90","","90","","6779.9","0.5","291.9","0.2","291.9","0.2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H15 Cl N2 O -","- C20 H15 Cl N2 O -","- C320 H240 Cl16 N32 O16 -","16","1","","Dagar, Anuradha; Bae, Gi Hun; Lee, Jeong Hwa; Kim, Ikyon","Tandem [4+1+1] Annulation Approach to 4-Acyl-3,4-dihydropyrrolo[1,2- a]pyrazines: Diastereoselective Construction of Dihydropyrazine Units from Pyrroles.","The Journal of organic chemistry","2019","84","11","6916","6927","10.1021/acs.joc.9b00724","","x-ray","0.71073","MoKα","","0.1342","0.0642","","","0.1104","0.1343","","","","","","1.044","","","","has coordinates","223083","2020-10-21","18:00:00",""
"4034912","26.6839","0.001","26.6839","0.001","10.228","0.0007","90","","90","","90","","7282.6","0.6","100","0.1","100","0.1","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H22 N2 O3 S -","- C20 H22 N2 O3 S -","- C320 H352 N32 O48 S16 -","16","1","","Liu, Xiaozu; Zhou, Yuxiang; Yang, Zhongqin; Li, Qin; Zhao, Liang; Liu, Peijun","Iodine-Catalyzed C-H Amidation and Imination at the 2α-Position of 2,3-Disubstituted Indoles with Chloramine Salts.","The Journal of organic chemistry","2018","83","8","4665","4673","10.1021/acs.joc.8b00286","","x-ray","0.71073","MoKα","","0.0805","0.0541","","","0.1239","0.1373","","","","","","1.049","","","","has coordinates","226427","2020-10-21","18:00:00",""
"4034975","22.0462","0.001","22.0462","0.001","12.8478","0.0012","90","","90","","90","","6244.5","0.7","301","2","301","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C13 H14 F3 N3 O3 -","- C13 H14 F3 N3 O3 -","- C208 H224 F48 N48 O48 -","16","1","","Zhao, Yilong; Zhou, Yuhan; Zhang, Chunxia; Li, Dong; Sun, Puhua; Li, Jianzhe; Wang, Huan; Liu, Jianhui; Qu, Jingping","Base-Controlled Regiodivergent Azidation of Trifluoromethyl Alkenyl Triflates: Transition-Metal-Free Access to CF<sub>3</sub>-Containing Allyl Azides and Alkenyl Azides.","The Journal of organic chemistry","2018","83","5","2858","2868","10.1021/acs.joc.7b03294","","","0.71073","MoKα","","0.1071","0.0714","","","0.1619","0.1775","","","","","","1.07","","","","has coordinates","226483","2020-10-21","18:00:00",""
"4035239","22.7789","0.0015","22.7789","0.0015","34.781","0.003","90","","90","","90","","18047","2","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C25.75 H24.5 N3 O2.25 -","- C25.75 H24.5 N3 O2.25 -","- C824 H784 N96 O72 -","32","2","","Halli, Juliette; Kramer, Philipp; Grimmer, Jennifer; Bolte, Michael; Manolikakes, Georg","Bi(OTf)<sub>3</sub>-Catalyzed Diastereoselective One-Pot Synthesis of 1,3-Diamines with Three Continuous Stereogenic Centers.","The Journal of organic chemistry","2018","83","19","12007","12022","10.1021/acs.joc.8b01925","","","0.71073","MoKα","","0.1994","0.0688","","","0.1124","0.1528","","","","","","0.802","","","","has coordinates","226705","2020-10-21","18:00:00",""
"4035891","22.6011","0.0014","22.6011","0.0014","16.3728","0.0012","90","","90","","90","","8363.4","1","296","2","296","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C28 H24 N2 -","- C28 H24 N2 -","- C448 H384 N32 -","16","1","","Mallick, Sudesh; Maddala, Sudhakar; Kollimalayan, Kalidass; Venkatakrishnan, Parthasarathy","Oxidative Coupling of Carbazoles: A Substituent-Governed Regioselectivity Profile.","The Journal of organic chemistry","2019","84","1","73","93","10.1021/acs.joc.8b02322","","","0.71073","MoKα","","0.0645","0.0489","","","0.124","0.1357","","","","","","1.03","","","","has coordinates","227292","2020-10-21","18:00:00",""
"4035961","25.511","0.006","25.511","0.006","8.04","0.002","90","","90","","90","","5233","2","120","2","120","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C16 H16 N2 -","- C16 H16 N2 -","- C256 H256 N32 -","16","1","","Pozharskii, Alexander F.; Ozeryanskii, Valery A.; Filatova, Ekaterina A.; Dyablo, Olga V.; Pogosova, Olga G.; Borodkin, Gennady S.; Filarowski, Aleksander; Steglenko, Dmitriy V.","Neutral Pyrrole Nitrogen Atom as a π- and Mixed n,π-Donor in Hydrogen Bonding.","The Journal of organic chemistry","2019","84","2","726","737","10.1021/acs.joc.8b02562","","","0.71073","MoKα","","0.1274","0.0523","","","0.0988","0.124","","","","","","0.97","","","","has coordinates","227354","2020-10-21","18:00:00",""
"4035963","27.2663","0.0002","27.2663","0.0002","12.3982","0.0002","90","","90","","90","","9217.46","0.18","150","0.1","150","0.1","","","","","","","synthesis as described","6","I 41/a :2","-I 4ad","88","","","","- C22 H26 F N2 O4 P -","- C22 H26 F N2 O4 P -","- C352 H416 F16 N32 O64 P16 -","16","1","","Maestro, Aitor; Martinez de Marigorta, Edorta; Palacios, Francisco; Vicario, Javier","Enantioselective α-Aminophosphonate Functionalization of Indole Ring through an Organocatalyzed Friedel-Crafts Reaction.","The Journal of organic chemistry","2019","84","2","1094","1102","10.1021/acs.joc.8b02843","","x-ray","1.54184","CuKα","","0.0525","0.0484","","","0.1356","0.1396","","","","","","1.065","","","","has coordinates,has disorder","227356","2020-10-21","18:00:00",""
"4036088","37.3457","0.0009","37.3457","0.0009","8.156","0.0003","90","","90","","90","","11375.2","0.6","200","2","200","2","","","","","","","","5","I 41/a :2","-I 4ad","88","3f in manuscript","","","- C64 H70 N4 O2 Si2 -","- C64 H70 N4 O2 Si2 -","- C512 H560 N32 O16 Si16 -","8","0.5","","Brosius, Victor; Müller, Matthias; Borstelmann, Jan; Rominger, Frank; Freudenberg, Jan; Bunz, Uwe H. F.","Azaacenodibenzosuberones.","The Journal of organic chemistry","2019","","","","","10.1021/acs.joc.9b02756","","","1.54178","CuKα","","0.1169","0.0661","","","0.1595","0.1892","","","","","","1.018","","","","has coordinates,has disorder","231013","2020-10-21","18:00:00",""
"4037336","28.4537","0.0007","28.4537","0.0007","10.8501","0.0007","90","","90","","90","","8784.4","0.6","293","2","293.15","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C25 H22 N2 O4 S -","- C25 H22 N2 O4 S -","- C400 H352 N32 O64 S16 -","16","1","","Jash, Moumita; Das, Bimolendu; Chowdhury, Chinmay","One-Pot Access to Benzo[a]carbazoles via Palladium(II)-Catalyzed Hetero- and Carboannulations.","The Journal of organic chemistry","2016","81","22","10987","10999","10.1021/acs.joc.6b02022","","","0.71073","MoKα","","0.1004","0.0459","","","0.119","0.1491","","","","","","0.991","","","","has coordinates","235975","2020-10-21","18:00:00",""
"4037433","21.8061","0.0011","21.8061","0.0011","18.3306","0.0014","90","","90","","90","","8716.3","0.9","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24 H21 N O3 S -","- C24 H21 N O3 S -","- C384 H336 N16 O48 S16 -","16","1","","Li, Tengfei; Yan, Hao; Li, Xincheng; Wang, Chunxiang; Wan, Boshun","Ruthenium-Catalyzed [3 + 2] Cycloaddition of 2H-Azirines with Alkynes: Access to Polysubstituted Pyrroles.","The Journal of organic chemistry","2016","81","23","12031","12037","10.1021/acs.joc.6b02322","","","0.71073","MoKα","","0.1293","0.0814","","","0.2327","0.2829","","","","","","1.047","","","","has coordinates,has disorder","236134","2020-10-21","18:00:00",""
"4037584","18.901","0.003","18.901","0.003","17.635","0.003","90","","90","","90","","6300.1","1.8","113","2","113","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C42 H30 F2 Ge -","- C42 H30 F2 Ge -","- C336 H240 F16 Ge8 -","8","0.5","","Okamura, Kazuma; Inagaki, Yusuke; Momma, Hiroyuki; Kwon, Eunsang; Setaka, Wataru","Gear Slippage in Molecular Bevel Gears Bridged with a Group 14 Element.","The Journal of organic chemistry","2019","84","22","14636","14643","10.1021/acs.joc.9b02214","","","0.71073","MoKα","","0.0618","0.0493","","","0.1335","0.1393","","","","","","1.059","","","","has coordinates","236389","2020-10-21","18:00:00",""
"4038130","30.826","0.003","30.826","0.003","10.4869","0.0012","90","","90","","90","","9965.1","1.8","100","0.1","100","0.1","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C33 H32 N2 -","- C33 H32 N2 -","- C528 H512 N32 -","16","1","","Górski, Krzysztof; Mech-Piskorz, Justyna; Leśniewska, Barbara; Pietraszkiewicz, Oksana; Pietraszkiewicz, Marek","Toward Soluble 5,10-Diheterotruxenes: Synthesis and Reactivity of 5,10-Dioxatruxenes, 5,10-Dithiatruxenes, and 5,10-Diazatruxenes.","The Journal of organic chemistry","2020","85","7","4672","4681","10.1021/acs.joc.9b03387","","","1.54184","CuKα","","0.1888","0.0896","","","0.1662","0.2107","","","","","","0.897","","","","has coordinates","250107","2020-10-21","18:00:00",""
"4038473","27.123","0.004","27.123","0.004","13.041","0.003","90","","90","","90","","9594","3","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C21 H19 Br F6 N2 O4 -","- C21 H19 Br F6 N2 O4 -","- C336 H304 Br16 F96 N32 O64 -","16","1","","Liu, Yi; Wu, Ziqiao; Wang, Yankai; Zhang, Yuheng; Shao, Jie; Lu, Tao; Li, Wenhai","Synthesis of Active Hexafluoroisopropyl Benzoates via Multicomponent Reaction.","The Journal of organic chemistry","2020","","","","","10.1021/acs.joc.0c00476","","","0.71073","MoKα","","0.1161","0.055","","","0.0952","0.116","","","","","","1.002","","","","has coordinates","253065","2020-10-21","18:00:00",""
"4061018","25.5779","0.0017","25.5779","0.0017","13.7775","0.0014","90","","90","","90","","9013.6","1.2","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C72 H56 Cl24 N12 Si -","- C72 H48 Cl24 N12 Si -","- C288 H192 Cl96 N48 Si4 -","4","0.25","","Bai, Dong-Ren; Wang, Suning","Comparative Study on Tetrahedral and Tripodal Luminescent Silane and Methane Compounds with a 2,2'-Dipyridylamino Group","Organometallics","2004","23","25","5958","5966","10.1021/om049382y","","","","","","","","","","","","","","","","","","","","","has coordinates","209959","2020-10-21","18:00:00",""
"4061387","26.5859","0.0007","26.5859","0.0007","11.9092","0.0007","90","","90","","90","","8417.5","0.6","213","2","213","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C28 H22 Si -","- C28 H22 Si -","- C448 H352 Si16 -","16","1","","","","Organometallics","2005","","","","","10.1021/om0490886","","","","","","","","","","","","","","","","","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4061388","26.457","0.002","26.457","0.002","11.846","0.002","90","","90","","90","","8292.1","1.8","100","2","100","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C28 H22 Ge -","- C28 H22 Ge -","- C448 H352 Ge16 -","16","1","","","","Organometallics","2005","","","","","10.1021/om0490886","","","","","","","","","","","","","","","","","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4061391","26.5807","0.0012","26.5807","0.0012","11.9078","0.001","90","","90","","90","","8413.3","0.9","203","2","203","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C28 H20 D2 Si -","- C28 H20 D2 Si -","- C448 H320 D32 Si16 -","16","1","","","","Organometallics","2005","","","","","10.1021/om0490886","","","","","","","","","","","","","","","","","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4061392","26.5534","0.0012","26.5534","0.0012","11.9358","0.001","90","","90","","90","","8415.7","0.9","203","2","203","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C28 H20 D2 Ge -","- C28 H22 Ge -","- C448 H352 Ge16 -","16","1","","","","Organometallics","2005","","","","","10.1021/om0490886","","","","","","","","","","","","","","","","","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4061629","20.0697","0.0006","20.0697","0.0006","25.8902","0.0008","90","","90","","90","","10428.4","0.5","110","2","110","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C18 H29 Cl2 O Si Ta -","- C18 H29 Cl2 O Si Ta -","- C288 H464 Cl32 O16 Si16 Ta16 -","16","1","","Goux, Jerome; Le Gendre, Pierre; Richard, Philippe; Claude, Moise","Oxo and hydroxo tantalocene complexes: synthesis and reactivity. X-Ray molecular structures of [(η^5^-Cp*)TaCl(OH)(η^5^-C~5~H~4~SiMe~3~)]^+^Cl^-^, (η^5^-Cp*)Ta=OCl(η^5^-C~5~H~4~SiMe~3~)], [(η^5^-Cp*)TaCl~2~ (η^5^-C~5~H~4~SiMe~3~)]+PF~6~^-^.","Organometallics","2005","","","","","10.1021/om0504497","","","","","","","","","","","","","","","","","","","","","has coordinates","178513","2020-10-21","18:00:00",""
"4062011","17.8744","0.0014","17.8744","0.0014","15.6983","0.0018","90","","90","","90","","5015.5","0.8","133","2","133","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C13 H17.22 N O2.11 -","- C13 H17 N O2.11 -","- C208 H272 N16 O33.76 -","16","1","","","","Organometallics","2003","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","178500","2020-10-21","18:00:00",""
"4062135","21.663","0.002","21.663","0.002","15.609","0.002","90","","90","","90","","7325.1","1.5","299","2","299","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H17 Mo N3 O2 -","- C20 H17 Mo N3 O2 -","- C320 H272 Mo16 N48 O32 -","16","1","","Morales, Dolores; Navarro Clemente, M. Elena; Pérez, Julio; Riera, Lucía; Riera, Víctor; Miguel, Daniel","Reactivity of [MCl(η^3^-allyl)(1,10-phenanthroline)(CO)2] (M = Mo, W) Complexes toward Enolate Anions","Organometallics","2003","22","20","4124","4128","10.1021/om030275y","","","","","","","","","","","","","","","","","","","","","has coordinates","192075","2020-10-21","18:00:00",""
"4062359","15.869","0.004","15.869","","16.679","0.002","90","","90","","90","","4200.2","0.8","173","","173","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24 H18 N2 O4 Sn -","- C24 H18 N2 O4 Sn -","- C192 H144 N16 O32 Sn8 -","8","0.5","","Dakternieks, Dainis; Duthie, Andrew; Smyth, Douglas R.; Stapleton, Clynton P. D.; Tiekink, Edward R. T.","Steric Control over Molecular Structure and Supramolecular Association Exerted by Tin- and Ligand-Bound Groups in Diorganotin Carboxylates","Organometallics","2003","22","22","4599","4603","10.1021/om0340140","","","","","","","","","","","","","","","","","","","","","has coordinates","192115","2020-10-21","18:00:00",""
"4062642","31.797","0.005","31.797","0.005","8.438","0.003","90","","90","","90","","8532","3","203","2","203","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C22 H36 U -","- C22 H36 U -","- C352 H576 U16 -","16","1","","Kimberly C. Jantunen; Carol J. Burns; Ingrid Castro-Rodriguez; Ryan E. Da Re; Jeffery T. Golden; David E. Morris; Brian L. Scott; Felicia L. Taw; Jaqueline L. Kiplinger","Thorium(IV) and Uranium(IV) Ketimide Complexes Prepared by Nitrile Insertion in ActinideAlkyl and -Aryl Bonds","Organometallics","2004","","","","","10.1021/om0343824","","","","","","","","","","","","","","","","","","","","","has coordinates","178522","2020-10-21","18:00:00",""
"4062925","17.961","0.006","17.961","0.006","34.786","0.015","90","","90","","90","","11222","7","203","2","203","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C22 H47 Lu O2 Si2 -","- C22 H47 Lu O2 Si2 -","- C352 H752 Lu16 O32 Si32 -","16","1","","Thomas M. Cameron; John C. Gordon; Brian L. Scott","Synthesis and Characterization of (Mono)pentamethylcyclopentadienyl Lutetium Complexes: Formation of Bipyridyl Stabilized Alkyls, Anilides, and a Terminal Acetylide","Organometallics","2004","","","","","10.1021/om0497700","","","","","","","","","","","","","","","","","","","","","has coordinates","178525","2020-10-21","18:00:00",""
"4063684","42.615","0.006","42.615","0.006","32.935","0.007","90","","90","","90","","59811","17","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C152.5 H212.5 Cu10 N15 O6.25 -","- C152.5 H212.5 Cu10 N15 O6.25 -","- C2440 H3400 Cu160 N240 O100 -","16","1","","Stollenz, Michael; Gehring, Henrike; Konstanzer, Vera; Fischer, Stefan; Dechert, Sebastian; Grosse, Christian; Meyer, Franc","From Pyrazolate-Based Binuclear Copper(I) Complexes to Octanuclear σ-Mesityl-Bridged μ4-Oxo-Cuprocuprates: Controlled Dioxygen Splitting by Organocopper Scaffolds","Organometallics","2011","30","14","3708","","10.1021/om100836j","","x-ray","1.54178","CuKα","","0.0987","0.0667","","","0.1835","0.2227","","","","","","1.278","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4063863","21.183","0.003","21.183","0.003","34.642","0.007","90","","90","","90","","15545","4","113","2","113","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C31 H45 Cl2 N3 O Pd -","- C31 H45 Cl2 N3 O Pd -","- C496 H720 Cl32 N48 O16 Pd16 -","16","1","","Kong, Yong; Wen, Lifang; Song, Haibin; Xu, Shansheng; Yang, Min; Liu, Binyuan; Wang, Baiquan","Synthesis, Structures, and Norbornene Polymerization Behavior of Aryloxide-N-Heterocyclic Carbene Ligated Palladacycles","Organometallics","2011","30","1","153","","10.1021/om100994s","","","0.71073","MoKα","","0.0473","0.0429","","","0.114","0.1168","","","","","","1.105","","","","has coordinates,has disorder","178533","2020-10-21","18:00:00",""
"4064191","35.231","0.009","35.231","0.009","11.818","0.004","90","","90","","90","","14669","7","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C30.25 H57 N2 O Os P2 -","- C30.25 H54 N2 O Os P2 -","- C484 H864 N32 O16 Os16 P32 -","16","1","","Eguillor, Beatriz; Esteruelas, Miguel A.; García-Raboso, Jorge; Oliván, Montserrat; Oñate, Enrique; Pastor, Isidro M.; Peñafiel, Itziar; Yus, Miguel","Osmium NHC Complexes from Alcohol-Functionalized Imidazoles and Imidazolium Salts","Organometallics","2011","30","6","1658","","10.1021/om101173e","","","0.71073","MoKα","","0.1108","0.0398","","","0.0707","0.081","","","","","","0.803","","","","has coordinates,has disorder","178535","2020-10-21","18:00:00",""
"4064697","20.3919","0.0015","20.3919","0.0015","54.171","0.006","90","","90","","90","","22526","3","293","","293","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C44 H94 Ge4 O4 P2 Pt -","- C44 H75 Ge4 O4 P2 Pt -","- C704 H1200 Ge64 O64 P32 Pt16 -","16","1","","Tanabe, Makoto; Deguchi, Takashi; Osakada, Kohtaro","Chemical Properties of Tetragermaplatinacyclopentane. Insertion of an Alkyne into a Pt‒Ge Bond and Silylation Caused by H2SiPh2","Organometallics","2011","30","12","3386","","10.1021/om200275w","","","0.7107","MoKα","","0.1039","0.0829","","","0.2229","0.2468","","","","","","1.046","","","","has coordinates","178540","2020-10-21","18:00:00",""
"4065434","16.73268","0.00009","16.73268","0.00009","15.88529","0.00013","90","","90","","90","","4447.6","0.05","173","","173","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H44 Br4 Cu4 O8 P4 -","- C32 H44 Br4 Cu4 O8 P4 -","- C128 H176 Br16 Cu16 O32 P16 -","4","0.25","","Lal, Steven; McNally, Jayne; White, Andrew J. P.; Díez-González, Silvia","Novel Phosphinite and Phosphonite Copper(I) Complexes: Efficient Catalysts for Click Azide‒Alkyne Cycloaddition Reactions","Organometallics","2011","30","22","6225","","10.1021/om200791u","","","1.54184","CuKα","","0.0271","0.0247","","","0.0617","0.0631","","","","","","1.053","","","","has coordinates","178547","2020-10-21","18:00:00",""
"4065986","24.3176","0.0004","24.3176","0.0004","11.5212","0.0004","90","","90","","90","","6813","0.3","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C36 H40 Cl2 N2 Pd2 -","- C36 H40 Cl2 N2 Pd2 -","- C288 H320 Cl16 N16 Pd16 -","8","0.5","","Vázquez-García, Digna; Fernández, Alberto; López-Torres, Margarita; Rodríguez, Antonio; Gómez-Blanco, Nina; Viader, Carlos; Vila, José M.; Fernández, Jesús J.","Versatile Behavior of the Schiff Base Ligand 2,5-Me2C6H3C(H)═N(2,4,6-Me3C6H2) toward Cyclometalation Reactions: C(sp2,phenyl)−H vs C(sp3,methyl)−H Activation","Organometallics","2010","29","15","3303","","10.1021/om100238w","","","0.71073","MoKα","","0.0582","0.0395","","","0.0955","0.105","","","","","","1.059","","","","has coordinates","178552","2020-10-21","18:00:00",""
"4066292","28.9982","0.0011","28.9982","0.0011","16.8529","0.0008","90","","90","","90","","14171.5","1","153","2","153","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C37.5 H47 Cl2 N2 O P Ru -","- C37.5 H46 Cl2 N2 O P Ru -","- C600 H736 Cl32 N32 O16 P16 Ru16 -","16","1","","Hahn, F. Ekkehardt; Naziruddin, Abbas Raja; Hepp, Alexander; Pape, Tania","Synthesis, Characterization, and H-Bonding Abilities of Ruthenium(II) Complexes Bearing Bidentate NR,NH-Carbene/Phosphine Ligands†","Organometallics","2010","29","21","5283","","10.1021/om100388w","","","0.71073","MoKα","","0.0736","0.0467","","","0.1101","0.1246","","","","","","1.024","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4066412","19.7936","0.0014","19.7936","0.0014","35.745","0.004","90","","90","","90","","14004","2","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C34 H42 B2 Mn2 O6 -","- C34 H42 B2 Mn2 O6 -","- C544 H672 B32 Mn32 O96 -","16","1","","Eckensberger, U. David; Weber, Mitra; Wildt, Julia; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Reactivity of [(C5Me5)Fe(C5H4BBr2)] and [(OC)3Mn(C5H4BBr2)] toward Et3SiH: Facile Access to [(OC)3Mn(C5H4BH2)]2and to Boron-Bridged Dinuclear Organometallics†","Organometallics","2010","29","21","5301","","10.1021/om1004513","","","0.71073","MoKα","","0.1072","0.0664","","","0.1519","0.1689","","","","","","0.943","","","","has coordinates,has disorder","178556","2020-10-21","18:00:00",""
"4067054","20.891","0.003","20.891","0.003","34.563","0.004","90","","90","","90","","15084","4","173","0.5","173","0.5","","","","","","","","4","I 41/a :2","-I 4ad","88","jonll10","","","- C68 H70 Ir2 N2 -","- C68 H70 Ir2 N2 -","- C544 H560 Ir16 N16 -","8","0.5","","Li, Ling; Jiao, Yunzhe; Brennessel, William W.; Jones, William D.","Reactivity and Regioselectivity of Insertion of Unsaturated Molecules into M−C (M = Ir, Rh) Bonds of Cyclometalated Complexes","Organometallics","2010","29","20","4593","","10.1021/om100796q","","","0.71073","MoKα","","0.0993","0.0738","","","0.1996","0.2137","","","","","","1.089","","","","has coordinates","178505","2020-10-21","18:00:00",""
"4067425","27.5771","0.0006","27.5771","0.0006","31.4506","0.0008","90","","90","","90","","23918.1","1","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C82 H116 Cl20 Mo8 N8 O24 -","- C82 H116 Cl20 Mo8 N8 O24 -","- C656 H928 Cl160 Mo64 N64 O192 -","8","0.5","","Amarante, Tatiana R.; Neves, Patrícia; Coelho, Ana C.; Gago, Sandra; Valente, Anabela A.; Almeida Paz, Filipe A.; Pillinger, Martyn; Gonçalves, Isabel S.","Investigation of Molybdenum Tetracarbonyl Complexes As Precursors to MoVICatalysts for the Epoxidation of Olefins","Organometallics","2010","29","4","883","","10.1021/om900948r","","","0.71073","MoKα","","0.1724","0.0865","","","0.1833","0.2563","","","","","","1.135","","","","has coordinates","178565","2020-10-21","18:00:00",""
"4068572","31.843","0.005","31.843","0.005","10.133","0.003","90","","90","","90","","10275","4","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24 H31 N2 O5.5 Ru -","- C24 H30 N2 O5.5 Ru -","- C384 H480 N32 O88 Ru16 -","16","1","","Ito, Jun-ichi; Ujiie, Satoshi; Nishiyama, Hisao","New Bis(oxazolinyl)phenyl−Ruthenium(II) Complexes and Their Catalytic Activity for Enantioselective Hydrogenation and Transfer Hydrogenation of Ketones","Organometallics","2009","28","2","630","","10.1021/om800953f","","","0.71073","MoKα","","0.0563","0.0473","","","0.1308","0.1383","","","","","","1.154","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4068837","12.8618","0.0011","12.8618","0.0011","17.9097","0.0017","90","","90","","90","","2962.7","0.5","153","2","153","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C16 H16 N4 -","- C16 H16 N4 -","- C128 H128 N32 -","8","0.5","","Theilmann, Oliver; Saak, Wolfgang; Haase, Detlev; Beckhaus, Rüdiger","Reactions of Low-Valent Titanocene(II) Fragments withtrans-4,4′-Azobispyridine (RNNR, R = C5H4N): Formation of Tetranuclear Molecular Squares bytrans−cisIsomerization","Organometallics","2009","28","9","2799","","10.1021/om801123k","","","0.71073","MoKα","","0.0634","0.026","","","0.0423","0.0465","","","","","","0.731","","","","has coordinates","178578","2020-10-21","18:00:00",""
"4068857","24.455","0.006","24.455","0.006","13.684","0.005","90","","90","","90","","8184","4","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C72 H76 N4 O8 S4 Ti4 -","- C72 H76 N4 O8 S4 Ti4 -","- C288 H304 N16 O32 S16 Ti16 -","4","0.25","","Jia, Ai-Quan; Jin, Guo-Xin","Syntheses, Reactions, and Ethylene Polymerization of Titanium Complexes with [N, O, S] Ligands","Organometallics","2009","28","6","1872","","10.1021/om801131b","","","0.71073","MoKα","","0.2052","0.0603","","","0.1215","0.1455","","","","","","0.653","","","","has coordinates","178578","2020-10-21","18:00:00",""
"4069544","20.8625","0.0008","20.8625","0.0008","39.386","0.003","90","","90","","90","","17142.5","1.6","185","2","185","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C41 H60 Lu N2 O P Si2 -","- C41 H60 Lu N2 O P Si2 -","- C656 H960 Lu16 N32 O16 P16 Si32 -","16","1","","Li, Shihui; Cui, Dongmei; Li, Danfeng; Hou, Zhaomin","Highly 3,4-Selective Polymerization of Isoprene with NPN Ligand Stabilized Rare-Earth Metal Bis(alkyl)s. Structures and Performances","Organometallics","2009","28","16","4814","","10.1021/om900261n","","","0.71073","MoKα","","0.0574","0.0369","","","0.0801","0.0842","","","","","","0.887","","","","has coordinates","178584","2020-10-21","18:00:00",""
"4069547","20.7807","0.0006","20.7807","0.0006","38.349","0.002","90","","90","","90","","16560.5","1.1","187","2","187","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C38 H55 Lu N3 O P Si2 -","- C38 H55 Lu N3 O P Si2 -","- C608 H880 Lu16 N48 O16 P16 Si32 -","16","1","","Li, Shihui; Cui, Dongmei; Li, Danfeng; Hou, Zhaomin","Highly 3,4-Selective Polymerization of Isoprene with NPN Ligand Stabilized Rare-Earth Metal Bis(alkyl)s. Structures and Performances","Organometallics","2009","28","16","4814","","10.1021/om900261n","","","0.71073","MoKα","","0.0423","0.031","","","0.0733","0.0773","","","","","","1.001","","","","has coordinates","178584","2020-10-21","18:00:00",""
"4069548","20.8486","0.0005","20.8486","0.0005","38.22","0.002","90","","90","","90","","16612.9","1","187","2","187","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C38 H55 N3 O P Si2 Y -","- C38 H55 N3 O P Si2 Y -","- C608 H880 N48 O16 P16 Si32 Y16 -","16","1","","Li, Shihui; Cui, Dongmei; Li, Danfeng; Hou, Zhaomin","Highly 3,4-Selective Polymerization of Isoprene with NPN Ligand Stabilized Rare-Earth Metal Bis(alkyl)s. Structures and Performances","Organometallics","2009","28","16","4814","","10.1021/om900261n","","","0.71073","MoKα","","0.0908","0.0479","","","0.0989","0.1147","","","","","","1.007","","","","has coordinates","178584","2020-10-21","18:00:00",""
"4070683","20.6332","0.0007","20.6332","0.0007","38.833","0.003","90","","90","","90","","16532.3","1.5","187","2","187","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C39 H56 N2 O P Sc Si2 -","- C39 H56 N2 O P Sc Si2 -","- C624 H896 N32 O16 P16 Sc16 Si32 -","16","1","","Li, Shihui; Miao, Wei; Tang, Tao; Dong, Weimin; Zhang, Xuequan; Cui, Dongmei","New Rare Earth Metal Bis(alkyl)s Bearing an Iminophosphonamido Ligand. Synthesis and Catalysis toward Highly 3,4-Selective Polymerization of Isoprene","Organometallics","2008","27","4","718","","10.1021/om700945r","","","0.71073","MoKα","","0.1442","0.0551","","","0.0891","0.1103","","","","","","0.833","","","","has coordinates","178595","2020-10-21","18:00:00",""
"4070684","20.8477","0.001","20.8477","0.001","39.083","0.003","90","","90","","90","","16986.5","1.7","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C39 H56 N2 O P Si2 Y -","- C39 H56 N2 O P Si2 Y -","- C624 H896 N32 O16 P16 Si32 Y16 -","16","1","","Li, Shihui; Miao, Wei; Tang, Tao; Dong, Weimin; Zhang, Xuequan; Cui, Dongmei","New Rare Earth Metal Bis(alkyl)s Bearing an Iminophosphonamido Ligand. Synthesis and Catalysis toward Highly 3,4-Selective Polymerization of Isoprene","Organometallics","2008","27","4","718","","10.1021/om700945r","","","0.71073","MoKα","","0.1703","0.0613","","","0.1028","0.1331","","","","","","0.937","","","","has coordinates","178595","2020-10-21","18:00:00",""
"4070685","20.7862","0.0019","20.7862","0.0019","39.098","0.007","90","","90","","90","","16893","4","187","2","187","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C39 H56 Lu N2 O P Si2 -","- C39 H56 Lu N2 O P Si2 -","- C624 H896 Lu16 N32 O16 P16 Si32 -","16","1","","Li, Shihui; Miao, Wei; Tang, Tao; Dong, Weimin; Zhang, Xuequan; Cui, Dongmei","New Rare Earth Metal Bis(alkyl)s Bearing an Iminophosphonamido Ligand. Synthesis and Catalysis toward Highly 3,4-Selective Polymerization of Isoprene","Organometallics","2008","27","4","718","","10.1021/om700945r","","","0.71073","MoKα","","0.0393","0.0286","","","0.0689","0.0751","","","","","","1.049","","","","has coordinates","178595","2020-10-21","18:00:00",""
"4070686","20.6088","0.0004","20.6088","0.0004","38.8061","0.0015","90","","90","","90","","16481.8","0.8","187","2","187","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C38 H55 N3 O P Sc Si2 -","- C38 H55 N3 O P Sc Si2 -","- C608 H880 N48 O16 P16 Sc16 Si32 -","16","1","","Li, Shihui; Miao, Wei; Tang, Tao; Dong, Weimin; Zhang, Xuequan; Cui, Dongmei","New Rare Earth Metal Bis(alkyl)s Bearing an Iminophosphonamido Ligand. Synthesis and Catalysis toward Highly 3,4-Selective Polymerization of Isoprene","Organometallics","2008","27","4","718","","10.1021/om700945r","","","0.71073","MoKα","","0.0697","0.0458","","","0.114","0.1267","","","","","","0.942","","","","has coordinates","178595","2020-10-21","18:00:00",""
"4070866","21.0388","0.0019","21.0388","0.0019","17.05","0.002","90","","90","","90","","7546.9","1.3","108","2","108","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C22 H28 B P -","- C22 H28 B P -","- C352 H448 B16 P16 -","16","1","","Fischbach, Andreas; Bazinet, Patrick R.; Waterman, Rory; Tilley, T. Don","β-Phosphinoethylboranes as Ambiphilic Ligands in Nickel−Methyl Complexes","Organometallics","2008","27","6","1135","","10.1021/om7010886","","","0.71073","MoKα","","0.0422","0.0339","","","0.0788","0.0834","","","","","","1.037","","","","has coordinates","178597","2020-10-21","18:00:00",""
"4071856","31.325","0.0008","31.325","0.0008","7.0407","0.0003","90","","90","","90","","6908.7","0.4","223","2","223","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C14 H20 Cl N Si2 Zr -","- C14 H20 Cl N Si2 Zr -","- C224 H320 Cl16 N16 Si32 Zr16 -","16","1","","Wang, Cun; Luo, He-Kuan; van Meurs, Martin; Stubbs, Ludger P.; Wong, Pui-Kwan","The New Tridentate Ligand CpSiNSiCp and Its Zirconium Complexes: Incorporation of Two Bridged Constrained-Geometry Units into One Molecule","Organometallics","2008","27","13","2908","","10.1021/om8004299","","","0.71073","MoKα","","0.0331","0.0298","","","0.0711","0.0727","","","","","","1.116","","","","has coordinates","178607","2020-10-21","18:00:00",""
"4072503","26.054","0.004","26.054","0.004","21.715","0.004","90","","90","","90","","14740","4","253","2","253","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C40 H31 N2 O0.5 Pt S2 -","- C39.976 H29.972 N2 O0.5 Pt S1.996 -","- C639.616 H479.552 N32 O8 Pt16 S31.936 -","16","1","","Lee, Jason Ka-Wai; Ko, Chi-Chiu; Wong, Keith Man-Chung; Zhu, Nianyong; Yam, Vivian Wing-Wah","A Photochromic Platinum(II) Bis(alkynyl) Complex Containing a Versatile 5,6-Dithienyl-1,10-phenanthroline","Organometallics","2007","26","1","12","","10.1021/om060731t","","","0.71073","MoKα","","0.0779","0.0455","","","0.1265","0.1316","","","","","","0.956","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4072905","40.2284","0.0005","40.2284","0.0005","10.693","0.0001","90","","90","","90","","17304.7","0.3","113","2","113","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C46 H53 Al N2 O4 S2 -","- C46 H53 Al N2 O4 S2 -","- C736 H848 Al16 N32 O64 S32 -","16","1","","Zhao, Jian; Song, Haibin; Cui, Chunming","Synthesis and Reactions of Aluminum Sulfonamide Alkyls and Hydride","Organometallics","2007","26","8","1947","","10.1021/om0611296","","","0.7107","MoKα","","0.055","0.0482","","","0.1148","0.1193","","","","","","1.085","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4073465","37.796","0.005","37.796","0.005","14.331","0.003","90","","90","","90","","20472","6","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C48.5 H63.5 Au Ga N4 -","- C48.5 H63.5 Au Ga N4 -","- C776 H1016 Au16 Ga16 N64 -","16","1","","Green, Shaun P.; Jones, Cameron; Mills, David P.; Stasch, Andreas","Group 9 and 11 Metal(I) Gallyl Complexes Stabilized by N-Heterocyclic Carbene Coordination: First Structural Characterization of Ga-M (M = Cu or Ag) Bonds","Organometallics","2007","26","14","3424","","10.1021/om700345m","","","0.71073","MoKα","","0.0479","0.0382","","","0.094","0.0986","","","","","","1.067","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4074121","26.8026","0.0013","26.8026","0.0013","9.9436","0.0005","90","","90","","90","","7143.3","0.6","203","2","203","2","","","","","","","","2","I 41/a :2","-I 4ad","88","9,10 diphenyl phenanthrene","9,10-di(phanyl)phenanthrene","","- C26 H18 -","- C26 H18 -","- C416 H288 -","16","1","","Schaub, Thomas; Backes, Marc; Radius, Udo","Nickel(0) Complexes of N-Alkyl-Substituted N-Heterocyclic Carbenes and Their Use in the Catalytic Carbon−Carbon Bond Activation of Biphenylene","Organometallics","2006","25","17","4196","","10.1021/om0604223","","","0.71073","MoKα","","0.0969","0.046","","","0.0963","0.1151","","","","","","0.947","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4074202","8.5731","0.0001","8.5731","0.0001","39.7548","0.0007","90","","90","","90","","2921.9","0.07","90","0.2","90","0.2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Tetrakis-(4-methylcarboxylate-phenyl)stannane","","- C32 H28 O8 Sn -","- C32 H28 O8 Sn -","- C128 H112 O32 Sn4 -","4","0.25","","Shaikh, Nadim S.; Parkin, Sean; Lehmler, Hans-Joachim","The Ullmann Coupling Reaction: A New Approach to Tetraarylstannanes","Organometallics","2006","25","17","4207","","10.1021/om060456a","","","0.71073","MoKα","","0.0319","0.0245","","","0.0517","0.0551","","","","","","1.098","","","","has coordinates","178631","2020-10-21","18:00:00",""
"4074836","25.493","0.0008","25.493","0.0008","12.085","0.0003","90","","90","","90","","7854","0.4","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","Compound X","","","- C80 H60 Cl2 O4 P4 Ru -","- C80 H60 Cl2 O4 P4 Ru -","- C320 H240 Cl8 O16 P16 Ru4 -","4","0.25","","Bernechea, María; Lugan, Noël; Gil, Belén; Lalinde, Elena; Lavigne, Guy","Six-Coordinate Alkynyldiphenylphosphine Ruthenium(II) Complexes: Synthesis, Structure, and Catalytic Activity as ROMP Initiators","Organometallics","2006","25","3","684","","10.1021/om050935u","","","0.71073","MoKα","","0.0932","0.0514","","","0.124","0.1441","","","","","","1.044","","","","has coordinates","178637","2020-10-21","18:00:00",""
"4076021","29.9488","0.0013","29.9488","0.0013","13.7241","0.0009","90","","90","","90","","12309.6","1.1","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C56 H148 B40 N4 Na O8 Sm5 -","- C56 H148 B40 N4 Na O8 Sm5 -","- C224 H592 B160 N16 Na4 O32 Sm20 -","4","0.25","","Cheung, Mak-Shuen; Chan, Hoi-Shan; Bi, Siwei; Lin, Zhenyang; Xie, Zuowei","Functional Sidearm Promoted Electron-Transfer Reactions: A New Route to Metallacarboranes Incorporating theη7-arachno-Carboranyl Ligands","Organometallics","2005","24","18","4333","","10.1021/om050454a","","","0.71073","MoKα","","0.1759","0.1087","","","0.2636","0.3387","","","","","","1.095","","","","has coordinates","178649","2020-10-21","18:00:00",""
"4076485","20.972","0.003","20.972","0.003","15.313","0.004","90","","90","","90","","6735","2","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C34 H28 Br4 Mn4 N8 O14 -","- C34.0016 H28 Br4.0016 Mn4 N8 O14.0016 -","- C136.006 H112 Br16.0064 Mn16 N32 O56.0064 -","4","0.25","","Karthikeyan, S.; Velavan, K.; Sathishkumar, Ranganathan; Varghese, Babu; Manimaran, Bala.","Self-Assembly of Manganese(I)-Based Molecular Squares: Synthesis and Spectroscopic and Structural Characterization","Organometallics","2012","31","5","1953","","10.1021/om201244a","","","0.71073","MoKα","","0.1518","0.0763","","","0.1667","0.1942","","","","","","0.928","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076486","15.4691","0.0007","15.4691","0.0007","27.759","0.003","90","","90","","90","","6642.5","0.8","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C58 H44 Br4 Mn4 N8 O14 -","- C57.996 H32 Br4 Mn4 N8 O14 -","- C231.984 H128 Br16 Mn16 N32 O56 -","4","0.25","","Karthikeyan, S.; Velavan, K.; Sathishkumar, Ranganathan; Varghese, Babu; Manimaran, Bala.","Self-Assembly of Manganese(I)-Based Molecular Squares: Synthesis and Spectroscopic and Structural Characterization","Organometallics","2012","31","5","1953","","10.1021/om201244a","","","0.71073","MoKα","","0.0674","0.0555","","","0.146","0.1523","","","","","","1.178","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4077204","14.484","0.008","14.484","0.008","31.703","0.015","90","","90","","90","","6651","6","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C33 H41 Fe2 Ga O4 -","- C33 H41 Fe2 Ga O4 -","- C264 H328 Fe16 Ga8 O32 -","8","0.5","","Yamaguchi, Takeshi; Ueno, Keiji; Ogino, Hiroshi","Synthesis and Structures of Mesitylgallylene-Bridged Diiron Complexes [Cp‘Fe(CO)]2(μ-CO)(μ-GaMes) (Cp‘ = η-C5Me5, η-C5H5; Mes = 2,4,6-Trimethylphenyl) and Kinetic Study of the Cis−Trans Isomerization of [(η-C5H5)Fe(CO)]2(μ-CO)(μ-GaMes)","Organometallics","2001","20","3","501","","10.1021/om000675a","","","0.71073","MoKα","","0.2371","0.0629","","","0.1087","0.1543","","","","","","0.933","","","","has coordinates","178661","2020-10-21","18:00:00",""
"4078060","34.6611","0.0004","34.6611","0.0004","22.335","0.0003","90","","90","","90","","26833.1","0.6","193","2","193","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C30 H43 N6 O6.5 -","- C30 H43 N6 O6.5 -","- C960 H1376 N192 O208 -","32","2","","Blasberg, Florian; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Mononuclear (O,O′ orN,N′) and Heterodinuclear (O,O′ andN,N′) Transition-Metal Complexes ofortho-Quinoid Bis(pyrazol-1-yl)methane Ligands","Organometallics","2012","31","8","3213","","10.1021/om3000746","","","1.54178","CuKα","","0.1308","0.1109","","","0.3432","0.3694","","","","","","1.533","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078068","41.347","0.004","41.347","0.004","13.4355","0.0019","90","","90","","90","","22969","5","150","2","150","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C64 H43 B F10 O0.25 P2 Ru S -","- C64 H43 B F10 O0.25 P2 Ru S -","- C1024 H688 B16 F160 O4 P32 Ru16 S16 -","16","1","","Dahcheh, Fatme; Stephan, Douglas W.","Ruthenium and Rhodium Complexes of Thioether-Alkynylborates","Organometallics","2012","31","8","3222","","10.1021/om300075r","","","0.71073","MoKα","","0.0716","0.0497","","","0.1085","0.117","","","","","","1.089","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078200","14.669","0.005","14.669","0.005","30.439","0.009","90","","90","","90","","6550","4","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C52 H80 N4 O4 Yb2 -","- C52 H80 N4 O4 Yb2 -","- C208 H320 N16 O16 Yb8 -","4","0.25","","Deacon, Glen B.; Gardiner, Michael G.; Junk, Peter C.; Townley, Josh P.; Wang, Jun","Rare-Earth Metalation of Calix[4]pyrrole/Calix[4]arene Free of Alkali-Metal Companions","Organometallics","2012","31","10","3857","","10.1021/om2011134","","","0.77487","Synchrotron","","0.0488","0.0428","","","0.1114","0.1158","","","","","","1.08","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4079617","21.4058","0.0009","21.4058","0.0009","35.1534","0.0016","90","","90","","90","","16107.6","1.2","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C34.25 H50.5 Cl6.5 Fe N4 -","- C34.25 H50.5 Cl6.5 Fe N4 -","- C548 H808 Cl104 Fe16 N64 -","16","1","","Kaplan, Hilan Z.; Li, Bo; Byers, Jeffery A.","Synthesis and Characterization of a Bis(imino)-N-heterocyclic Carbene Analogue to Bis(imino)pyridine Iron Complexes","Organometallics","2012","31","21","7343","","10.1021/om300885d","","","0.71073","MoKα","","0.0559","0.0433","","","0.1152","0.1253","","","","","","1.078","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4080668","20.9513","0.0016","20.9513","0.0016","41.583","0.007","90","","90","","90","","18253","4","100","2","100","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C105 H82 Cl2 F12 Ir2 N4 O2 P6 -","- C105 H82 Cl2 F12 Ir2 N4 O2 P6 -","- C840 H656 Cl16 F96 Ir16 N32 O16 P48 -","8","0.5","","Luo, Shao-Xiong; Wei, Lu; Zhang, Xin-Hai; Lim, Min Hwee; Lin, K. X. Vivian; Yeo, M. H. Valerie; Zhang, Wen-Hua; Liu, Zhi-Pan; Young, David J.; Hor, T. S. Andy","Enhanced Emission and Analyte Sensing by Cinchonine Iridium(III) Cyclometalated Complexes Bearing Bent Diphosphine Chelators","Organometallics","2013","32","10","2908","","10.1021/om400028n","","","0.71073","MoKα","","0.041","0.0332","","","0.0801","0.0839","","","","","","1.055","","","","has coordinates,has disorder","178695","2020-10-21","18:00:00",""
"4082045","17.3884","0.0002","17.3884","0.0002","43.7105","0.0008","90","","90","","90","","13216.2","0.3","120","2","120","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C78 H70 Cr2 N8 O2 P2 -","- C78 H70 Cr2 N8 O2 P2 -","- C624 H560 Cr16 N64 O16 P16 -","8","0.5","","Stevens, Charlotte J.; Nichol, Gary S.; Arnold, Polly L.; Love, Jason B.","Isocyanide and Phosphine Oxide Coordination in Binuclear Chromium Pacman Complexes","Organometallics","2013","32","23","6879","","10.1021/om4009313","","","1.54184","CuKα","","0.0416","0.0382","","","0.108","0.1111","","","","","","1.062","","","","has coordinates","178709","2020-10-21","18:00:00",""
"4082729","12.2598","0.0006","12.2598","0.0006","38.622","0.003","90","","90","","90","","5805","0.6","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","KEA029","KEA029","","- C32 H35 Ir N2 O7 -","- C32 H35 Ir N2 O7 -","- C256 H280 Ir8 N16 O56 -","8","0.5","","Allen, Kate E.; Heinekey, D. Michael; Goldman, Alan S.; Goldberg, Karen I.","Regeneration of an Iridium(III) Complex Active for Alkane Dehydrogenation Using Molecular Oxygen","Organometallics","2014","33","6","1337","","10.1021/om401241e","","","0.71073","MoKα","","0.0227","0.0168","","","0.0389","0.0421","","","","","","1.084","","","","has coordinates,has disorder","178716","2020-10-21","18:00:00",""
"4083120","20.7502","0.0016","20.7502","0.0016","14.377","0.0011","90","","90","","90","","6190.3","0.8","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","Woo35","","","- C72 H72 B F4 Ir N8 -","- C72 H72 B F4 Ir N8 -","- C288 H288 B4 F16 Ir4 N32 -","4","0.25","","Anding, Bernie J.; Ellern, Arkady; Woo, L. Keith","Comparative Study of Rhodium and Iridium Porphyrin Diaminocarbene and N-Heterocyclic Carbene Complexes","Organometallics","2014","33","9","2219","","10.1021/om500081w","","","0.71073","MoKα","","0.0484","0.0376","","","0.1009","0.1175","","","","","","1.137","","","","has coordinates,has disorder","178720","2020-10-21","18:00:00",""
"4083946","20.7053","0.0004","20.7053","0.0004","13.531","0.0005","90","","90","","90","","5800.9","0.3","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C24 H84 B40 Si5 -","- C24 H84 B40 Si5 -","- C96 H336 B160 Si20 -","4","0.25","","Núñez, Rosario; González-Campo, Arántzazu; Viñas, Clara; Teixidor, Francesc; Sillanpää, Reijo; Kivekäs, Raikko","Boron-Functionalized Carbosilanes: Insertion of Carborane Clusters into Peripheral Silicon Atoms of Carbosilane Compounds","Organometallics","2005","24","26","6351","","10.1021/om050651+","","x-ray","0.71073","Mokα","","0.1225","0.0768","","","0.17","0.1874","","","","","","1.099","","","","has coordinates","178728","2020-10-21","18:00:00",""
"4084696","38.138","0.005","38.138","0.005","14.147","0.002","90","","90","","90","","20577","5","291","2","291","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C53 H48 Cl N4 O4 Re S2 -","- C53 H48 Cl N4 O4 Re S2 -","- C848 H768 Cl16 N64 O64 Re16 S32 -","16","1","","Tao, Tao; Qian, Hui-Fen; Huang, Wei; You, Xiao-Zeng","Tuning the Spectroscopic, Electrochemical, and Single-Crystal Conductance Properties of a Series of Rhenium-Containing Bithiazoles with Different Donor/Acceptor Hybrids","Organometallics","2014","33","19","5120","","10.1021/om500168j","","","0.71073","MoKα","","0.1334","0.0785","","","0.2148","0.2581","","","","","","1.042","","","","has coordinates","178735","2020-10-21","18:00:00",""
"4086068","11.8617","","11.8617","","5.6519","","90","","90","","90","","795.222","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Si (C H2 O H)4","","- C4 H12 O4 Si -","- C4 H12 O4 Si -","- C16 H48 O16 Si4 -","4","0.25","","Ilg, R.; Troegel, D.; Burschka, C.; Tacke, R.","Tetrafunctional silanes of the formula type Si (C H2)4 X (X = S Ac, S H, O Ac, O H, Br, I)","Organometallics","2006","25","","548","551","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4086461","18.753","0.0009","18.753","0.0009","22.8532","0.0011","90","","90","","90","","8036.9","0.7","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","W-complex","","- C38 H64 N6 O2 W2 -","- C38 H64 N6 O2 W2 -","- C304 H512 N48 O16 W16 -","8","0.5","","Farrell, Wesley S.; Yonke, Brendan L.; Reeds, Jonathan P.; Zavalij, Peter Y.; Sita, Lawrence R.","Small-Molecule Activation within the Group 6 Complexes (η5-C5Me5)[N(iPr)C(Me)N(iPr)]M(CO)(L) for M = Mo, W and L = N2, NCMe, η2-Alkene, SMe2, C3H6O","Organometallics","2016","35","8","1132","","10.1021/acs.organomet.6b00131","","","0.71073","MoKα","","0.0195","0.0154","","","0.0313","0.0321","","","","","","0.998","","","","has coordinates,has disorder","182521","2020-10-21","18:00:00",""
"4086690","30.098","0.002","30.098","0.002","18.8104","0.0015","90","","90","","90","","17040","2","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C160 H200 Co4 Fe4 N8 O8 -","- C160 H200 Co4 Fe4 N8 O8 -","- C640 H800 Co16 Fe16 N32 O32 -","4","0.25","","Shepard, Scott M.; Diaconescu, Paula L.","Redox-Switchable Hydroelementation of a Cobalt Complex Supported by a Ferrocene-Based Ligand","Organometallics","2016","35","15","2446","","10.1021/acs.organomet.6b00317","","","0.71073","MoKα","","0.0726","0.0459","","","0.1183","0.1269","","","","","","1.103","","","","has coordinates","186237","2020-10-21","18:00:00",""
"4086692","30.138","0.002","30.138","0.002","18.8213","0.0015","90","","90","","90","","17095","2","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C160 H200 Fe4 N8 O8 Zn4 -","- C160 H200 Fe4 N8 O8 Zn4 -","- C640 H800 Fe16 N32 O32 Zn16 -","4","0.25","","Shepard, Scott M.; Diaconescu, Paula L.","Redox-Switchable Hydroelementation of a Cobalt Complex Supported by a Ferrocene-Based Ligand","Organometallics","2016","35","15","2446","","10.1021/acs.organomet.6b00317","","","0.71073","MoKα","","0.0358","0.0305","","","0.095","0.0975","","","","","","1.178","","","","has coordinates","186237","2020-10-21","18:00:00",""
"4088122","44.813","0.003","44.813","0.003","16.8439","0.0011","90","","90","","90","","33826","4","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C49 H71 Cl15 N6 O3 Ti2 -","- C49 H71 Cl15 N6 O3 Ti2 -","- C784 H1136 Cl240 N96 O48 Ti32 -","16","1","","Wan, Li; Zhang, Dao","Brønsted Base-Induced Rearrangement and Nucleophilic Addition of O/N-Functionalized NHCs and Relative Group 4 Metal Complexes for Ethylene Polymerization Catalysis","Organometallics","2016","35","2","138","","10.1021/acs.organomet.5b00862","","","0.71073","MoKα","","0.0975","0.0602","","","0.157","0.1727","","","","","","0.988","","","","has coordinates,has disorder","237296","2020-10-21","18:00:00",""
"4088494","21.1862","0.0006","21.1862","0.0006","54.0853","0.0017","90","","90","","90","","24276.5","1.2","200","2","200","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C64 H78 Cl2 F2 Mo2 N4 O2 -","- C64 H78 Cl2 F2 Mo2 N4 O2 -","- C1024 H1248 Cl32 F32 Mo32 N64 O32 -","16","1","","Harisomayajula, N. V. Satyachand; Chen, Han-Gung; Kuo, Ting-Shen; Tsai, Yi-Chou","Reductive Cleavage of Acyl Halides to Carboxylato Alkylidyne Complexes from Their Reactions with the Quintuply Bonded Dimolybdenum Amidinate","Organometallics","2016","35","10","1534","","10.1021/acs.organomet.6b00132","","","0.71073","MoKα","","0.0709","0.042","","","0.1136","0.1437","","","","","","1.109","","","","has coordinates,has disorder","237616","2020-10-21","18:00:00",""
"4088693","18.2136","0.0014","18.2136","0.0014","11.7714","0.0014","90","","90","","90","","3905","0.6","143","","143","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C10 H13 N O -","- C10 H13 N O -","- C160 H208 N16 O16 -","16","1","","Shimbayashi, Takuya; Okamoto, Kazuhiro; Ohe, Kouichi","C‒H Activation Induced by Oxidative Addition of N‒O Bonds in Oxime Esters: Formation of Rhodacycles and Cycloaddition with Alkynes","Organometallics","2016","35","11","2026","","10.1021/acs.organomet.6b00311","","","0.71075","MoKα","","0.0621","0.0509","","","0.1314","0.1392","","","","","","1.094","","","","has coordinates","237772","2020-10-21","18:00:00",""
"4088728","14.2559","0.0006","14.2559","0.0006","23.569","0.001","90","","90","","90","","4789.9","0.4","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","BTe","","","- C10 H15 B O2 Te -","- C10 H15 B O2 Te -","- C160 H240 B16 O32 Te16 -","16","1","","Torres Delgado, William; Shahin, Fatemeh; Ferguson, Michael J.; McDonald, Robert; He, Gang; Rivard, Eric","Selective Placement of Bromide and Pinacolboronate Groups about a Tellurophene: New Building Blocks for Optoelectronic Applications","Organometallics","2016","35","12","2140","","10.1021/acs.organomet.6b00362","","","0.71073","MoKα","","0.0195","0.0183","","","0.0455","0.0461","","","","","","1.085","","","","has coordinates,has disorder","237792","2020-10-21","18:00:00",""
"4088904","21.286","0.002","21.286","0.002","19.703","0.003","90","","90","","90","","8927.3","1.8","163","2","163","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C50 H70 Co Yb2 -","- C50 H70 Co Yb2 -","- C400 H560 Co8 Yb16 -","8","0.5","","Walter, Marc D.; Burns, Carol J.; Matsunaga, Phillip T.; Smith, Michael E.; Andersen, Richard A.","Synthesis and Physical Properties of Pentamethylmanganocene, (C5Me5)Mn(C5H5), and the Inclusion Compounds [(C5Me5)2Yb]2[(C5H5)2M] (Where M = V, Cr, Fe, Co)","Organometallics","2016","35","20","3488","","10.1021/acs.organomet.6b00554","","","0.71073","MoKα","","0.0368","0.0214","","","0.0488","0.0518","","","","","","1.114","","","","has coordinates","237876","2020-10-21","18:00:00",""
"4100052","25.057","0.003","25.057","0.003","8.371","0.0005","90","","90","","90","","5255.8","0.7","273.2","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C17 H13 N O2 -","- C17 H14 N O2 -","- C272 H224 N16 O32 -","16","1","","Yamashita, Makoto; Yamamoto, Yohsuke; Akiba, Kin-ya; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Nagase, Shigeru","Syntheses and Structures of Hypervalent Pentacoordinate Carbon and Boron Compounds Bearing an Anthracene Skeleton ‒ Elucidation of Hypervalent Interaction Based on X-ray Analysis and DFT Calculation","Journal of the American Chemical Society","2005","127","12","4354","4371","10.1021/ja0438011","","","","","","","","","","","","","","","","","","","","","has coordinates","218965","2020-10-21","18:00:00",""
"4100160","17.1741","0.0005","17.1741","0.0005","28.797","0.001","90","","90","","90","","8493.8","0.5","173.2","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H30 O2 Si W -","- C20 H30 O2 Si W -","- C320 H480 O32 Si16 W16 -","16","1","","","","Journal of the American Chemical Society","2005","","","","","10.1021/ja050441o","","","","","","","","","","","","","","","","","","","","","has coordinates","178747","2020-10-21","18:00:00",""
"4100190","16.926","0.004","16.926","0.004","38.794","0.016","90","","90","","90","","11114","6","220","2","220","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C102 H120 O44 Si3 -","- C102 H120 O44 Si3 -","- C408 H480 O176 Si12 -","4","0.25","","","","Journal of the American Chemical Society","2005","","","","","10.1021/ja052587t","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","178747","2020-10-21","18:00:00",""
"4100193","17.106","0.005","17.106","0.005","38.635","0.005","90","","90","","90","","11305","5","220","2","220","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C112 H140 O34 Si3 -","- C112 H140 O34 Si3 -","- C448 H560 O136 Si12 -","4","0.25","","","","Journal of the American Chemical Society","2005","","","","","10.1021/ja052587t","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","178747","2020-10-21","18:00:00",""
"4100208","27.6121","0.0011","27.6121","0.0011","31.7727","0.0018","90","","90","","90","","24224.4","1.9","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C61 H100 N3 O4 U -","- C61 H100 N3 O4 U -","- C976 H1600 N48 O64 U16 -","16","1","","","","Journal of the American Chemical Society","2005","","","","","10.1021/ja053497r","","","","","","","","","","","","","","","","","","","","","has coordinates","178748","2020-10-21","18:00:00",""
"4100350","18.048","0.0003","18.048","0.0003","25.862","0.0006","90","","90","","90","","8424","0.3","200","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C76 H94 N4 O -","- C76 H92 N4 O2 -","- C304 H368 N16 O8 -","4","0.25","","Yamamoto, Yohsuke; Yamamoto, Akihiro; Furuta, Shin-ya; Horie, Masanori; Kodama, Megumi; Sato, Wataru; Akiba, Kin-ya; Tsuzuki, Seiji; Uchimaru, Tadafumi; Hashizume, Daisuke; Iwasaki, Fujiko","Synthesis and Structure of 16 π Octaalkyltetraphenylporphyrins","Journal of the American Chemical Society","2005","127","42","14540","14541","10.1021/ja052842+","","","","","","","","","","","","","","","","","","","","","has coordinates","271475","2021-12-16","11:44:43",""
"4100469","33.417","0.002","33.417","0.002","12.6691","0.0018","90","","90","","90","","14148","2","90","2","90","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C72 H98 B4 N4 O8 -","- C72 H98 B4 N4 O8 -","- C576 H784 B32 N32 O64 -","8","0.5","","","","Journal of the American Chemical Society","2005","","","","","10.1021/ja051073r","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","178750","2020-10-21","18:00:00",""
"4100640","26.8549","0.0013","26.8549","0.0013","40.9221","0.0019","90","","90","","90","","29512","2","258","2","258","2","","","","","","","","6","I 41/a :2","-I 4ad","88","IRMOP-54","","","- C180 H120 Fe12 N16 O115 S12 -","- C180 H120 Fe12 N16 O115 S12 -","- C720 H480 Fe48 N64 O460 S48 -","4","0.25","","Andrea C. Sudik; Andrew R. Millward; Nathan W. Ockwig; Adrien P. Cote; Jaheon Kim; Omar M. Yaghi","Design, Synthesis, Structure, and Gas (N2, Ar, CO2, CH4 and H2) Sorption Properties of Porous Metal-Organic Tetrahedral and Heterocuboidal Polyhedra","Journal of the American Chemical Society","2005","","","","","10.1021/ja042802q","","","","","","","","","","","","","","","","","","","","","has coordinates","178752","2020-10-21","18:00:00",""
"4100710","38.2238","0.0008","38.2238","0.0008","12.4091","0.0005","90","","90","","90","","18130.4","0.9","98","2","98","2","","","","","","","","6","I 41/a :2","-I 4ad","88","[PhBP3]CoO(4-tBu-Ph)","","","- C55 H54 B Co O P3 -","- C55 H54 B Co O P3 -","- C880 H864 B16 Co16 O16 P48 -","16","1","","Emmanuel Terazzi; Stephane Torelli; Jean-Pierre Rivera; Jean-Marc Benech; Gerald Bernardinelli; Cyril Bourgogne; Bertrand Donnio; Daniel Guillon; Daniel Imbert; Jean-Claude Bunzli; Andre Pinto; Damien Jeannerat; Claude Piguet","Molecular Control of Macroscopic Cubic, Columnar and Lamellar Organizations in Luminescent Lanthanide-containing Thermotropic Liquid Crystals.","Journal of the American Chemical Society","2005","","","","","10.1021/ja0446101","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","178753","2020-10-21","18:00:00",""
"4101070","23.1968","0.0007","23.1968","0.0007","38.961","0.002","90","","90","","90","","20964.4","1.5","163","2","163","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C50.5 H74.75 Cl0.75 N2.5 O4.75 -","- C50.5 H63 Cl0.75 N2.5 O4.75 -","- C808 H1008 Cl12 N40 O76 -","16","1","","","","Journal of the American Chemical Society","2006","","","","","10.1021/ja057395c","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4101639","15.4355","0.0018","15.4355","0.0018","22.775","0.005","90","","90","","90","","5426.2","1.5","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","bio-MOF-11","","","- C7 H7 Co N5 O2 -","- C7 H7 Co N5 O2 -","- C112 H112 Co16 N80 O32 -","16","1","","An, Jihyun; Geib, Steven J; Rosi, Nathaniel L","High and selective CO2 uptake in a cobalt adeninate metal-organic framework exhibiting pyrimidine- and amino-decorated pores.","Journal of the American Chemical Society","2010","132","1","38","39","10.1021/ja909169x","","","0.71073","MoKα","","0.1371","0.1047","","","0.2834","0.2974","","","","","","2.388","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101643","30.221","0.011","30.221","0.011","23.645","0.012","90","","90","","90","","21595","16","100","2","100","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C35 H43 Li N O6 P Pd S2 -","- C35 H43 Li N O6 P Pd S2 -","- C560 H688 Li16 N16 O96 P16 Pd16 S32 -","16","1","","Shen, Zhongliang; Jordan, Richard F.","Self-assembled tetranuclear palladium catalysts that produce high molecular weight linear polyethylene.","Journal of the American Chemical Society","2010","132","1","52","53","10.1021/ja909473y","","","0.71073","MoKα","","0.0955","0.0603","","","0.1607","0.1708","","","","","","0.871","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4102000","27.8184","0.0009","27.8184","0.0009","13.4328","0.0004","90","","90","","90","","10395.2","0.6","90","2","90","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C72 H128 N4 O48 Ti17 -","- C72 H128 N4 O48 Ti17 -","- C288 H512 N16 O192 Ti68 -","4","0.25","","Jason B. Benedict; Philip Coppens","The Crystalline Nanocluster Phase as a Medium for Structural and Spectroscopic Studies of Light Absorption of Photosensitizer Dyes on Semiconductor Surfaces","Journal of the American Chemical Society","2010","132","","2938","2944","10.1021/ja909600w","","","0.71073","MoKα","","0.1176","0.0757","","","0.2077","0.2579","","","","","","1.142","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00",""
"4102028","26.313","0.004","26.313","0.004","31.709","0.005","90","","90","","90","","21954","6","90","2","90","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C119.52 H156.96 N52.56 O94.8 Pd6 -","- C119.52 H156.96 N52.56 O94.804 Pd6 -","- C478.08 H627.84 N210.24 O379.216 Pd24 -","4","0.25","","Takashi Murase; Shinnosuke Horiuchi; Makoto Fujita","Naphthalene Diels-Alder in a Self-Assembled Molecular Flask","Journal of the American Chemical Society","2010","132","","2866","2867","10.1021/ja9107275","","","0.71073","MoKα","","0.1495","0.0684","","","0.1842","0.2501","","","","","","1.006","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4102029","26.222","0.003","26.222","0.003","31.65","0.006","90","","90","","90","","21762","5","90","2","90","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C132 H173 N48.9 O92.89 Pd6 -","- C132 H173 N48.9 O92.884 Pd6 -","- C528 H692 N195.6 O371.536 Pd24 -","4","0.25","","Takashi Murase; Shinnosuke Horiuchi; Makoto Fujita","Naphthalene Diels-Alder in a Self-Assembled Molecular Flask","Journal of the American Chemical Society","2010","132","","2866","2867","10.1021/ja9107275","","","0.71073","MoKα","","0.1109","0.0655","","","0.1725","0.2122","","","","","","1.068","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4102790","36.0527","0.0004","36.0527","0.0004","20.744","0.0004","90","","90","","90","","26963","0.7","110","2","110","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C54 H72 Cl2 P2 Pt2 -","- C54 H72 Cl2 P2 Pt2 -","- C864 H1152 Cl32 P32 Pt32 -","16","1","","Ariela W. Kaspi; Israel Goldberg; Arkadi Vigalok","Reagent-Dependent Formation of C-C and C-F Bonds in Pt Complexes: An Unexpected Twist in the Electrophilic Fluorination Chemistry","Journal of the American Chemical Society","2010","132","","10626","10627","10.1021/ja101436w","","","0.71073","MoKα","","0.0657","0.0409","","","0.0963","0.1014","","","","","","0.936","","","","has coordinates","178773","2020-10-21","18:00:00",""
"4103046","39.583","0.007","39.583","0.007","9.3091","0.0015","90","","90","","90","","14586","4","100","2","100","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C40 H44 O8 -","- C40 H44 O8 -","- C640 H704 O128 -","16","1","","Tse-Min Teng; Arindam Das; Deepak B. Huple; Rai-Shung Liu","Gold-Catalyzed Stereoselective Synthesis of 9-Oxabicyclo[3.3.1]nona-4,7-dienes from Diverse 1-Oxo-4-oxy-5-ynes: A Viable Formal [4 + 2] Cycloaddition on an s-trans-Heterodiene Framework","Journal of the American Chemical Society","2010","132","","12565","12567","10.1021/ja106493h","","","0.71073","MoKα","","0.1624","0.0745","","","0.1663","0.1991","","","","","","0.929","","","","has coordinates","178776","2020-10-21","18:00:00",""
"4103459","30.5806","0.0007","30.5806","0.0007","68.5594","0.0015","90","","90","","90","","64115","3","120","2","120","2","","","","","","","synthesis as described","4","I 41/a :2","-I 4ad","88","","CpFeMe5C60MeAr5","","- C181 H198 Fe Si5 -","- C146 H111 Fe Si5 -","- C2336 H1776 Fe16 Si80 -","16","1","","Chang-Zhi Li; Yutaka Matsuo; Eiichi Nakamura","Octupole-like Supramolecular Aggregates of Conical Iron Fullerene Complexes into a Three-Dimensional Liquid Crystalline Lattice","Journal of the American Chemical Society","2010","132","","15514","15515","10.1021/ja1073933","","","0.71075","MoKα","","0.2529","0.1418","","","0.3524","0.3835","","","","","","1.815","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4103512","25.0996","0.0005","25.0996","0.0005","70.9292","0.0016","90","","90","","90","","44684.7","1.6","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C216 H359.2 Mn40 N8 Na4 O169.6 -","- C216 H340 Mn40 N8 Na4 O169.6 -","- C864 H1360 Mn160 N32 Na16 O678.4 -","4","0.25","","Eleni E. Moushi; Christos Lampropoulos; Wolfgang Wernsdorfer; Vassilios Nastopoulos; George Christou; Anastasios J. Tasiopoulos","Inducing Single-Molecule Magnetism in a Family of Loop-of-Loops Aggregates: Heterometallic Mn40Na4 Clusters and the Homometallic Mn44 Analogue","Journal of the American Chemical Society","2010","132","","16146","16155","10.1021/ja106666h","","","0.71073","MoKα","","0.114","0.0545","","","0.1537","0.1723","","","","","","0.906","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103515","23.9377","0.0003","23.9377","0.0003","70.072","0.0016","90","","90","","90","","40152.2","1.2","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C216 H355 Cl Mn44 N8 O173 -","- C216 H340 Cl Mn44 N8 O173 -","- C864 H1360 Cl4 Mn176 N32 O692 -","4","0.25","","Eleni E. Moushi; Christos Lampropoulos; Wolfgang Wernsdorfer; Vassilios Nastopoulos; George Christou; Anastasios J. Tasiopoulos","Inducing Single-Molecule Magnetism in a Family of Loop-of-Loops Aggregates: Heterometallic Mn40Na4 Clusters and the Homometallic Mn44 Analogue","Journal of the American Chemical Society","2010","132","","16146","16155","10.1021/ja106666h","","","0.71073","MoKα","","0.1262","0.0664","","","0.1597","0.1714","","","","","","1.01","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00",""
"4103743","10.627","0.011","10.627","0.011","41.608","0.006","90","","90","","90","","4699","7","226","","226","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C25 H24 B4 O8 -","- C25 H24 B4 O8 -","- C100 H96 B16 O32 -","4","0.25","","Jean-Hugues Fournier; Thierry Maris; James D. Wuest; Wenzhuo Guo; Elena Galoppini","Molecular Tectonics. Use of the Hydrogen Bonding of Boronic Acids To Direct Supramolecular Construction","Journal of the American Chemical Society","2003","125","","1002","1006","10.1021/ja0276772","","","1.54178","CuKα","","0.3307","0.0978","","","0.141","0.1594","","","","","","0.981","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103744","10.837","0.0015","10.837","0.0015","45.603","0.009","90","","90","","90","","5355.6","1.5","210","","210","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24 H24 B4 O8 Si -","- C24 H24 B4 O8 Si -","- C96 H96 B16 O32 Si4 -","4","0.25","","Jean-Hugues Fournier; Thierry Maris; James D. Wuest; Wenzhuo Guo; Elena Galoppini","Molecular Tectonics. Use of the Hydrogen Bonding of Boronic Acids To Direct Supramolecular Construction","Journal of the American Chemical Society","2003","125","","1002","1006","10.1021/ja0276772","","","1.54178","CuKα","","0.1508","0.0758","","","0.125","0.1367","","","","","","0.84","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103951","50.3695","0.0007","50.3695","0.0007","48.0517","0.0006","90","","90","","90","","121911","3","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C296 H362 N24 Na20 O162 S16 -","- C290 H204 N24 Na20 O114.4 S16 -","- C2320 H1632 N192 Na160 O915.2 S128 -","8","0.5","","Rita De Zorzi; Nicol Guidolin; Lucio Randaccio; Roberto Purrello; Silvano Geremia","Nanoporous Crystals of Calixarene/Porphyrin Supramolecular Complex Functionalized by Diffusion and Coordination of Metal Ions","Journal of the American Chemical Society","2009","131","","2487","2489","10.1021/ja808850d","","","1","","","0.1379","0.1173","","","0.3237","0.3567","","","","","","1.001","","","","has coordinates,has disorder","289031","2024-01-11","08:35:40",""
"4103952","49.14","0.0007","49.14","0.0007","49.8","0.0006","90","","90","","90","","120254","3","100","2","100","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C276 H354 Cl4 N24 Na16 O168 S16 Zn4 -","- C276 H204 Cl4 N24 Na16 O112 S16 Zn4 -","- C2208 H1632 Cl32 N192 Na128 O896 S128 Zn32 -","8","0.5","","Rita De Zorzi; Nicol Guidolin; Lucio Randaccio; Roberto Purrello; Silvano Geremia","Nanoporous Crystals of Calixarene/Porphyrin Supramolecular Complex Functionalized by Diffusion and Coordination of Metal Ions","Journal of the American Chemical Society","2009","131","","2487","2489","10.1021/ja808850d","","","1","","","0.1214","0.0985","","","0.2575","0.2825","","","","","","0.996","","","","has coordinates","289031","2024-01-11","08:35:45",""
"4104123","28.127","0.013","28.127","","8.879","0.0026","90","","90","","90","","7024","4","298","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C41 H28 N4 -","- C41 H28 N4 -","- C164 H112 N16 -","4","0.25","","Fernando J. Uribe-Romo; Joseph R. Hunt; Hiroyasu Furukawa; Cornelius Klöck; Michael O'Keeffe; Omar M. Yaghi","A Crystalline Imine-Linked 3-D Porous Covalent Organic Framework","Journal of the American Chemical Society","2009","131","","4570","4571","10.1021/ja8096256","powder diffraction","x-ray","1.54059","Kα~1~","","","","","","","","11.91","","11.91","","","","","","","has coordinates,has Fobs","178787","2020-10-21","18:00:00",""
"4104268","15.8698","0.0014","15.8698","0.0014","16.868","0.0014","90","","90","","90","","4248.2","0.6","103","2","103","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C20 H26 Cl2 N3 O2 Ta -","- C20 H26 Cl2 N3 O2 Ta -","- C160 H208 Cl16 N24 O16 Ta8 -","8","0.5","","Andy I. Nguyen; Karen J. Blackmore; Shawn M. Carter; Ryan A. Zarkesh; Alan F. Heyduk","One- and Two-Electron Reactivity of a Tantalum(V) Complex with a Redox-Active Tris(amido) Ligand","Journal of the American Chemical Society","2009","131","","3307","3316","10.1021/ja808542j","","","0.71073","MoKα","","0.0247","0.0187","","","0.0473","0.0513","","","","","","1.063","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4104486","15.7111","0.0008","15.7111","0.0008","6.4101","0.0004","90","","90","","90","","1582.26","0.15","150","1","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C8 H24 N4 P4 -","- C8 H24 N4 P4 -","- C32 H96 N16 P16 -","4","0.25","","Keith Huynh; Alan J. Lough; Michelle A. M. Forgeron; Martin Bendle; Alejandro Presa Soto; Roderick E. Wasylishen; Ian Manners","Synthesis and Reactivity of Phosphine-Stabilized Phosphoranimine Cations, [R3P.PR'2=NSiMe3]+","Journal of the American Chemical Society","2009","131","","7905","7916","10.1021/ja900256g","","","0.71073","MoKα","","0.0494","0.0354","","","0.08","0.0875","","","","","","1.07","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104665","25.993","0.006","25.993","0.006","31.681","0.007","90","","90","","90","","21405","8","80","2","80","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C68 H81 N24 O42.82 Pd3 -","- C68 H81 N24.668 O45.292 Pd3 -","- C544 H648 N197.344 O362.336 Pd24 -","8","0.5","","Jeremy K. Klosterman; Munetaka Iwamura; Tahei Tahara; Makoto Fujita","Energy Transfer in a Mechanically Trapped Exciplex","Journal of the American Chemical Society","2009","131","","9478","9479","10.1021/ja901674g","","","0.71073","MoKα","","0.1058","0.081","","","0.2147","0.2349","","","","","","1.1","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104711","18.502","0.0012","18.502","0.0012","36.985","0.005","90","","90","","90","","12661","2","220","2","220","2","","","","","","","","4","I 41/a :2","-I 4ad","88","dimer","dimer","","- C30 H46 N2 O6 -","- C30 H46 N2 O6 -","- C480 H736 N32 O96 -","16","1","","Christoph Riplinger; Joseph P. Y. Kao; Gerald M. Rosen; Velavan Kathirvelu; Gareth R. Eaton; Sandra S. Eaton; Andrei Kutateladze; Frank Neese","Interaction of Radical Pairs Through-Bond and Through-Space: Scope and Limitations of the Point-Dipole Approximation in Electron Paramagnetic Resonance Spectroscopy","Journal of the American Chemical Society","2009","131","","10092","10106","10.1021/ja901150j","","","0.71073","MoKα","","0.0879","0.0542","","","0.109","0.1221","","","","","","1","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104974","29.8146","0.0005","29.8146","0.0005","6.9588","0.0001","90","","90","","90","","6185.75","0.17","150","","150","","","","","","","","?","5","I 41/a :2","-I 4ad","88","","caesium copper(I) silver(I) cyanide Cs3Ag2Cu3(CN)8","","- C24 Ag6 Cs9 Cu9 N24 -","- C24 Ag6 Cs9 Cu9 N24 -","- C96 Ag24 Cs36 Cu36 N96 -","4","0.25","","Ann M. Chippindale; Simon J. Hibble","Helices, Chirality and Interpenetration: the Versatility and Remarkable Interconversion of Silver-Copper Cyanide Frameworks","Journal of the American Chemical Society","2009","131","","12736","12744","10.1021/ja903841e","","","0.71073","MoKα","","0.0474","0.0379","","0.0505","0.0466","0.0466","","","","","","0.9729","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105445","30.2865","0.0002","30.2865","0.0002","14.7582","0.0002","90","","90","","90","","13537.3","0.2","223","2","223","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C38 H45 N P2 -","- C38 H45 N P2 -","- C608 H720 N16 P32 -","16","1","","Kirsten Spannhoff; Nadine Kuhl; Gerald Kehr; Roland Fröhlich; Gerhard Erker","Remarkable Product Diversity in the ""Self-Organized"" Reaction of Deprotonated Acetonitrile with Chlorophosphines","Journal of the American Chemical Society","2009","131","","17836","17842","10.1021/ja905676a","","","0.71073","MoKα","","0.099","0.0489","","","0.1157","0.1356","","","","","","1.014","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4106482","16.976","0.0004","16.976","0.0004","43.55","0.002","90","","90","","90","","12550.4","0.7","153","2","153","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C72 H76 Cl8 Ir4 N8 O8 -","- C72 H76 Cl8 Ir4 N8 O8 -","- C288 H304 Cl32 Ir16 N32 O32 -","4","0.25","","Fabian M. Conrady; Roland Fröhlich; Christian Schulte to Brinke; Tania Pape; F. Ekkehardt Hahn","Stepwise Formation of a Molecular Square with Bridging NH,O-Substituted Dicarbene Building Blocks","Journal of the American Chemical Society","2011","133","","11496","11499","10.1021/ja205021p","","","0.71073","MoKα","","0.1067","0.0762","","","0.1743","0.1913","","","","","","1.15","","","","has coordinates","178810","2020-10-21","18:00:00",""
"4106562","24.3203","0.0012","24.3203","0.0012","40.323","0.0019","90","","90","","90","","23850","2","293","2","293","2","","","","","","","","8","I 41/a :2","-I 4ad","88","[Ni(PCy2NPh2)(PPh2NPh2)(MeCN)](BF4)2","","","- C59.5 H74.75 B2 F8 N5 Ni O0.38 P4 -","- C59.58 H74.85 B2.005 F8.035 N5 Ni O0.38 P4 -","- C953.28 H1197.6 B32.08 F128.56 N80 Ni16 O6.08 P64 -","16","1","","Brandon R. Galan; Julia Schöffel; John C. Linehan; Candace Seu; Aaron M. Appel; John A. S. Roberts; Monte L. Helm; Uriah J. Kilgore; Jenny Y. Yang; Daniel L. DuBois; Clifford P. Kubiak","Electrocatalytic Oxidation of Formate by [Ni(PR2NR'2)2(CH3CN)]2+ Complexes","Journal of the American Chemical Society","2011","133","","12767","12779","10.1021/ja204489e","","","0.71073","MoKα","","0.0855","0.064","","","0.1763","0.1949","","","","","","1.033","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107310","61.7239","0.0011","61.7239","0.0011","26.9189","0.0005","90","","90","","90","","102557","3","153","2","153","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C222 H276 Ag30 N60 -","- C222 H276 Ag30 N60 -","- C3552 H4416 Ag480 N960 -","16","1","","Jie-Peng Zhang; Susumu Kitagawa","Supramolecular Isomerism, Framework Flexibility, Unsaturated Metal Center, and Porous Property of Ag(I)/Cu(I) 3,3',5,5'-Tetrametyl-4,4'-Bipyrazolate","Journal of the American Chemical Society","2008","130","","907","917","10.1021/ja075408b","","","0.71073","MoKα","","0.0821","0.0548","","","0.1051","0.1158","","","","","","1.051","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107458","15.7383","0.001","15.7383","0.001","13.9964","0.0012","90","","90","","90","","3466.8","0.4","100","2","100","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C24 H56 N2 Ni P4 S2 Se2 -","- C24 H56 N2 Ni P4 S2 Se2 -","- C96 H224 N8 Ni4 P16 S8 Se8 -","4","0.25","","Arunkumar Panneerselvam; Mohammad A. Malik; Mohammad Afzaal; Paul O'Brien; Madeleine Helliwell","The Chemical Vapor Deposition of Nickel Phosphide or Selenide Thin Films from a Single Precursor","Journal of the American Chemical Society","2008","130","","2420","2421","10.1021/ja078202j","","","0.71073","MoKα","","0.0321","0.0253","","","0.0638","0.0684","","","","","","1.082","","","","has coordinates,has disorder","178820","2020-10-21","18:00:00",""
"4107691","14.9","0.002","14.9","0.002","38.795","0.005","90","","90","","90","","8613","2","123.2","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C47 H53 N O10 -","- C47 H50 N O10 -","- C376 H400 N8 O80 -","8","0.5","","Tomoki Ogoshi; Suguru Kanai; Shuhei Fujinami; Tada-aki Yamagishi; Yoshiaki Nakamoto","para-Bridged Symmetrical Pillar[5]arenes: Their Lewis Acid Catalyzed Synthesis and Host-Guest Property","Journal of the American Chemical Society","2008","130","","5022","5023","10.1021/ja711260m","","","0.7107","MoKα","","","0.0459","","","","0.0635","","","","","","1.067","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108511","24.5467","0.0012","24.5467","0.0012","72.387","0.006","90","","90","","90","","43616","5","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C52 H31 Cu2 O12 -","- C52 H30.75 Cu2 O12 -","- C832 H492 Cu32 O192 -","16","1","","Liqing Ma; Wenbin Lin","Chirality-Controlled and Solvent-Templated Catenation Isomerism in Metal-Organic Frameworks","Journal of the American Chemical Society","2008","130","","13834","13835","10.1021/ja804944r","","","0.71073","MoKα","","0.1447","0.0849","","","0.2125","0.2248","","","","","","0.997","","","","has coordinates,has disorder","178831","2020-10-21","18:00:00",""
"4108610","19.851","0.006","19.851","","8.639","0.003","90","","90","","90","","3404.3","1.6","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C24 H60 Li4 N8 -","- C24 H60 Li4 N8 -","- C96 H240 Li16 N32 -","4","0.25","","Viktoria H. Gessner; Carsten Strohmann","Lithiation of TMEDA and its Higher Homologous TEEDA: Understanding Observed α- and β-Deprotonation","Journal of the American Chemical Society","2008","130","","14412","14413","10.1021/ja8058205","","","0.71073","MoKα","","0.0614","0.0496","","","0.1155","0.1237","","","","","","1.088","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108864","44.817","0.003","44.817","0.003","25.2047","0.0016","90","","90","","90","","50625","6","100","2","100","2","","","","","","","synthesis as described","5","I 41/a :2","-I 4ad","88","","","","- C88.66667 H107.33333 Fe2 P4 Si4 -","- C88.6667 H107.333 Fe2 P4 Si4 -","- C2128 H2576 Fe48 P96 Si96 -","24","1.5","","Paul Hamon; Frederic Justaud; Olivier Cador; Philippe Hapiot; Stéphane Rigaut; Loïc Toupet; Lahcène Ouahab; Harald Stueger; Jean-René Hamon; Claude Lapinte","Redox-Active Organometallics: Magnetic and Electronic Couplings through Carbon-Silicon Hybrid Molecular Connectors","Journal of the American Chemical Society","2008","130","","17372","17383","10.1021/ja804608z","","x-ray","0.71073","MoKα","","0.089","0.0632","","","0.1305","0.1422","","","","","","1.063","","","","has coordinates","264242","2021-04-16","08:51:53",""
"4109033","11.0586","0.0019","11.0586","0.0019","38.711","0.013","90","","90","","90","","4734","2","173","2","173","2","","","","","","","synthesis as described","4","I 41/a :2","-I 4ad","88","","","","- C24 H38 Ni P2 -","- C24 H38 Ni P2 -","- C192 H304 Ni8 P16 -","8","0.5","","Alana L. Keen; Meghan Doster; Samuel A. Johnson","1,4-Shifts in a Dinuclear Ni(I) Biarylyl Complex: A Mechanistic Study of C-H Bond Activation by Monovalent Nickel","Journal of the American Chemical Society","2007","129","","810","819","10.1021/ja067112w","","x-ray","0.71073","MoKα","","0.0458","0.0385","","","0.0878","0.0918","","","","","","1.152","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109139","22.498","0.002","22.498","0.002","5.9121","0.0011","90","","90","","90","","2992.5","0.7","193","2","193","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C9 H9 N O -","- C9 H9 N O -","- C144 H144 N16 O16 -","16","1","","Derrick L. J. Clive; Mai P. Pham; Rajendra Subedi","Carbocyclization by Radical Closure onto O-Trityl Oximes: Dramatic Effect of Diphenyl Diselenide","Journal of the American Chemical Society","2007","129","","2713","2717","10.1021/ja067117t","","","0.71073","MoKα","","0.096","0.0444","","","0.0982","0.1191","","","","","","0.997","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109486","26.2759","0.0019","26.2759","0.0019","31.734","0.005","90","","90","","90","","21910","4","80","2","80","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C134 H167 N43 O111.5 Pd6 -","- C134.24 H167.44 N43 O111.52 Pd6 -","- C536.96 H669.76 N172 O446.08 Pd24 -","4","0.25","","Yuki Nishioka; Takumi Yamaguchi; Michito Yoshizawa; Makoto Fujita","Unusual [2+4] and [2+2] Cycloadditions of Arenes in the Confined Cavity of Self-Assembled Cages","Journal of the American Chemical Society","2007","129","","7000","7001","10.1021/ja071591x","","","0.71073","MoKα","","0.1076","0.0712","","","0.2021","0.2419","","","","","","1.026","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109487","26.283","0.012","26.283","0.012","32.15","0.03","90","","90","","90","","22209","3","82","2","82","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C138 H169 N43 O126 Pd6 -","- C138.24 H169.44 N43 O126 Pd6 -","- C552.96 H677.76 N172 O504 Pd24 -","4","0.25","","Yuki Nishioka; Takumi Yamaguchi; Michito Yoshizawa; Makoto Fujita","Unusual [2+4] and [2+2] Cycloadditions of Arenes in the Confined Cavity of Self-Assembled Cages","Journal of the American Chemical Society","2007","129","","7000","7001","10.1021/ja071591x","","","0.71073","MoKα","","0.1218","0.0812","","","0.2162","0.2602","","","","","","1.053","","","","has coordinates,has disorder","178840","2020-10-21","18:00:00",""
"4109732","18.869","0.002","18.869","0.002","23.021","0.004","90","","90","","90","","8196.4","1.9","223","2","223","2","","","","","","","","5","I 41/a :2","-I 4ad","88","Ta-dimer","","","- C36 H64 Cl2 N6 Ta2 -","- C36 H64 Cl2 N6 Ta2 -","- C288 H512 Cl16 N48 Ta16 -","8","0.5","","Masakazu Hirotsu; Philip P. Fontaine; Albert Epshteyn; Lawrence R. Sita","Dinitrogen Activation at Ambient Temperatures: New Modes of H2 and PhSiH3 Additions for an ""End-On-Bridged"" [Ta(IV)]2(μ-η1:η1-N2) Complex and for the Bis(μ-nitrido) [Ta(V)(μ-N)]2 Product Derived from Facile N\τbN Bond Cleavage","Journal of the American Chemical Society","2007","129","","9284","9285","10.1021/ja072248v","","","0.71073","MoKα","","0.0563","0.031","","","0.0638","0.0893","","","","","","1","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109826","23.705","0.003","23.705","0.003","11.409","0.002","90","","90","","90","","6411","1.6","113","2","113","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C16 H26 Co5 O21 -","- C16 H26 Co5 O21 -","- C128 H208 Co40 O168 -","8","0.5","","Zhuojia Lin; David S. Wragg; John E. Warren; Russell E. Morris","Anion Control in the Ionothermal Synthesis of Coordination Polymers","Journal of the American Chemical Society","2007","129","","10334","10335","10.1021/ja0737671","","","0.71073","MoKα","","0.1034","0.0846","","","0.2071","0.2224","","","","","","1.11","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4110447","25.2178","0.0015","25.2178","0.0015","17.4913","0.0012","90","","90","","90","","11123.4","1.2","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","bis(mu2-trifluoroacetateo-O,O')-bis(mu2-pivolate-O,O')-(bismuth-rhodium) -pivolic acid adduct","","- C19 H28 Bi F6 O10 Rh -","- C18.97 H27.91 Bi F5.94 O10 Rh -","- C303.52 H446.56 Bi16 F95.04 O160 Rh16 -","16","1","","Evgeny V. Dikarev; Bo Li; Haitao Zhang","Tuning the Properties at Heterobimetallic Core: Mixed-Ligand Bismuth-Rhodium Paddlewheel Carboxylates","Journal of the American Chemical Society","2006","128","","2814","2815","10.1021/ja058294h","","","0.71073","MoKα","","0.0763","0.0463","","","0.0992","0.1119","","","","","","1.034","","","","has coordinates,has disorder","178875","2020-10-21","18:00:00",""
"4110611","26.9948","0.0016","26.9948","0.0016","12.7245","0.0011","90","","90","","90","","9272.6","1.1","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C36 H40 Br16 Cl8 Mn12 O48 -","- C36 H24 Br16.02 Cl8.376 Mn12 O48 -","- C144 H96 Br64.08 Cl33.504 Mn48 O192 -","4","0.25","","Nicole E. Chakov; Sheng-Chiang Lee; Andrew G. Harter; Philip L. Kuhns; Arneil P. Reyes; Stephen O. Hill; N. S. Dalal; Wolfgang Wernsdorfer; Khalil A. Abboud; George Christou","The Properties of the [Mn12O12(O2CR)16(H2O)4] Single-Molecule Magnets in Truly Axial Symmetry: [Mn12O12(O2CCH2Br)16(H2O)4].4CH2Cl2","Journal of the American Chemical Society","2006","128","","6975","6989","10.1021/ja060796n","","","0.71073","MoKα","","0.0805","0.0568","","","0.1543","0.1648","","","","","","1.075","","","","has coordinates,has disorder","178877","2020-10-21","18:00:00",""
"4110709","33.5715","0.0007","33.5715","0.0007","68.2468","0.0014","90","","90","","90","","76917","3","153","2","153","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C640 H1072 Cu24 N32 O176 -","- C524 H768 Cu24 N4 O144 -","- C2096 H3072 Cu96 N16 O576 -","4","0.25","","Hiroyasu Furukawa; Jaheon Kim; Katherine E. Plass; Omar M. Yaghi","Crystal Structure, Dissolution, and Deposition of a 5 nm Functionalized Metal-Organic Great Rhombicuboctahedron","Journal of the American Chemical Society","2006","128","","8398","8399","10.1021/ja062491e","","","0.71073","MoKα","","0.183","0.1178","","","0.3336","0.3641","","","","","","1.066","","","","has coordinates","178878","2020-10-21","18:00:00",""
"4111421","7.261","0.004","7.261","0.004","25.471","0.019","90","","90","","90","","1342.9","1.4","158","2","158","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C7 H6 O4 Zn -","- C7 H6 O4 Zn -","- C56 H48 O32 Zn8 -","8","0.5","","Nathaniel L. Rosi; Jaheon Kim; Mohamed Eddaoudi; Banglin Chen; Michael O'Keeffe; Omar M. Yaghi","Rod Packings and Metal-Organic Frameworks Constructed from Rod-Shaped Secondary Building Units","Journal of the American Chemical Society","2005","127","","1504","1518","10.1021/ja045123o","","","0.71073","MoKα","","0.081","0.0586","","","0.1553","0.1687","","","","","","1.093","","","","has coordinates","178885","2020-10-21","18:00:00",""
"4111542","25.985","0.003","25.985","0.003","13.1692","0.0019","90","","90","","90","","8892.1","1.9","240","2","273","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C40 H52 Cl2 Mn2 N4 Ni2 O8 -","- C40 H52 Cl2 Mn2 N4 Ni2 O8 -","- C320 H416 Cl16 Mn16 N32 Ni16 O64 -","8","0.5","","Hiroki Oshio; Masayuki Nihei; Satoshi Koizumi; Takuya Shiga; Hiroyuki Nojiri; Motohiro Nakano; Naoki Shirakawa; Mitsuhiro Akatsu","A Heterometal Single-Molecule Magnet of [MnIII2NiII2Cl2(salpa)2]","Journal of the American Chemical Society","2005","127","","4568","4569","10.1021/ja042217p","","","0.71073","MoKα","","0.1108","0.0548","","","0.1428","0.1578","","","","","","0.987","","","","has coordinates","178886","2020-10-21","18:00:00",""
"4112161","13.8195","0.0004","13.8195","0.0004","26.189","0.002","90","","90","","90","","5001.5","0.4","123","2","123","2","","","","","","","chemical synthesis","4","I 41/a :2","-I 4ad","88","","1,2-dimethyl-4,5-bis(phenothiazin-10-yl)benzene","","- C32 H24 N2 S2 -","- C32 H24 N2 S2 -","- C256 H192 N16 S16 -","8","0.5","","Duoli Sun; Sergiy V. Rosokha; Jay K. Kochi","Donor-Acceptor (Electronic) Coupling in the Precursor Complex to Organic Electron Transfer: Intermolecular and Intramolecular Self-Exchange between Phenothiazine Redox Centers","Journal of the American Chemical Society","2004","126","","1388","1401","10.1021/ja038746v","","","0.71073","MoKα","","0.0712","0.0563","","0.1631","0.1437","","","","1.021","1.047","1.047","","","","","has coordinates","178892","2020-10-21","18:00:00",""
"4112300","19.13","0.005","19.13","0.005","11.379","0.004","90","","90","","90","","4164","2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","dinickel aspartato-diaqua-oxide tetrahydrate","","- C4 H13 N Ni2 O9 -","- C4 N Ni2 O9 -","- C64 N16 Ni32 O144 -","16","1","","Ekaterina V. Anokhina; Allan J. Jacobson","[Ni2O(l-Asp)(H2O)2].4H2O: A Homochiral 1D Helical Chain Hybrid Compound with Extended Ni-O-Ni Bonding","Journal of the American Chemical Society","2004","126","","3044","3045","10.1021/ja031836f","","","0.71073","MoKα","","0.1502","0.0602","","","0.1255","0.1441","","","","","","0.896","","","","has coordinates","178894","2020-10-21","18:00:00",""
"4112656","26.917","0.004","26.917","0.004","12.114","0.002","90","","90","","90","","8777","2","301","2","301","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C20 H31 N2 O5.5 -","- C20 H30 N2 O5.5 -","- C320 H480 N32 O88 -","16","1","","Dan Yang; Yu-Hui Zhang; Bing Li; Dan-Wei Zhang; Jenny Chun-Yu Chan; Nian-Yong Zhu; Shi-Wei Luo; Yun-Dong Wu","Effect of Side Chains on Turns and Helices in Peptides of β3-Aminoxy Acids","Journal of the American Chemical Society","2004","126","","6956","6966","10.1021/ja049976s","","","0.71069","MoKα","","0.1189","0.0897","","","0.2606","0.278","","","","","","1.067","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4112703","15.092","0.002","15.092","0.002","13.016","0.003","90","","90","","90","","2964.6","0.9","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C20 H20 Cl6 Cu6 N4 S4 -","- C20 H20 Cl6 Cu6 N4 S4 -","- C80 H80 Cl24 Cu24 N16 S16 -","4","0.25","","Jian-Kai Cheng; Yuan-Gen Yao; Jian Zhang; Zhao-Ji Li; Zong-Wei Cai; Xiang-You Zhang; Zhong-Ning Chen; Yu-Biao Chen; Yao Kang; Ye-Yan Qin; Yi-Hang Wen","A Simultaneous Redox, Alkylation, Self-Assembly Reaction under Solvothermal Conditions Afforded a Luminescent Copper(I) Chain Polymer Constructed of Cu3I4- and EtS-4-C5H4N+Et Components (Et = CH3CH2)","Journal of the American Chemical Society","2004","126","","7796","7797","10.1021/ja048624i","","","0.71073","MoKα","","0.0962","0.0569","","","0.1623","0.1924","","","","","","1.031","","","","has coordinates","178898","2020-10-21","18:00:00",""
"4112765","16.7925","0.0006","16.7925","0.0006","17.456","0.0009","90","","90","","90","","4922.4","0.4","203","","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","[Fe4(sap)4(MeOH)4]2H2O","","","- C44 H60 Fe4 N4 O14 -","- C11 H15 Fe N O3.5 -","- C176 H240 Fe16 N16 O56 -","16","1","","Hiroki Oshio; Norihisa Hoshino; Tasuku Ito; Motohiro Nakano","Single-Molecule Magnets of Ferrous Cubes: Structurally Controlled Magnetic Anisotropy","Journal of the American Chemical Society","2004","126","","8805","8812","10.1021/ja0487933","","","0.71073","MoKα","","0.04","0.0316","","","0.0847","0.0908","","","","","","1.032","","","","has coordinates","178898","2020-10-21","18:00:00",""
"4112766","17.0854","0.0018","17.0854","0.0018","18.391","0.002","90","","90","","90","","5368.5","1","203","","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","[Fe4(5-Br-sap)4(MeOH)4]","","- C44 H56 Br4 Fe4 N4 O12 -","- C44 H52 Br4 Fe4 N4 O12 -","- C176 H208 Br16 Fe16 N16 O48 -","4","0.25","","Hiroki Oshio; Norihisa Hoshino; Tasuku Ito; Motohiro Nakano","Single-Molecule Magnets of Ferrous Cubes: Structurally Controlled Magnetic Anisotropy","Journal of the American Chemical Society","2004","126","","8805","8812","10.1021/ja0487933","","","0.71073","MoKα","","0.0754","0.0612","","","0.1671","0.1763","","","","","","0.905","","","","has coordinates","178898","2020-10-21","18:00:00",""
"4112770","16.5583","0.0009","16.5583","0.0009","18.7408","0.0015","90","","90","","90","","5138.3","0.6","203","","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","[Fe4(3,5-Cl2-sae)4(MeOH)4]","","- C40 H44 Cl8 Fe4 N4 O12 -","- C40 H44 Cl8 Fe4 N4 O12 -","- C160 H176 Cl32 Fe16 N16 O48 -","4","0.25","","Hiroki Oshio; Norihisa Hoshino; Tasuku Ito; Motohiro Nakano","Single-Molecule Magnets of Ferrous Cubes: Structurally Controlled Magnetic Anisotropy","Journal of the American Chemical Society","2004","126","","8805","8812","10.1021/ja0487933","","","0.71073","MoKα","","0.0533","0.0296","","","0.0591","0.0626","","","","","","0.845","","","","has coordinates","178898","2020-10-21","18:00:00",""
"4112919","31.853","0.0003","31.853","0.0003","8.438","0.0002","90","","90","","90","","8561.3","0.2","293","2","293","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C22 H36 U -","- C22 H36 U -","- C352 H576 U16 -","16","1","","Eyal Barnea; Tamer Andrea; Moshe Kapon; Jean-Claude Berthet; Michel Ephritikhine; Moris S. Eisen","Catalytic Coupling of Terminal Alkynes with Isonitriles Promoted by Organoactinide Complexes","Journal of the American Chemical Society","2004","126","","10860","10861","10.1021/ja046604a","","","0.71073","MoKα","","0.0514","0.0288","","","0.0546","0.0575","","","","","","0.909","","","","has coordinates","178900","2020-10-21","18:00:00",""
"4113001","15.099","0.001","15.099","0.001","14.607","0.001","90","","90","","90","","3330.1","0.4","296.2","","","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H44 I N8 O14 Rh4 -","- C16 H40 I N8 O14 Rh4 -","- C64 H160 I4 N32 O56 Rh16 -","4","0.25","","Yasuhiro Fuma; Masahiro Ebihara; Shoichi Kutsumizu; Takashi Kawamura","A Diamondoid Network of Tetrakis(acetamidato)dirhodium in Mixed Oxidation States Linked by μ4-Iodide Having a 105 Enhancement of Its Electrical Conductivity by Water Molecules of Hydration","Journal of the American Chemical Society","2004","126","","12238","12239","10.1021/ja047421r","","","0.7107","MoKα","","","0.0279","","","","0.0547","","","","","","0.586","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4113030","30.8925","0.0011","30.8925","0.0011","26.6992","0.0013","90","","90","","90","","25480.3","1.8","153","2","153","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C64 H32 N20 O12 Re4 -","- C64 H32 N20 O12 Re4 -","- C512 H256 N160 O96 Re32 -","8","0.5","","Peter H. Dinolfo; Mary Elizabeth Williams; Charlotte L. Stern; Joseph T. Hupp","Rhenium-Based Molecular Rectangles as Frameworks for Ligand-Centered Mixed Valency and Optical Electron Transfer","Journal of the American Chemical Society","2004","126","","12989","13001","10.1021/ja0473182","","","0.71069","MoKα","","0.1555","0.0655","","","0.2085","0.2873","","","","","","1.027","","","","has coordinates","178901","2020-10-21","18:00:00",""
"4113140","32.486","0.006","32.486","0.006","12.05","0.003","90","","90","","90","","12717","5","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C68 H64 Cl2 O4 P4 Rh2 S2 -","- C68 H64 Cl2 O4 P4 Rh2 S2 -","- C544 H512 Cl16 O32 P32 Rh16 S16 -","8","0.5","","Aaron M. Brown; Maxim V. Ovchinnikov; Charlotte L. Stern; Chad A. Mirkin","Halide-Induced Supramolecular Ligand Rearrangement","Journal of the American Chemical Society","2004","126","","14316","14317","10.1021/ja045316b","","","0.71073","MoKα","","0.2825","0.1324","","","0.2799","0.3427","","","","","","1.006","","","","has coordinates","178902","2020-10-21","18:00:00",""
"4113417","21.087","0.002","21.087","0.002","35.582","0.006","90","","90","","90","","15822","3","293","2","293","2","","","","","","","","3","I 41/a :2","-I 4ad","88","UCR-19ZnGaS-TETA","","","- Ga26 S51 Zn4 -","- Ga26 S51 Zn4 -","- Ga104 S204 Zn16 -","4","0.25","","Nanfeng Zheng; Xianhui Bu; Pingyun Feng","Nonaqueous Synthesis and Selective Crystallization of Gallium Sulfide Clusters into Three-Dimensional Photoluminescent Superlattices","Journal of the American Chemical Society","2003","125","","1138","1139","10.1021/ja021274k","","","0.71073","MoKα","","0.1229","0.0608","","","0.1943","0.2197","","","","","","1.001","","","","has coordinates","178905","2020-10-21","18:00:00",""
"4113855","33.3063","0.0015","33.3063","0.0015","13.8485","0.0009","90","","90","","90","","15362.3","1.4","193","2","193","2","","","","","","","","8","I 41/a :2","-I 4ad","88","compound(1a)","","","- C32 H24 Au2 F3 N2 O7 P2 S -","- C32 H24 Au2 F3 N2 O7 P2 S -","- C512 H384 Au32 F48 N32 O112 P32 S16 -","16","1","","Young-A Lee; Richard Eisenberg","Luminescence Tribochromism and Bright Emission in Gold(I) Thiouracilate Complexes","Journal of the American Chemical Society","2003","125","","7778","7779","10.1021/ja034560k","","","0.71073","MoKα","","0.0631","0.0516","","","0.1441","0.1508","","","","","","1.073","","","","has coordinates","178909","2020-10-21","18:00:00",""
"4114509","19.8263","0.0017","19.8263","0.0017","15.23","0.003","90","","90","","90","","5986.6","1.4","170","2","170","2","","","","","","","","5","I 41/a :2","-I 4ad","88","[FeTC~6~TPP(1-MeIm)~2~]Cl","","","- C70 H68 Cl5 Fe N8 -","- C70 H68 Cl5 Fe N8 -","- C280 H272 Cl20 Fe4 N32 -","4","0.25","","Liliya A. Yatsunyk; Michael D. Carducci; F. Ann Walker","Low-Spin Ferriheme Models of the Cytochromes: Correlation of Molecular Structure with EPR Spectral Type","Journal of the American Chemical Society","2003","125","","15986","16005","10.1021/ja036398r","","","0.71073","MoKα","","0.1219","0.0565","","","0.1459","0.1731","","","","","","0.925","","","","has coordinates,has disorder","178916","2020-10-21","18:00:00",""
"4115100","24.597","0.006","24.597","0.006","44.088","0.015","90","","90","","90","","26674","13","293","2","293","2","","","","","","","","2","I 41/a :2","-I 4ad","88","UCR-15","","","- In44 S72 -","- In44 S72 -","- In176 S288 -","4","0.25","","Cheng Wang; Xianhui Bu; Nanfeng Zheng; Pingyun Feng","Nanocluster with One Missing Core Atom: A Three-Dimensional Hybrid Superlattice Built from Dual-Sized Supertetrahedral Clusters","Journal of the American Chemical Society","2002","124","","10268","10269","10.1021/ja020735z","","","0.71073","MoKα","","0.1887","0.0769","","","0.2082","0.2517","","","","","","1.062","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115167","37.276","0.005","37.276","0.005","12.423","0.002","90","","90","","90","","17262","4","98","2","98","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C53 H47 B Co O2 P3 -","- C53 H47 B Co O2 P3 -","- C848 H752 B16 Co16 O32 P48 -","16","1","","David M. Jenkins; Theodore A. Betley; Jonas C. Peters","Oxidative Group Transfer to Co(I) Affords a Terminal Co(III) Imido Complex","Journal of the American Chemical Society","2002","124","","11238","11239","10.1021/ja026852b","","","0.71073","MoKα","","0.1815","0.0724","","","0.097","0.1072","","","","","","1.348","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4115276","23.703","0.002","23.703","0.002","10.2725","0.0007","90","","90","","90","","5771.4","0.8","296.2","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C17 H18 O2 -","- C17 H18 O2 -","- C272 H288 O32 -","16","1","","Makoto Yasuda; Kay Hirata; Mitsuyoshi Nishino; Akihiro Yamamoto; Akio Baba","Diastereoselective Addition of γ-Substituted Allylic Nucleophiles to Ketones: Highly Stereoselective Synthesis of Tertiary Homoallylic Alcohols Using an Allylic Tributylstannane/Stannous Chloride System","Journal of the American Chemical Society","2002","124","","13442","13447","10.1021/ja0274047","","","0.7107","MoKα","","","0.0361","","","","0.0783","","","","","","0.658","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115450","25.441","0.004","25.441","0.004","20.308","0.004","90","","90","","90","","13144","4","200","2","200","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C108 H144 Cd10 P4 Se16 -","- C108 H144 Cd10 P4 Se16 -","- C432 H576 Cd40 P16 Se64 -","4","0.25","","V. N. Soloviev; A. Eichhöfer; D. Fenske; U. Banin","Size-Dependent Optical Spectroscopy of a Homologous Series of CdSe Cluster Molecules","Journal of the American Chemical Society","2001","123","","2354","2364","10.1021/ja003598j","","","0.71073","MoKα","","0.0716","0.0528","","","0.1462","0.1594","","","","","","1.107","","","","has coordinates","178925","2020-10-21","18:00:00",""
"4115894","28.3805","0.0004","28.3805","0.0004","22.0986","0.0002","90","","90","","90","","17799.4","0.4","188","2","188","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C48 H112 N32 O54 S2 -","- C48 H48 N32 O53.6 S2 -","- C384 H384 N256 O428.8 S16 -","8","0.5","","Jaheon Kim; In-Sun Jung; Soo-Young Kim; Eunsung Lee; Jin-Koo Kang; Shigeru Sakamoto; Kentaro Yamaguchi; Kimoon Kim","New Cucurbituril Homologues: Syntheses, Isolation, Characterization, and X-ray Crystal Structures of Cucurbit[n]uril (n= 5, 7, and 8)","Journal of the American Chemical Society","2000","122","","540","541","10.1021/ja993376p","","","0.71073","MoKα","","0.112","0.1002","","","0.2747","0.2899","","","","","","1.042","","","","has coordinates,has disorder","178929","2020-10-21","18:00:00",""
"4116298","34.003","0.003","34.003","0.003","8.3206","0.0011","90","","90","","90","","9620.3","1.7","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","{(C5Me5)Ru}2B4H10","","- C20 H40 B4 Ru2 -","- C20 H40 B4 Ru2 -","- C320 H640 B64 Ru32 -","16","1","","Xinjian Lei; Maoyu Shang; Thomas P. Fehlner","Chemistry of Dimetallaboranes Derived from the Reaction of [Cp*MCl2]2 with Monoboranes (M = Ru, Rh; Cp* = η5-C5Me5)","Journal of the American Chemical Society","1999","121","","1275","1287","10.1021/ja982954j","","","0.71073","MoKα","","0.0364","0.0278","","0.0879","0.0658","","","","1.067","1.006","1.006","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116376","24.0738","0.0002","24.0738","0.0002","68.5828","0.0005","90","","90","","90","","39747","0.5","170","2","170","2","","","","","","","synthetic","5","I 41/a :2","-I 4ad","88","","","","- C186 H234 Ga4 N30 O42 -","- C197 H163 Ga4 N20 O32 -","- C1576 H1304 Ga32 N160 O256 -","8","0.5","","Thomas Beissel; Ryan E. Powers; Tatjana N. Parac; Kenneth N. Raymond","Dynamic Isomerization of a Supramolecular Tetrahedral M4L6 Cluster1","Journal of the American Chemical Society","1999","121","","4200","4206","10.1021/ja984046s","","","0.71073","MoKα","","0.1234","0.0888","","0.2523","0.2205","","","","1.033","1.085","1.085","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116968","8.0422","0.0005","8.0422","0.0005","24.653","0.002","90","","90","","90","","1594.48","0.19","150","2","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Tetraisopropoxysilane","","- C12 H28 O4 Si -","- C12 H28 O4 Si -","- C48 H112 O16 Si4 -","4","0.25","","Norbert W. Mitzel; Alexander J. Blake; David W. H. Rankin","β-Donor Bonds in SiON Units: An Inherent Structure- Determining Property Leading to (4 + 4)-Coordination in Tetrakis-(N,N-dimethylhydroxylamido)silane","Journal of the American Chemical Society","1997","119","","4143","4148","10.1021/ja9640004","","","1.54184","CuKα","","0.0336","0.0314","","0.0827","0.0782","","","","1.102","1.121","1.121","","","","","has coordinates","178940","2020-10-21","18:00:00",""
"4117032","5.9164","0.0004","5.9164","0.0004","19.712","0.003","90","","90","","90","","689.99","0.12","223","2","223","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","Lithium dinitramide","","- Li N3 O4 -","- Li N3 O4 -","- Li8 N24 O32 -","8","0.5","","Richard Gilardi; J. Flippen-Anderson; Clifford George; Ray J. Butcher","A New Class of Flexible Energetic Salts: The Crystal Structures of the Ammonium, Lithium, Potassium, and Cesium Salts of Dinitramide","Journal of the American Chemical Society","1997","119","","9411","9416","10.1021/ja9709280","","","1.54178","CuKα","","0.0464","0.0409","","0.1112","0.1068","","","","1.155","1.193","1.193","","","","","has coordinates","178941","2020-10-21","18:00:00",""
"4117200","28.605","0.002","28.605","0.002","9.969","0.001","90","","90","","90","","8157.1","1.1","130","2","130","2","","","","","","","synthetic","5","I 41/a :2","-I 4ad","88","H~2~F~20~DPP","5,10,15,20-tetrakis-(pentafluorophenyl)-2,3,7,8,12,13,17,18-octaphenyl- porphyrin","","- C96 H50 Cl8 F20 N4 -","- C96 H50 Cl8 F20 N4 -","- C384 H200 Cl32 F80 N16 -","4","0.25","","Daniel J. Nurco; Craig J. Medforth; Timothy P. Forsyth; Marilyn M. Olmstead; Kevin M. Smith","Conformational Flexibility in Dodecasubstituted Porphyrins","Journal of the American Chemical Society","1996","118","","10918","10919","10.1021/ja962164e","","","1.54178","CuKα","","0.0461","0.0396","","0.1169","0.1088","","","","0.727","0.741","0.741","","","","","has coordinates","178943","2020-10-21","18:00:00",""
"4117449","8.795","0.002","8.795","","27.918","0.009","90","","90","","90","","2159.5","0.9","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H12 Co N10 O4 -","- C20 H12 Co N10 O4 -","- C80 H48 Co4 N40 O16 -","4","0.25","","Matthew G. Cowan; Juan Olguín; Suresh Narayanaswamy; Jeffery L. Tallon; Sally Brooker","Reversible Switching of a Cobalt Complex by Thermal, Pressure, and Electrochemical Stimuli: Abrupt, Complete, Hysteretic Spin Crossover","Journal of the American Chemical Society","2012","134","","2892","2894","10.1021/ja208429u","","","0.71073","MoKα","","0.0657","0.0469","","","0.1214","0.1338","","","","","","1.02","","","","has coordinates","178945","2020-10-21","18:00:00",""
"4117538","21.8413","0.0002","21.8413","0.0002","36.2785","0.0007","90","","90","","90","","17306.4","0.4","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C70 H120 Cd4 In16 N20 S31 -","- C70 H120 Cd4 In16 N20 S31 -","- C280 H480 Cd16 In64 N80 S124 -","4","0.25","","Tao Wu; Xianhui Bu; Puhong Liao; Le Wang; Shou-Tian Zheng; Richard Ma; Pingyun Feng","Superbase Route to Supertetrahedral Chalcogenide Clusters","Journal of the American Chemical Society","2012","134","","3619","3622","10.1021/ja210039u","","","0.71073","MoKα","","0.1409","0.0714","","","0.2314","0.3224","","","","","","1.072","","","","has coordinates","178946","2020-10-21","18:00:00",""
"4118056","10.4865","0.0012","10.4865","0.0012","5.8982","0.0007","90","","90","","90","","648.61","0.13","130","2","130","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C6 H10 Zn -","- C6 H10 Zn -","- C24 H40 Zn4 -","4","0.25","","Crispin Lichtenberg; Julien Engel; Thomas P. Spaniol; Ulli Englert; Gerhard Raabe; Jun Okuda","Bis(allyl)zinc Revisited: Sigma versus Pi Bonding of Allyl Coordination","Journal of the American Chemical Society","2012","134","","9805","9811","10.1021/ja303480a","","","0.71073","MoKα","","0.0185","0.0165","","","0.0426","0.044","","","","","","1.143","","","","has coordinates,has disorder","178951","2020-10-21","18:00:00",""
"4118254","39.0484","0.0015","39.0484","0.0015","13.8013","0.0006","90","","90","","90","","21043.9","1.5","90","2","90","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C84 H148 N4 O48 Ti17 -","- C84 H148 N4 O48 Ti17 -","- C336 H592 N16 O192 Ti68 -","4","0.25","","Jesse D. Sokolow; Elzbieta Trzop; Yang Chen; Jiji Tang; Laura J. Allen; Robert H. Crabtree; Jason B. Benedict; Philip Coppens","Binding Modes of Carboxylate- and Acetylacetonate-Linked Chromophores to Homodisperse Polyoxotitanate Nanoclusters","Journal of the American Chemical Society","2012","134","","11695","11700","10.1021/ja303692r","","","0.71073","MoKα","","0.1083","0.0584","","","0.1493","0.168","","","","","","0.959","","","","has coordinates,has disorder","178953","2020-10-21","18:00:00",""
"4118256","27.857","0.003","27.857","0.003","13.2097","0.0012","90","","90","","90","","10250.9","1.8","90","2","90","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C72 H128 N4 O48 Ti17 -","- C72 H128 N4 O48 Ti17 -","- C288 H512 N16 O192 Ti68 -","4","0.25","","Jesse D. Sokolow; Elzbieta Trzop; Yang Chen; Jiji Tang; Laura J. Allen; Robert H. Crabtree; Jason B. Benedict; Philip Coppens","Binding Modes of Carboxylate- and Acetylacetonate-Linked Chromophores to Homodisperse Polyoxotitanate Nanoclusters","Journal of the American Chemical Society","2012","134","","11695","11700","10.1021/ja303692r","","","0.71073","MoKα","","0.0777","0.0475","","","0.1133","0.138","","","","","","1.124","","","","has coordinates,has disorder","178953","2020-10-21","18:00:00",""
"4119958","18.5111","0.0012","18.5111","0.0012","9.7964","0.0007","90","","90","","90","","3356.8","0.4","143","1","143","1","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C24 H14 N2 O2 -","- C24 H14 N2 O2 -","- C192 H112 N16 O16 -","8","0.5","","Robert-André F. Rarig; Mai N. Tran; David M. Chenoweth","Synthesis and Conformational Dynamics of the Reported Structure of Xylopyridine A","Journal of the American Chemical Society","2013","135","","9213","9219","10.1021/ja404737q","","","0.71073","MoKα","","0.0358","0.0308","","","0.076","0.0805","","","","","","1.036","","","","has coordinates,has disorder","178970","2020-10-21","18:00:00",""
"4120392","23.229","0.003","23.229","0.003","9.9083","0.0016","90","","90","","90","","5346.4","1.3","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C30 H28 B2 Br2 -","- C30 H28 B2 Br2 -","- C240 H224 B16 Br16 -","8","0.5","","Christian Reus; Sabine Weidlich; Michael Bolte; Hans-Wolfram Lerner; Matthias Wagner","C-Functionalized, Air- and Water-Stable 9,10-Dihydro-9,10-diboraanthracenes: Efficient Blue to Red Emitting Luminophores","Journal of the American Chemical Society","2013","135","","12892","12907","10.1021/ja406766e","","","0.71073","MoKα","","0.1458","0.0678","","","0.1303","0.1608","","","","","","0.947","","","","has coordinates,has disorder","178980","2020-10-21","18:00:00",""
"4120400","22.998","0.003","22.998","0.003","9.8225","0.0013","90","","90","","90","","5195.2","1.2","173","2","173","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C32 H28 Br2 -","- C32 H28 Br2 -","- C256 H224 Br16 -","8","0.5","","Christian Reus; Sabine Weidlich; Michael Bolte; Hans-Wolfram Lerner; Matthias Wagner","C-Functionalized, Air- and Water-Stable 9,10-Dihydro-9,10-diboraanthracenes: Efficient Blue to Red Emitting Luminophores","Journal of the American Chemical Society","2013","135","","12892","12907","10.1021/ja406766e","","","0.71073","MoKα","","0.1252","0.0732","","","0.1272","0.1415","","","","","","1.116","","","","has coordinates,has disorder","178981","2020-10-21","18:00:00",""
"4120557","26.374","0.003","26.374","0.003","31.884","0.003","90","","90","","90","","22178","4","90","2","90","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C126 H156 F28 N44.56 O91.35 Pd6 -","- C126 H156 F28 N44.564 O91.348 Pd6 -","- C504 H624 F112 N178.256 O365.392 Pd24 -","4","0.25","","Takezawa, Hiroki; Murase, Takashi; Resnati, Giuseppe; Metrangolo, Pierangelo; Fujita, Makoto","Recognition of polyfluorinated compounds through self-aggregation in a cavity.","Journal of the American Chemical Society","2014","136","5","1786","1788","10.1021/ja412893c","","","0.71073","MoKα","","0.1188","0.0774","","","0.226","0.2633","","","","","","1.028","","","","has coordinates,has disorder","178982","2020-10-21","18:00:00",""
"4120558","26.059","0.002","26.059","0.002","31.879","0.003","90","","90","","90","","21648","3","90","2","90","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C124.8 H152.4 F8.4 N45.48 O85.02 Pd6 -","- C124.8 H152.4 F8.4 N45.484 O85.024 Pd6 -","- C499.2 H609.6 F33.6 N181.936 O340.096 Pd24 -","4","0.25","","Takezawa, Hiroki; Murase, Takashi; Resnati, Giuseppe; Metrangolo, Pierangelo; Fujita, Makoto","Recognition of polyfluorinated compounds through self-aggregation in a cavity.","Journal of the American Chemical Society","2014","136","5","1786","1788","10.1021/ja412893c","","","0.71073","MoKα","","0.087","0.0689","","","0.1922","0.2206","","","","","","1.042","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4120559","26.037","0.002","26.037","0.002","31.484","0.003","90","","90","","90","","21344","3","90","2","90","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C126.8 H144 F16.78 N45.92 O78.76 Pd6 -","- C126.8 H144 F16.776 N45.92 O78.76 Pd6 -","- C507.2 H576 F67.104 N183.68 O315.04 Pd24 -","4","0.25","","Takezawa, Hiroki; Murase, Takashi; Resnati, Giuseppe; Metrangolo, Pierangelo; Fujita, Makoto","Recognition of polyfluorinated compounds through self-aggregation in a cavity.","Journal of the American Chemical Society","2014","136","5","1786","1788","10.1021/ja412893c","","","0.71073","MoKα","","0.0866","0.0671","","","0.191","0.2163","","","","","","1.047","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4120561","25.941","0.005","25.941","0.005","31.667","0.006","90","","90","","90","","21310","7","90","2","90","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C268 H288 F40 N91.25 O168.2 Pd12 -","- C268 H288 F40 N91.256 O168.176 Pd12 -","- C536 H576 F80 N182.512 O336.352 Pd24 -","2","0.125","","Takezawa, Hiroki; Murase, Takashi; Resnati, Giuseppe; Metrangolo, Pierangelo; Fujita, Makoto","Recognition of polyfluorinated compounds through self-aggregation in a cavity.","Journal of the American Chemical Society","2014","136","5","1786","1788","10.1021/ja412893c","","","0.71073","MoKα","","0.1317","0.0826","","","0.226","0.2562","","","","","","1.082","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4120562","25.93","0.003","25.93","0.003","31.605","0.003","90","","90","","90","","21250","4","90","2","90","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C132 H146.72 F20 N48.09 O85.32 Pd6 -","- C132 H146.72 F20 N48.092 O85.324 Pd6 -","- C528 H586.88 F80 N192.368 O341.296 Pd24 -","4","0.25","","Takezawa, Hiroki; Murase, Takashi; Resnati, Giuseppe; Metrangolo, Pierangelo; Fujita, Makoto","Recognition of polyfluorinated compounds through self-aggregation in a cavity.","Journal of the American Chemical Society","2014","136","5","1786","1788","10.1021/ja412893c","","","0.71073","MoKα","","0.0925","0.066","","","0.1773","0.2036","","","","","","1.047","","","","has coordinates,has disorder","178982","2020-10-21","18:00:00",""
"4120613","17.4249","0.0004","17.4249","0.0004","16.3359","0.0004","90","","90","","90","","4960","0.2","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C50 H72 Ir2 O P4 -","- C50 H72 Ir2 O P4 -","- C200 H288 Ir8 O4 P16 -","4","0.25","","Burford, Richard J.; Piers, Warren E.; Ess, Daniel H.; Parvez, Masood","Reversible Interconversion Between a Monomeric Iridium Hydroxo and a Dinuclear Iridium μ-Oxo Complex.","Journal of the American Chemical Society","2014","136","8","3256","","10.1021/ja412650s","","","0.71073","MoKα","","0.0321","0.0255","","","0.0539","0.0586","","","","","","1.115","","","","has coordinates","178983","2020-10-21","18:00:00",""
"4120704","27.8949","0.001","27.8949","0.001","16.4272","0.0007","90","","90","","90","","12782.4","0.8","153","2","153","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C42 H31 N3 O3 -","- C41 H27 N3 O2 -","- C656 H432 N48 O32 -","16","1","","Kim, Sung Kuk; Lim, Jong Min; Pradhan, Tuhin; Jung, Hyo Sung; Lynch, Vincent M.; Kim, Jong Seung; Kim, Dongho; Sessler, Jonathan L.","Self-association and nitroaromatic-induced deaggregation of pyrene substituted pyridine amides.","Journal of the American Chemical Society","2014","136","1","495","505","10.1021/ja411672f","","","0.7107","MoKα","","0.1475","0.0745","","","0.1451","0.153","","","","","","1.711","","","","has coordinates","178984","2020-10-21","18:00:00",""
"4121096","28.7128","0.0012","28.7128","0.0012","7.4609","0.0004","90","","90","","90","","6151","0.5","150","2","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","Molecular Analogue of COF-320","","","- C78 H58 Cl2 N4 -","- C78 H58 Cl2 N4 -","- C312 H232 Cl8 N16 -","4","0.25","","Yue-Biao Zhang; Jie Su; Hiroyasu Furukawa; Yifeng Yun; Felipe Gándara; Adam Duong; Xiaodong Zou; Omar M. Yaghi","Single-Crystal Structure of a Covalent Organic Framework","Journal of the American Chemical Society","2013","135","","16336","16339","10.1021/ja409033p","","","1.54178","CuKα","","0.0736","0.0474","","","0.1193","0.1343","","","","","","1.059","","","","has coordinates,has disorder","179012","2020-10-21","18:00:00",""
"4121439","22.896","0.003","22.896","0.003","95.642","0.019","90","","90","","90","","50138","14","120","2","120","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C228 H214 Cu8 F48 N40 O3 P8 -","- C216 H184 Cu8 F48 N40 P8 -","- C1728 H1472 Cu64 F384 N320 P64 -","8","0.5","","Meng, Wenjing; League, Aaron B.; Ronson, Tanya K.; Clegg, Jack K.; Isley, 3rd, William C; Semrouni, David; Gagliardi, Laura; Cramer, Christopher J.; Nitschke, Jonathan R.","Empirical and Theoretical Insights into the Structural Features and Host-Guest Chemistry of M8L4 Tube Architectures.","Journal of the American Chemical Society","2014","136","10","3972","3980","10.1021/ja412964r","","","1.5418","CuKα","","0.1149","0.1048","","","0.3081","0.3179","","","","","","1.042","","","","has coordinates,has disorder","192777","2020-10-21","18:00:00",""
"4122228","16.5583","0.0009","16.5583","0.0009","18.7408","0.0015","90","","90","","90","","5138.3","0.6","203.15","","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","[Fe4(3,5-Cl2-sae)4(MeOH)4]","","- C40 H44 Cl8 Fe4 N4 O12 -","- C40 H44 Cl8 Fe4 N4 O12 -","- C160 H176 Cl32 Fe16 N16 O48 -","4","0.25","","Oshio, Hiroki; Hoshino, Norihisa; Ito, Tasuku; Nakano, Motohiro","Single-molecule magnets of ferrous cubes: structurally controlled magnetic anisotropy.","Journal of the American Chemical Society","2004","126","28","8805","8812","10.1021/ja0487933","","","0.71073","MoKα","","0.0533","0.0296","","","0.0591","0.0626","","","","","","0.845","","","","has coordinates","179024","2020-10-21","18:00:00",""
"4122230","17.0854","0.0018","17.0854","0.0018","18.391","0.002","90","","90","","90","","5368.5","1","203.15","","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","[Fe4(5-Br-sap)4(MeOH)4]","","- C44 H56 Br4 Fe4 N4 O12 -","- C44 H52 Br4 Fe4 N4 O12 -","- C176 H208 Br16 Fe16 N16 O48 -","4","0.25","","Oshio, Hiroki; Hoshino, Norihisa; Ito, Tasuku; Nakano, Motohiro","Single-molecule magnets of ferrous cubes: structurally controlled magnetic anisotropy.","Journal of the American Chemical Society","2004","126","28","8805","8812","10.1021/ja0487933","","","0.71073","MoKα","","0.0754","0.0612","","","0.1671","0.1763","","","","","","0.905","","","","has coordinates","179024","2020-10-21","18:00:00",""
"4122770","23.758","0.002","23.758","0.002","22.318","0.002","90","","90","","90","","12597.2","1.9","293","2","293","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C26.5 H31.5 Ag F6 N4 O0.75 P S -","- C26.5 H29 Ag F6 N4 O0.75 P S -","- C424 H464 Ag16 F96 N64 O12 P16 S16 -","16","1","","Bassanetti, Irene; Comotti, Angiolina; Sozzani, Piero; Bracco, Silvia; Calestani, Gianluca; Mezzadri, Francesco; Marchiò, Luciano","Porous molecular crystals by macrocyclic coordination supramolecules.","Journal of the American Chemical Society","2014","136","42","14883","14895","10.1021/ja507555j","","","0.71073","MoKα","","0.0616","0.042","","","0.1091","0.1215","","","","","","1.027","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4123478","26.251","0.005","26.251","0.005","11.422","0.002","90","","90","","90","","7871","3","153","2","153","2","","","","","","","","2","I 41/a :2","-I 4ad","88","","","","- C25 H26 -","- C25 H26 -","- C400 H416 -","16","1","","Xue, Fei; Zhao, Jin; Hor, T. S. Andy; Hayashi, Tamio","Nickel-catalyzed three-component domino reactions of aryl grignard reagents, alkynes, and aryl halides producing tetrasubstituted alkenes.","Journal of the American Chemical Society","2015","137","9","3189","3192","10.1021/ja513166w","","","0.71073","MoKα","","0.0915","0.0532","","","0.1296","0.155","","","","","","1.019","","","","has coordinates,has disorder","179036","2020-10-21","18:00:00",""
"4123890","21.6737","0.0002","21.6737","0.0002","9.6282","0.0002","90","","90","","90","","4522.84","0.11","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.0274","0.023","","","0.0897","0.096","","","","","","0.841","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4123891","21.708","0.0016","21.708","0.0016","9.636","0.002","90","","90","","90","","4540.8","1.1","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.2611","0.2243","","","0.5596","0.5753","","","","","","1.164","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4123892","21.8286","0.0001","21.8286","0.0001","9.636","0.0001","90","","90","","90","","4591.44","0.06","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Mn2 N24 Nb O4 -","- C32 H40 Mn2 N24 Nb O4 -","- C128 H160 Mn8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.0266","0.0236","","","0.1019","0.105","","","","","","0.952","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4124094","10.0668","","10.0668","","9.6466","","90","","90","","90","","977.591","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","K5.76 Ga5.76 Si10.24 O32 (H2 O)9.936","","- Ga5.76 H19.872 K5.76 O41.936 Si10.24 -","- Ga5.76 K5.76 O41.936 Si10.24 -","- Ga5.76 K5.76 O41.936 Si10.24 -","1","0.0625","","Lee Yongjae; Kim Sun Jin; Kao Chichang; Vogt, T.","Pressure-induced hydration and order-disorder transition in a synthetic potassium gallosilicate zeolite with gismondine topology","Journal of the American Chemical Society","2008","130","","2842","2850","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124095","10.0517","","10.0517","","9.6148","","90","","90","","90","","971.447","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","K5.76 Ga5.76 Si10.24 O32 (H2 O)9.664","","- Ga5.76 H19.328 K5.76 O41.664 Si10.24 -","- Ga5.76 K5.76 O41.664 Si10.24 -","- Ga5.76 K5.76 O41.664 Si10.24 -","1","0.0625","","Lee Yongjae; Kim Sun Jin; Vogt, T.; Kao Chichang","Pressure-induced hydration and order-disorder transition in a synthetic potassium gallosilicate zeolite with gismondine topology","Journal of the American Chemical Society","2008","130","","2842","2850","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124096","10.0548","","10.0548","","9.5433","","90","","90","","90","","964.818","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","K5.76 Ga5.76 Si10.24 O32 (H2 O)11.584","","- Ga5.76 H23.168 K5.76 O43.584 Si10.24 -","- Ga5.76 K5.76 O43.584 Si10.24 -","- Ga5.76 K5.76 O43.584 Si10.24 -","1","0.0625","","Lee Yongjae; Kim Sun Jin; Kao Chichang; Vogt, T.","Pressure-induced hydration and order-disorder transition in a synthetic potassium gallosilicate zeolite with gismondine topology","Journal of the American Chemical Society","2008","130","","2842","2850","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124097","10.0835","","10.0835","","9.4084","","90","","90","","90","","956.618","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","K5.76 Ga5.76 Si10.24 O32 (H2 O)11.904","","- Ga5.76 H23.808 K5.76 O43.904 Si10.24 -","- Ga5.76 K5.76 O43.904 Si10.24 -","- Ga5.76 K5.76 O43.904 Si10.24 -","1","0.0625","","Lee Yongjae; Kim Sun Jin; Kao Chichang; Vogt, T.","Pressure-induced hydration and order-disorder transition in a synthetic potassium gallosilicate zeolite with gismondine topology","Journal of the American Chemical Society","2008","130","","2842","2850","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124098","10.0741","","10.0741","","9.3033","","90","","90","","90","","944.169","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","K5.76 Ga5.76 Si10.24 O32 (H2 O)11.920","","- Ga5.76 H23.84 K5.76 O43.92 Si10.24 -","- Ga5.76 K5.76 O43.92 Si10.24 -","- Ga5.76 K5.76 O43.92 Si10.24 -","1","0.0625","","Lee Yongjae; Kim Sun Jin; Kao Chichang; Vogt, T.","Pressure-induced hydration and order-disorder transition in a synthetic potassium gallosilicate zeolite with gismondine topology","Journal of the American Chemical Society","2008","130","","2842","2850","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124099","10.0621","","10.0621","","9.2185","","90","","90","","90","","933.335","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","K5.76 Ga5.76 Si10.24 O32 (H2 O)12.368","","- Ga5.76 H24.736 K5.76 O44.368 Si10.24 -","- Ga5.76 K5.76 O44.368 Si10.24 -","- Ga5.76 K5.76 O44.368 Si10.24 -","1","0.0625","","Lee Yongjae; Kim Sun Jin; Kao Chichang; Vogt, T.","Pressure-induced hydration and order-disorder transition in a synthetic potassium gallosilicate zeolite with gismondine topology","Journal of the American Chemical Society","2008","130","","2842","2850","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124213","21.6751","0.0019","21.6751","0.0019","9.526","0.002","90","","90","","90","","4475.4","1.1","296","2","296","2","300000","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Mn2 N24 Nb O4 -","- C32 H40 Mn2 N24 Nb O4 -","- C128 H160 Mn8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.102","0.0831","","","0.2343","0.2714","","","","","","0.922","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4124214","21.537","0.002","21.537","0.002","9.417","0.003","90","","90","","90","","4368","1.5","296","2","296","2","660000","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Mn2 N24 Nb O4 -","- C32 H40 Mn2 N24 Nb O4 -","- C128 H160 Mn8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.1203","0.0973","","","0.2863","0.3358","","","","","","1.141","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4124215","21.499","0.004","21.499","0.004","9.41","0.003","90","","90","","90","","4349.4","1.8","296","2","296","2","760000","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Mn2 N24 Nb O4 -","- C32 H40 Mn2 N24 Nb O4 -","- C128 H160 Mn8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.1108","0.0849","","","0.2372","0.2892","","","","","","1.159","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4124216","21.3237","0.0018","21.3237","0.0018","9.287","0.002","90","","90","","90","","4222.8","1","296","2","296","2","1270000","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Mn2 N24 Nb O4 -","- C32 H40 Mn2 N24 Nb O4 -","- C128 H160 Mn8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.1207","0.1048","","","0.2877","0.3217","","","","","","1.198","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4124217","21.2734","0.0017","21.2734","0.0017","9.258","0.003","90","","90","","90","","4189.8","1.4","296","2","296","2","1400000","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Mn2 N24 Nb O4 -","- C32 H40 Mn2 N24 Nb O4 -","- C128 H160 Mn8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.0956","0.0768","","","0.2093","0.245","","","","","","1.155","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4124218","21.1568","0.0005","21.1568","0.0005","9.303","0.004","90","","90","","90","","4164.1","1.8","296","2","296","2","1500000","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Mn2 N24 Nb O4 -","- C32 H40 Mn2 N24 Nb O4 -","- C128 H160 Mn8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.0736","0.0547","","","0.1205","0.1345","","","","","","1.057","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4124219","21.0887","0.0005","21.0887","0.0005","9.254","0.003","90","","90","","90","","4115.6","1.3","296","2","296","2","1980000","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Mn2 N24 Nb O4 -","- C32 H40 Mn2 N24 Nb O4 -","- C128 H160 Mn8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.0601","0.0423","","","0.1075","0.1207","","","","","","1.184","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4124220","20.897","0.015","20.897","0.015","9.21","0.014","90","","90","","90","","4022","7","296","2","296","2","2420000","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Mn2 N24 Nb O4 -","- C32 H40 Mn2 N24 Nb O4 -","- C128 H160 Mn8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.1182","0.0772","","","0.1893","0.2152","","","","","","1.146","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4124221","21.14","0.003","21.14","0.003","8.903","0.002","90","","90","","90","","3978.7","1.2","296","2","296","2","2710000","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Mn2 N24 Nb O4 -","- C32 H40 Mn2 N24 Nb O4 -","- C128 H160 Mn8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.1413","0.1129","","","0.3092","0.3485","","","","","","1.182","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4124222","21.6165","0.0006","21.6165","0.0006","9.5995","0.0009","90","","90","","90","","4485.6","0.5","296","2","296","2","120000","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.1265","0.0618","","","0.1298","0.1588","","","","","","1.11","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4124223","21.4","0.003","21.4","0.003","9.438","0.002","90","","90","","90","","4322.2","1.3","296","2","296","2","550000","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.1671","0.0955","","","0.2223","0.2718","","","","","","1.164","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4124224","21.116","0.003","21.116","0.003","9.5","0.03","90","","90","","90","","4236","13","296","2","296","2","890000","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.1663","0.0816","","","0.1891","0.234","","","","","","1.198","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4124225","20.986","0.002","20.986","0.002","9.26","0.03","90","","90","","90","","4078","13","296","2","296","2","1550000","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.1656","0.0677","","","0.1307","0.1615","","","","","","1.157","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4124226","20.717","0.002","20.717","0.002","9.222","0.006","90","","90","","90","","3958","3","296","2","296","2","1870000","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.2107","0.0758","","","0.153","0.2195","","","","","","1.043","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4124227","20.6","0.02","20.6","0.02","9.16","0.02","90","","90","","90","","3887","10","296","2","296","2","2120000","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.197","0.0766","","","0.1662","0.2199","","","","","","1.128","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4124228","20.546","0.005","20.546","0.005","9.061","0.017","90","","90","","90","","3825","7","296","2","296","2","2360000","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.3042","0.0775","","","0.1058","0.1628","","","","","","0.912","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4124229","20.47","0.02","20.47","0.02","9.24","0.02","90","","90","","90","","3872","10","296","2","296","2","2600000","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.486","0.1896","","","0.2743","0.3697","","","","","","1.19","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4124230","20.47","0.004","20.47","0.004","9.1","0.1","90","","90","","90","","3813","4","296","2","296","2","2880000","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Pinkowicz, Dawid; Rams, Michał; Mišek, Martin; Kamenev, Konstantin V.; Tomkowiak, Hanna; Katrusiak, Andrzej; Sieklucka, Barbara","Enforcing Multifunctionality: A Pressure-Induced Spin-Crossover Photomagnet.","Journal of the American Chemical Society","2015","137","27","8795","8802","10.1021/jacs.5b04303","","","0.71073","MoKα","","0.2092","0.0439","","","0.0753","0.1285","","","","","","0.853","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4128539","17.1853","0.00023","17.1853","","20.4819","0.0004","90","","90","","90","","6049.01","0.14","298","","298","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C10 H16 Fe2 N S4 -","- C10 H16 Fe2 N S4 -","- C160 H256 Fe32 N16 S64 -","16","1","","Horwitz, Noah E.; Xie, Jiaze; Filatov, Alexander S.; Papoular, Robert J.; Shepard, William E.; Zee, David Z.; Grahn, Mia P.; Gilder, Chloe; Anderson, John S.","Redox-Active 1D Coordination Polymers of Iron-Sulfur Clusters.","Journal of the American Chemical Society","2019","141","9","3940","3951","10.1021/jacs.8b12339","powder diffraction","x-ray","0.412748","synchrotron","","","","","","","","0.04894","","2.02","","","","","","","has coordinates","221620","2020-10-21","18:00:00",""
"4129179","23.4416","0.0004","23.4416","0.0004","63.1632","0.0019","90","","90","","90","","34708.7","1.3","170","2","170","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C144 H128 Fe4 Mo2 N32 -","- C144 H128 Fe4 Mo2 N32 -","- C1152 H1024 Fe32 Mo16 N256 -","8","0.5","","Arczyński, Mirosław; Stanek, Jan; Sieklucka, Barbara; Dunbar, Kim R.; Pinkowicz, Dawid","Site-Selective Photoswitching of Two Distinct Magnetic Chromophores in a Propeller-Like Molecule To Achieve Four Different Magnetic States.","Journal of the American Chemical Society","2019","","","","","10.1021/jacs.9b09576","","","0.6889","synchrotron","","0.2232","0.1159","","","0.353","0.4033","","","","","","1.06","","","","has coordinates","231141","2020-10-21","18:00:00",""
"4129180","23.1795","0.00006","23.1795","0.00006","62.6916","0.0003","90","","90","","90","","33683.5","0.2","30","2","30","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C144 H128 Fe4 Mo2 N32 -","- C144 H128 Fe4 Mo2 N32 -","- C1152 H1024 Fe32 Mo16 N256 -","8","0.5","","Arczyński, Mirosław; Stanek, Jan; Sieklucka, Barbara; Dunbar, Kim R.; Pinkowicz, Dawid","Site-Selective Photoswitching of Two Distinct Magnetic Chromophores in a Propeller-Like Molecule To Achieve Four Different Magnetic States.","Journal of the American Chemical Society","2019","","","","","10.1021/jacs.9b09576","","","0.6889","synchrotron","","0.2472","0.1344","","","0.3965","0.442","","","","","","1.15","","","","has coordinates","231142","2020-10-21","18:00:00",""
"4129181","23.7611","0.0014","23.7611","0.0014","63.745","0.004","90","","90","","90","","35990","4","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C144 H124 Fe4 N32 W2 -","- C144 H124 Fe4 N32 W2 -","- C1152 H992 Fe32 N256 W16 -","8","0.5","","Arczyński, Mirosław; Stanek, Jan; Sieklucka, Barbara; Dunbar, Kim R.; Pinkowicz, Dawid","Site-Selective Photoswitching of Two Distinct Magnetic Chromophores in a Propeller-Like Molecule To Achieve Four Different Magnetic States.","Journal of the American Chemical Society","2019","","","","","10.1021/jacs.9b09576","","","0.71073","MoKα","","0.1457","0.1064","","","0.2724","0.3301","","","","","","1.046","","","","has coordinates","231143","2020-10-21","18:00:00",""
"4129182","23.6836","0.001","23.6836","0.001","63.305","0.003","90","","90","","90","","35509","3","120","2","120","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C144 H128 Mn4 Mo2 N32 -","- C144 H128 Mn4 Mo2 N32 -","- C1152 H1024 Mn32 Mo16 N256 -","8","0.5","","Arczyński, Mirosław; Stanek, Jan; Sieklucka, Barbara; Dunbar, Kim R.; Pinkowicz, Dawid","Site-Selective Photoswitching of Two Distinct Magnetic Chromophores in a Propeller-Like Molecule To Achieve Four Different Magnetic States.","Journal of the American Chemical Society","2019","","","","","10.1021/jacs.9b09576","","","0.71073","MoKα","","0.1484","0.1236","","","0.3645","0.3976","","","","","","1.796","","","","has coordinates","231144","2020-10-21","18:00:00",""
"4129183","23.1624","0.0003","23.1624","0.0003","62.6742","0.0012","90","","90","","90","","33624.5","0.9","30","","30","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C144 H128 Fe4 Mo2 N32 -","- C144 H128 Fe4 Mo2 N32 -","- C1152 H1024 Fe32 Mo16 N256 -","8","0.5","","Arczyński, Mirosław; Stanek, Jan; Sieklucka, Barbara; Dunbar, Kim R.; Pinkowicz, Dawid","Site-Selective Photoswitching of Two Distinct Magnetic Chromophores in a Propeller-Like Molecule To Achieve Four Different Magnetic States.","Journal of the American Chemical Society","2019","","","","","10.1021/jacs.9b09576","","","0.6889","synchrotron","","0.1629","0.0938","","","0.2746","0.3118","","","","","","1.107","","","","has coordinates","231145","2020-10-21","18:00:00",""
"4129184","23.7526","0.0005","23.7526","0.0005","63.7037","0.0016","90","","90","","90","","35940.7","1.4","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C144 H128 Fe4 Mo2 N32 -","- C144 H128 Fe4 Mo2 N32 -","- C1152 H1024 Fe32 Mo16 N256 -","8","0.5","","Arczyński, Mirosław; Stanek, Jan; Sieklucka, Barbara; Dunbar, Kim R.; Pinkowicz, Dawid","Site-Selective Photoswitching of Two Distinct Magnetic Chromophores in a Propeller-Like Molecule To Achieve Four Different Magnetic States.","Journal of the American Chemical Society","2019","","","","","10.1021/jacs.9b09576","","","0.71073","MoKα","","0.1268","0.0687","","","0.1871","0.2465","","","","","","1.03","","","","has coordinates","231146","2020-10-21","18:00:00",""
"4129185","23.5748","0.0009","23.5748","0.0009","62.588","0.003","90","","90","","90","","34785","3","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C144 H128 Fe4 N32 W2 -","- C144 H128 Fe4 N32 W2 -","- C1152 H1024 Fe32 N256 W16 -","8","0.5","","Arczyński, Mirosław; Stanek, Jan; Sieklucka, Barbara; Dunbar, Kim R.; Pinkowicz, Dawid","Site-Selective Photoswitching of Two Distinct Magnetic Chromophores in a Propeller-Like Molecule To Achieve Four Different Magnetic States.","Journal of the American Chemical Society","2019","","","","","10.1021/jacs.9b09576","","","0.71073","MoKα","","0.1919","0.1777","","","0.4108","0.4227","","","","","","1.141","","","","has coordinates","231147","2020-10-21","18:00:00",""
"4129186","23.2521","0.0003","23.2521","0.0003","62.8697","0.0015","90","","90","","90","","33991.1","1","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C144 H128 Fe4 Mo2 N32 -","- C144 H128 Fe4 Mo2 N32 -","- C1152 H1024 Fe32 Mo16 N256 -","8","0.5","","Arczyński, Mirosław; Stanek, Jan; Sieklucka, Barbara; Dunbar, Kim R.; Pinkowicz, Dawid","Site-Selective Photoswitching of Two Distinct Magnetic Chromophores in a Propeller-Like Molecule To Achieve Four Different Magnetic States.","Journal of the American Chemical Society","2019","","","","","10.1021/jacs.9b09576","","","0.6889","synchrotron","","0.1604","0.0973","","","0.2708","0.3121","","","","","","1.063","","","","has coordinates","231148","2020-10-21","18:00:00",""
"4129187","23.42","0.0009","23.42","0.0009","62.283","0.003","90","","90","","90","","34162","2","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C144 H128 Fe4 N32 W2 -","- C144 H128 Fe4 N32 W2 -","- C1152 H1024 Fe32 N256 W16 -","8","0.5","","Arczyński, Mirosław; Stanek, Jan; Sieklucka, Barbara; Dunbar, Kim R.; Pinkowicz, Dawid","Site-Selective Photoswitching of Two Distinct Magnetic Chromophores in a Propeller-Like Molecule To Achieve Four Different Magnetic States.","Journal of the American Chemical Society","2019","","","","","10.1021/jacs.9b09576","","","0.71073","MoKα","","0.1693","0.1496","","","0.3561","0.374","","","","","","1.057","","","","has coordinates","264242","2021-04-16","08:52:16",""
"4129188","23.674","0.0014","23.674","0.0014","63.057","0.004","90","","90","","90","","35341","4","120","2","120","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C144 H128 Mn4 N32 W2 -","- C144 H128 Mn4 N32 W2 -","- C1152 H1024 Mn32 N256 W16 -","8","0.5","","Arczyński, Mirosław; Stanek, Jan; Sieklucka, Barbara; Dunbar, Kim R.; Pinkowicz, Dawid","Site-Selective Photoswitching of Two Distinct Magnetic Chromophores in a Propeller-Like Molecule To Achieve Four Different Magnetic States.","Journal of the American Chemical Society","2019","","","","","10.1021/jacs.9b09576","","","0.71073","MoKα","","0.1584","0.1455","","","0.3391","0.3492","","","","","","1.087","","","","has coordinates,has disorder","231150","2020-10-21","18:00:00",""
"4129229","38.2238","0.0008","38.2238","0.0008","12.4091","0.0005","90","","90","","90","","18130.4","0.9","98","2","98","2","","","","","","","","6","I 41/a :2","-I 4ad","88","[PhBP3]CoO(4-tBu-Ph)","","","- C55 H54 B Co O P3 -","- C55 H54 B Co O P3 -","- C880 H864 B16 Co16 O16 P48 -","16","1","","Jenkins, David M.; Peters, Jonas C.","Spin-state tuning at pseudotetrahedral d(7) ions: examining the structural and magnetic phenomena of four-coordinate [BP3]CoII-X systems.","Journal of the American Chemical Society","2005","127","19","7148","7165","10.1021/ja045310m","","","0.71073","MoKα","","0.097","0.056","","","0.0808","0.0837","","","","","","3.011","","","","has coordinates,has disorder","240010","2020-10-21","18:00:00",""
"4129453","24.114","0.006","24.114","0.006","31.267","0.008","90","","90","","90","","18181","8","120","2","120","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C38 H39 Cl4 F12 N8 P2 Rh2 -","- C38 H39 Cl4 F12 N8 P2 Rh2 -","- C608 H624 Cl64 F192 N128 P32 Rh32 -","16","1","","Kotani, Hiroaki; Sugiyama, Takumi; Ishizuka, Tomoya; Shiota, Yoshihito; Yoshizawa, Kazunari; Kojima, Takahiko","Redox-Noninnocent Behavior of Tris(2-pyridylmethyl)amine Bound to a Lewis Acidic Rh(III) Ion Induced by C-H Deprotonation.","Journal of the American Chemical Society","2015","137","35","11222","11225","10.1021/jacs.5b06237","","","0.71073","MoKα","","0.0459","0.04","","","0.1073","0.112","","","","","","1.046","","","","has coordinates,has disorder","240168","2020-10-21","18:00:00",""
"4129590","37.641","0.003","37.641","0.003","9.2606","0.0009","90","","90","","90","","13121","2","100","0.1","100","0.1","","","","","","","","4","I 41/a :2","-I 4ad","88","holak11","","","- C36 H49 Co N2 -","- C36 H49 Co N2 -","- C576 H784 Co16 N32 -","16","1","","Chen, Chi; Hecht, Maxwell B.; Kavara, Aydin; Brennessel, William W.; Mercado, Brandon Q.; Weix, Daniel J.; Holland, Patrick L.","Rapid, Regioconvergent, Solvent-Free Alkene Hydrosilylation with a Cobalt Catalyst.","Journal of the American Chemical Society","2015","137","41","13244","13247","10.1021/jacs.5b08611","","","0.71073","MoKα","","0.1038","0.0582","","","0.1205","0.1368","","","","","","0.996","","","","has coordinates,has disorder","240285","2020-10-21","18:00:00",""
"4130024","26.8014","0.0017","26.8014","0.0017","30.1916","0.0019","90","","90","","90","","21687","2","100.15","","100.15","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C59.8 H66.2 Cl3 N4 Ni O -","- C54 H59 Cl3 N4 Ni O -","- C864 H944 Cl48 N64 Ni16 O16 -","16","1","","Martinez, Gabriel Espinosa; Ocampo, Cristian; Park, Yun Ji; Fout, Alison R.","Accessing Pincer Bis(carbene) Ni(IV) Complexes from Ni(II) via Halogen and Halogen Surrogates.","Journal of the American Chemical Society","2016","138","13","4290","4293","10.1021/jacs.5b12827","","x-ray","0.71073","MoKα","","0.0627","0.0432","","","0.118","0.1256","","","","","","1.056","","","","has coordinates,has disorder","240618","2020-10-21","18:00:00",""
"4130064","20.7033","0.0006","20.7033","0.0006","43.9483","0.0013","90","","90","","90","","18837.4","1","93","","93","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C116 H120 O10 Rh2 -","- C116 H120 O10 Rh2 -","- C928 H960 O80 Rh16 -","8","0.5","","Sanada, Kazuma; Ube, Hitoshi; Shionoya, Mitsuhiko","Rotational Control of a Dirhodium-Centered Supramolecular Four-Gear System by Ligand Exchange.","Journal of the American Chemical Society","2016","138","9","2945","2948","10.1021/jacs.5b13515","","","0.71075","MoKα","","","0.0508","","","","0.1465","","","","","","1.071","","","","has coordinates","240651","2020-10-21","18:00:00",""
"4130078","28.4649","0.0017","28.4649","0.0017","17.3837","0.0011","90","","90","","90","","14085.2","1.5","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C19 H23 N3 Ni -","- C19 H23 N3 Ni -","- C608 H736 N96 Ni32 -","32","2","","Xu, Hongwei; Diccianni, Justin B.; Katigbak, Joseph; Hu, Chunhua; Zhang, Yingkai; Diao, Tianning","Bimetallic C-C Bond-Forming Reductive Elimination from Nickel.","Journal of the American Chemical Society","2016","138","14","4779","4786","10.1021/jacs.6b00016","","","0.71073","MoKα","","0.1147","0.0931","","","0.3106","0.3314","","","","","","1.6","","","","has coordinates,has disorder","240661","2020-10-21","18:00:00",""
"4130118","18.9935","0.0005","18.9935","0.0005","50.612","0.003","90","","90","","90","","18258.4","1.3","200","2","200","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C148 H136 Cl12 -","- C148 H136 Cl12 -","- C592 H544 Cl48 -","4","0.25","","Lee, Semin; Yang, Anna; Moneypenny, 2nd, Timothy P; Moore, Jeffrey S.","Kinetically Trapped Tetrahedral Cages via Alkyne Metathesis.","Journal of the American Chemical Society","2016","138","7","2182","2185","10.1021/jacs.6b00468","","","1.2399","synchrotron","","0.106","0.0881","","","0.2624","0.2817","","","","","","1.083","","","","has coordinates,has disorder","240682","2020-10-21","18:00:00",""
"4130156","13.2018","0.0004","13.2018","0.0004","57.5706","0.0017","90","","90","","90","","10033.8","0.5","100","","100","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C50 H85 Cl2 N Nb O P2 -","- C38 H57 Cl2 N Nb O P2 -","- C304 H456 Cl16 N8 Nb8 O8 P16 -","8","0.5","","Kurogi, Takashi; Carroll, Patrick J.; Mindiola, Daniel J.","A Terminally Bound Niobium Methylidyne.","Journal of the American Chemical Society","2016","138","13","4306","4309","10.1021/jacs.6b00830","","","0.71073","MoKα","","0.0846","0.074","","","0.1567","0.1601","","","","","","1.285","","","","has coordinates,has disorder","240709","2020-10-21","18:00:00",""
"4130641","22.9942","0.0012","22.9942","0.0012","15.5128","0.0008","90","","90","","90","","8202.1","0.7","200","2","200","2","","","","","","","","5","I 41/a :2","-I 4ad","88","CuS2NCN2","","","- C38 H46 Cu N4 S2 -","- C38 H46 Cu N4 S2 -","- C304 H368 Cu8 N32 S16 -","8","0.5","","Johnson, Brittany J.; Antholine, William E.; Lindeman, Sergey V.; Graham, Michael J.; Mankad, Neal P.","A One-Hole Cu<sub>4</sub>S Cluster with N<sub>2</sub>O Reductase Activity: A Structural and Functional Model for Cu<sub>Z</sub>.","Journal of the American Chemical Society","2016","138","40","13107","13110","10.1021/jacs.6b05480","","","0.71073","","","0.1106","0.0666","","","0.1967","0.2236","","","","","","1.404","","","","has coordinates","241033","2020-10-21","18:00:00",""
"4130879","31.0475","0.0002","31.0475","0.0002","41.4313","0.0004","90","","90","","90","","39937.6","0.5","160","2","160","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C34.83 H39.33 Au Cl2.33 F N -","- C34.8333 H39.3333 Au Cl2.33333 F N -","- C1672 H1888 Au48 Cl112 F48 N48 -","48","3","","Kumar, Roopender; Linden, Anthony; Nevado, Cristina","Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids.","Journal of the American Chemical Society","2016","138","42","13790","13793","10.1021/jacs.6b07763","","","0.71073","MoKα","","0.0961","0.0463","","","0.0925","0.112","","","","","","1.031","","","","has coordinates,has disorder","241237","2020-10-21","18:00:00",""
"4131684","42.4313","0.0018","42.4313","0.0018","15.8882","0.0008","90","","90","","90","","28605","2","100","2","100.01","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C76 H62 Fe N3 -","- C76 H62 Fe N3 -","- C1216 H992 Fe16 N48 -","16","1","","Wilding, Matthew J. T.; Iovan, Diana A.; Wrobel, Alexandra T.; Lukens, James T.; MacMillan, Samantha N.; Lancaster, Kyle M.; Betley, Theodore A.","Direct Comparison of C-H Bond Amination Efficacy through Manipulation of Nitrogen-Valence Centered Redox: Imido versus Iminyl.","Journal of the American Chemical Society","2017","139","41","14757","14766","10.1021/jacs.7b08714","","","0.71073","MoKα","","0.1467","0.0892","","","0.2592","0.2799","","","","","","1.136","","","","has coordinates,has disorder","241857","2020-10-21","18:00:00",""
"4132358","26.6512","0.0014","26.6512","0.0014","7.0521","0.0005","90","","90","","90","","5009","0.5","100","2","100","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C62 H44 N4 -","- C62 H44 N4 -","- C248 H176 N16 -","4","0.25","","di Gregorio, Maria Chiara; Ranjan, Priyadarshi; Houben, Lothar; Shimon, Linda J. W.; Rechav, Katya; Lahav, Michal; van der Boom, Milko E.","Metal-Coordination-Induced Fusion Creates Hollow Crystalline Molecular Superstructures.","Journal of the American Chemical Society","2018","140","29","9132","9139","10.1021/jacs.8b03055","","","0.71073","MoKα","","0.0984","0.0691","","","0.168","0.1869","","","","","","1.125","","","","has coordinates","242342","2020-10-21","18:00:00",""
"4132384","19.5302","0.0014","19.5302","0.0014","18.7188","0.0015","90","","90","","90","","7139.9","0.9","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C21 H20 N2 O -","- C21 H20 N2 O -","- C336 H320 N32 O16 -","16","1","","Wang, Chengdong; Xiao, Guanlin; Guo, Tao; Ding, Yalan; Wu, Xiaojin; Loh, Teck-Peng","Palladium-Catalyzed Regiocontrollable Reductive Heck Reaction of Unactivated Aliphatic Alkenes.","Journal of the American Chemical Society","2018","140","30","9332","9336","10.1021/jacs.8b03619","","","1.54178","CuKα","","0.1332","0.1048","","","0.2637","0.2904","","","","","","1.088","","","","has coordinates","242367","2020-10-21","18:00:00",""
"4132935","11.7107","0.0002","11.7107","0.0002","34.3827","0.0017","90","","90","","90","","4715.3","0.3","295","2","295","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C8 H26 Ga2 N2 O S7 Sb2 -","- C8 H24 Ga2 N2 O S7 Sb2 -","- C64 H192 Ga16 N16 O8 S56 Sb16 -","8","0.5","","Feng, Mei-Ling; Sarma, Debajit; Gao, Yu-Jie; Qi, Xing-Hui; Li, Wei-An; Huang, Xiao-Ying; Kanatzidis, Mercouri G.","Efficient Removal of [UO<sub>2</sub>]<sup>2+</sup>, Cs<sup>+</sup>, and Sr<sup>2+</sup> Ions by Radiation-Resistant Gallium Thioantimonates.","Journal of the American Chemical Society","2018","140","35","11133","11140","10.1021/jacs.8b07457","","","0.71073","MoKα","","0.1025","0.064","","","0.1264","0.1432","","","","","","1.01","","","","has coordinates,has disorder","242796","2020-10-21","18:00:00",""
"4133669","20.15","","20.15","","8.85","","90","","90","","90","","3593.3","","298","","298","","","","","","","","","3","I 41/a :2","-I 4ad","88","","COF-300-V_RT","","- C41 H28 N4 -","- C41 H28 N4 -","- C164 H112 N16 -","4","0.25","","Sun, Tu; Wei, Lei; Chen, Yichong; Ma, Yanhang; Zhang, Yue-Biao","Atomic-Level Characterization of Dynamics of a 3D Covalent Organic Framework by Cryo-Electron Diffraction Tomography.","Journal of the American Chemical Society","2019","141","28","10962","10966","10.1021/jacs.9b04895","","","0.0251","","","0.2952","0.2801","","","0.5713","0.5808","","","","","","1.08","","","","has coordinates","243406","2020-10-21","18:00:00",""
"4133670","27.3","","27.3","","7.7","","90","","90","","90","","5738.73","","77","","77","","","","","","","","","3","I 41/a :2","-I 4ad","88","","COF-300-PMMA_cryo","","- C41 H28 N4 -","- C41 H28 N4 -","- C164 H112 N16 -","4","0.25","","Sun, Tu; Wei, Lei; Chen, Yichong; Ma, Yanhang; Zhang, Yue-Biao","Atomic-Level Characterization of Dynamics of a 3D Covalent Organic Framework by Cryo-Electron Diffraction Tomography.","Journal of the American Chemical Society","2019","141","28","10962","10966","10.1021/jacs.9b04895","","","0.0251","","","0.4084","0.4033","","","0.7484","0.7525","","","","","","1.192","","","","has coordinates","243407","2020-10-21","18:00:00",""
"4133671","20.5","","20.5","","9.1","","90","","90","","90","","3824.27","","77","","77","","","","","","","","","3","I 41/a :2","-I 4ad","88","","COF-300-V_Cryo","","- C41 H28 N4 -","- C41 H28 N4 -","- C164 H112 N16 -","4","0.25","","Sun, Tu; Wei, Lei; Chen, Yichong; Ma, Yanhang; Zhang, Yue-Biao","Atomic-Level Characterization of Dynamics of a 3D Covalent Organic Framework by Cryo-Electron Diffraction Tomography.","Journal of the American Chemical Society","2019","141","28","10962","10966","10.1021/jacs.9b04895","","","0.0251","","","0.3377","0.3175","","","0.619","0.6295","","","","","","1.05","","","","has coordinates","243408","2020-10-21","18:00:00",""
"4133672","19.9","","19.9","","9.3","","90","","90","","90","","3682.89","","77","","77","","","","","","","","","4","I 41/a :2","-I 4ad","88","","COF-300-H2O","","- C41 H36 N4 O4 -","- C41 H36 N4 O4 -","- C164 H144 N16 O16 -","4","0.25","","Sun, Tu; Wei, Lei; Chen, Yichong; Ma, Yanhang; Zhang, Yue-Biao","Atomic-Level Characterization of Dynamics of a 3D Covalent Organic Framework by Cryo-Electron Diffraction Tomography.","Journal of the American Chemical Society","2019","141","28","10962","10966","10.1021/jacs.9b04895","","","0.0251","","","0.3074","0.2911","","","0.6091","0.6187","","","","","","1.052","","","","has coordinates","243409","2020-10-21","18:00:00",""
"4133729","38.1427","0.0019","38.1427","0.0019","13.6269","0.0007","90","","90","","90","","19825.3","1.7","100","2","100","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C11.25 H10.66 Mn0.5 Mo3 N O12 -","- C11.25 H10.5 Mn0.5 Mo3 N O12 -","- C180 H168 Mn8 Mo48 N16 O192 -","16","1","","Xu, Wentao; Pei, Xiaokun; Diercks, Christian S.; Lyu, Hao; Ji, Zhe; Yaghi, Omar M.","A Metal-Organic Framework of Organic Vertices and Polyoxometalate Linkers as a Solid-State Electrolyte.","Journal of the American Chemical Society","2019","141","44","17522","17526","10.1021/jacs.9b10418","","x-ray","0.7288","synchrotron","","0.079","0.0737","","","0.2282","0.2369","","","","","","1.059","","","","has coordinates,has disorder","243434","2020-10-21","18:00:00",""
"4134303","26.1739","0.0014","26.1739","0.0014","31.8805","0.0018","90","","90","","90","","21840","2","100","2","100","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C122.73 H157.5 Cl1.23 D103.13 N50.47 O88.88 Pd6 -","- C122.736 H157.508 Cl1.228 N50.4704 O88.8324 Pd6 -","- C490.944 H630.032 Cl4.912 N201.882 O355.33 Pd24 -","4","0.25","","Dolgopolova, Ekaterina A.; Berseneva, Anna A.; Faillace, Martín S; Ejegbavwo, Otega A.; Leith, Gabrielle A.; Choi, Seok W.; Gregory, Haley N.; Rice, Allison M.; Smith, Mark D.; Chruszcz, Maksymilian; Garashchuk, Sophya; Mythreye, Karthikeyan; Shustova, Natalia B.","Confinement-Driven Photophysics in Cages, Covalent-Organic Frameworks, Metal-Organic Frameworks, and DNA.","Journal of the American Chemical Society","2020","","","","","10.1021/jacs.9b13505","","x-ray","0.71073","MoKα","","0.0748","0.0523","","","0.1443","0.1654","","","","","","1.062","","","","has coordinates,has disorder","248652","2020-10-21","18:00:00",""
"4134305","26.0645","0.0009","26.0645","0.0009","31.6937","0.0013","90","","90","","90","","21531.4","1.4","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C120 H154 Cl N38 O10.97 Pd6 -","- C120 H154 Cl N38 O10.968 Pd6 -","- C480 H616 Cl4 N152 O43.872 Pd24 -","4","0.25","","Dolgopolova, Ekaterina A.; Berseneva, Anna A.; Faillace, Martín S; Ejegbavwo, Otega A.; Leith, Gabrielle A.; Choi, Seok W.; Gregory, Haley N.; Rice, Allison M.; Smith, Mark D.; Chruszcz, Maksymilian; Garashchuk, Sophya; Mythreye, Karthikeyan; Shustova, Natalia B.","Confinement-Driven Photophysics in Cages, Covalent-Organic Frameworks, Metal-Organic Frameworks, and DNA.","Journal of the American Chemical Society","2020","","","","","10.1021/jacs.9b13505","","","0.71073","MoKα","","0.0634","0.045","","","0.1196","0.1346","","","","","","1.027","","","","has coordinates,has disorder","248654","2020-10-21","18:00:00",""
"4135296","20.4388","0.0003","20.4388","0.0003","31.2788","0.0005","90","","90","","90","","13066.5","0.3","223.15","","223.15","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C116 H112 N8 O8 S16 -","- C116 H112 N8 O8 S16 -","- C464 H448 N32 O32 S64 -","4","0.25","","Lee, Ji Yoon; Root, Harrison D.; Ali, Rashid; An, Won; Lynch, Vincent M.; Bähring, Steffen; Kim, In Su; Sessler, Jonathan L.; Park, Jung Su","Ratiometric Turn-On Fluorophore Displacement Ensembles for Nitroaromatic Explosives Detection","Journal of the American Chemical Society","2020","","","","","10.1021/jacs.0c08106","","","1.54184","CuKα","","0.0661","0.0453","","","0.1249","0.1366","","","","","","1.028","","","","has coordinates,has disorder","258431","2020-10-21","18:00:00",""
"4300223","20.118","0.002","20.118","0.002","54.351","0.015","90","","90","","90","","21998","7","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C122.52 H160 Ba4 Co4 N8 O75 -","- C122.4 H104 Ba4 Co4 N8 O75.28 -","- C489.6 H416 Ba16 Co16 N32 O301.12 -","4","0.25","","O. Danny Fox; Jenny F.-Y. Leung; Jesse M. Hunter; N. Kent Dalley; Roger G. Harrison","Metal-Assembled Cobalt(II) Resorc[4]arene-Based Cage Molecules That Reversibly Capture Organic Molecules from Water and Act as NMR Shift Reagents","Inorganic Chemistry","2000","39","","783","790","10.1021/ic991235i","","","0.71073","MoKα","","0.197","0.0988","","0.3745","0.2586","","","","1.059","1.195","1.195","","","","","has coordinates","179040","2020-10-21","18:00:00",""
"4300246","17.737","0.002","17.737","0.002","15.6915","0.0006","90","","90","","90","","4936.6","0.8","213","2","213","2","","","","","","","synthesized","6","I 41/a :2","-I 4ad","88","","1,1,2,2-bis(n-propylamine)-bis(trimethylphosphine)-tetrachloro- -di-molybdenum (II, II)","","- C12 H36 Cl4 Mo2 N2 P2 -","- C12 H36 Cl4 Mo2 N2 P2 -","- C96 H288 Cl32 Mo16 N16 P16 -","8","0.5","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 6. Stepwise Substitution of Amines by Tertiary Phosphines and Vice Versa: Stereochemical Hysteresis","Inorganic Chemistry","2000","39","","609","616","10.1021/ic9913684","","","0.71073","MoKα","","0.0326","0.0276","","0.067","0.0625","","","","1.175","1.172","1.172","","","","","has coordinates","179040","2020-10-21","18:00:00",""
"4300345","12.8389","0.0003","12.8389","0.0003","35.047","0.002","90","","90","","90","","5777.1","0.4","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C48 H80 Cl4 N4 Ni4 O8 -","- C48 H80 Cl4 N4 Ni4 O8 -","- C192 H320 Cl16 N16 Ni16 O32 -","4","0.25","","","","Inorganic Chemistry","2006","","","","","10.1021/ic050093r","","","","","","","","","","","","","","","","","","","","","has coordinates","179041","2020-10-21","18:00:00",""
"4300347","12.8739","0.0003","12.8739","0.0003","36.3672","0.0019","90","","90","","90","","6027.4","0.4","213","2","213","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C48 H80 Br4 N4 Ni4 O8 -","- C48 H80 Br4 N4 Ni4 O8 -","- C192 H320 Br16 N16 Ni16 O32 -","4","0.25","","","","Inorganic Chemistry","2006","","","","","10.1021/ic050093r","","","","","","","","","","","","","","","","","","","","","has coordinates","179041","2020-10-21","18:00:00",""
"4300562","38.475","0.015","38.475","0.015","8.837","0.004","90","","90","","90","","13082","9","298","","298","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C33 H29 N2 O4 Re S4 -","- C33 H26 N2 O4 Re S4 -","- C528 H416 N32 O64 Re16 S64 -","16","1","","","","Inorganic Chemistry","2006","","","","","10.1021/ic051538e","","","","","","","","","","","","","","","","","","","","","has coordinates","179043","2020-10-21","18:00:00",""
"4300914","40.6327","0.0003","40.6327","0.0003","17.6171","0.0002","90","","90","","90","","29086.1","0.4","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C45 H45 Mn3 N9 O10 -","- C45 H45 Mn3 N9 O10 -","- C720 H720 Mn48 N144 O160 -","16","1","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.147","0.1315","","","0.4173","0.4447","","","","","","2.052","","","","has coordinates,has disorder","179047","2020-10-21","18:00:00",""
"4300915","40.6959","0.0006","40.6959","0.0006","17.4726","0.0003","90","","90","","90","","28937.4","0.8","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C54 H64 Mn3 N9 O10 -","- C54 H64 Mn3 N9 O10 -","- C864 H1024 Mn48 N144 O160 -","16","1","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.0706","0.0583","","","0.147","0.1564","","","","","","1.076","","","","has coordinates","179047","2020-10-21","18:00:00",""
"4300916","39.852","0.004","39.852","0.004","17.749","0.002","90","","90","","90","","28189","5","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C42 H40 Mn3 N9 O10 -","- C42 H40 Mn3 N9 O10 -","- C672 H640 Mn48 N144 O160 -","16","1","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.1366","0.0507","","","0.1054","0.1208","","","","","","0.751","","","","has coordinates","179047","2020-10-21","18:00:00",""
"4300917","39.916","0.004","39.916","0.004","18.033","0.002","90","","90","","90","","28732","5","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C64 H62.67 Mn4 N12 O16 -","- C64 H62.6667 Mn4 N12 O16 -","- C768 H752 Mn48 N144 O192 -","12","0.75","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.1065","0.0788","","","0.2318","0.2495","","","","","","1.033","","","","has coordinates,has disorder","179047","2020-10-21","18:00:00",""
"4300918","40.2119","0.0019","40.2119","0.0019","17.7703","0.0012","90","","90","","90","","28735","3","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C42 H40 Mn3 N9 O10 -","- C42 H40 Mn3 N9 O10 -","- C672 H640 Mn48 N144 O160 -","16","1","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.1342","0.0437","","","0.0841","0.0971","","","","","","0.691","","","","has coordinates","179047","2020-10-21","18:00:00",""
"4300919","40.709","0.009","40.709","0.009","17.468","0.007","90","","90","","90","","28948","15","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C53 H57 Mn3 N10 O11.5 -","- C52.298 H53.807 Mn3 N9.766 O11.266 -","- C836.768 H860.912 Mn48 N156.256 O180.256 -","16","1","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.1254","0.0832","","","0.2363","0.2629","","","","","","0.991","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4300920","40.376","0.013","40.376","0.013","17.567","0.008","90","","90","","90","","28638","18","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C210 H231.5 Mn12 N40 O48 -","- C196.44 H185.76 Mn12 N36 O44 -","- C785.76 H743.04 Mn48 N144 O176 -","4","0.25","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.1347","0.0946","","","0.2693","0.2931","","","","","","1.077","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4300921","40.32","0.004","40.32","0.004","17.588","0.003","90","","90","","90","","28593","6","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C48 H56.13 Mn3 N10 O11 -","- C47.739 H49.217 Mn3 N10 O11 -","- C763.824 H787.472 Mn48 N160 O176 -","16","1","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.1737","0.0914","","","0.2194","0.2476","","","","","","0.94","","","","has coordinates,has disorder","179047","2020-10-21","18:00:00",""
"4300922","40.6479","0.0016","40.6479","0.0016","17.5642","0.001","90","","90","","90","","29020","2","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C51 H60 Mn3 N11 O12 -","- C51 H60 Mn3 N11 O12 -","- C816 H960 Mn48 N176 O192 -","16","1","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.1089","0.0709","","","0.2082","0.2255","","","","","","1.013","","","","has coordinates","179047","2020-10-21","18:00:00",""
"4300923","40.5408","0.0017","40.5408","0.0017","17.6055","0.001","90","","90","","90","","28936","2","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C133.33 H136 Mn8 N24 O32 -","- C133.333 H136 Mn8 N24 O32 -","- C800 H816 Mn48 N144 O192 -","6","0.375","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.1334","0.0879","","","0.2599","0.2855","","","","","","0.969","","","","has coordinates,has disorder","179047","2020-10-21","18:00:00",""
"4300924","40.4245","0.0015","40.4245","0.0015","17.8143","0.0009","90","","90","","90","","29111","2","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C51 H53 Mn3 N9 O12 -","- C51 H53 Mn3 N9 O12 -","- C816 H848 Mn48 N144 O192 -","16","1","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.11","0.0883","","","0.2545","0.271","","","","","","1.054","","","","has coordinates,has disorder","179047","2020-10-21","18:00:00",""
"4300925","40.609","0.003","40.609","0.003","17.4132","0.0018","90","","90","","90","","28716","4","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C48 H53 Mn3 N10 O11 -","- C48 H53 Mn3 N10 O11 -","- C768 H848 Mn48 N160 O176 -","16","1","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.1984","0.0946","","","0.233","0.2736","","","","","","0.902","","","","has coordinates","179047","2020-10-21","18:00:00",""
"4300926","40.9493","0.0016","40.9493","0.0016","17.2151","0.001","90","","90","","90","","28867","2","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C45 H46 Mn3 N9 O10 -","- C45 H46 Mn3 N9 O10 -","- C720 H736 Mn48 N144 O160 -","16","1","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.1593","0.0612","","","0.1373","0.1573","","","","","","0.728","","","","has coordinates","179047","2020-10-21","18:00:00",""
"4300927","40.906","0.005","40.906","0.005","17.295","0.003","90","","90","","90","","28940","7","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C61 H75 Mn3 N10 O12 -","- C61 H75 Mn3 N10 O12 -","- C976 H1200 Mn48 N160 O192 -","16","1","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.1407","0.0881","","","0.2314","0.2622","","","","","","1.045","","","","has coordinates,has disorder","179047","2020-10-21","18:00:00",""
"4300928","40.9064","0.0018","40.9064","0.0018","17.4574","0.0011","90","","90","","90","","29212","3","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C58.5 H69 Mn3 N9 O11 -","- C58.5 H69 Mn3 N9 O11 -","- C936 H1104 Mn48 N144 O176 -","16","1","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.1054","0.0551","","","0.139","0.1534","","","","","","0.897","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4300929","40.852","0.002","40.852","0.002","17.4393","0.0012","90","","90","","90","","29104","3","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C57 H71 Mn3 N10 O11 -","- C57 H71 Mn3 N10 O11 -","- C912 H1136 Mn48 N160 O176 -","16","1","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.17","0.068","","","0.1471","0.1722","","","","","","0.843","","","","has coordinates","179047","2020-10-21","18:00:00",""
"4300930","40.792","0.006","40.792","0.006","17.442","0.004","90","","90","","90","","29023","9","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C57 H71 Mn3 N10 O11 -","- C57 H71 Mn3 N10 O11 -","- C912 H1136 Mn48 N160 O176 -","16","1","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.1786","0.068","","","0.1414","0.1684","","","","","","0.818","","","","has coordinates","179047","2020-10-21","18:00:00",""
"4300931","40.688","0.005","40.688","0.005","17.204","0.003","90","","90","","90","","28481","7","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C57 H70.13 Mn3 N10 O11 -","- C56.805 H70.545 Mn3 N9.935 O10.935 -","- C908.88 H1128.72 Mn48 N158.96 O174.96 -","16","1","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.1612","0.1001","","","0.265","0.3045","","","","","","1.015","","","","has coordinates","179047","2020-10-21","18:00:00",""
"4300932","40.669","0.005","40.669","0.005","17.351","0.003","90","","90","","90","","28698","7","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C144 H170.67 Mn8 N24 O26.67 -","- C144 H170.667 Mn8 N24 O26.6667 -","- C864 H1024 Mn48 N144 O160 -","6","0.375","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.1553","0.0651","","","0.1314","0.1546","","","","","","0.831","","","","has coordinates","179047","2020-10-21","18:00:00",""
"4300933","40.873","0.002","40.873","0.002","17.4993","0.0013","90","","90","","90","","29234","3","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C54 H64 Mn3 N9 O10 -","- C54 H64 Mn3 N9 O10 -","- C864 H1024 Mn48 N144 O160 -","16","1","","Dohyun Moon; Myoung Soo Lah","Size and Shape Selectivity of Host Networks Built Based on Tunable Secondary Building Units","Inorganic Chemistry","2005","44","","1934","1940","10.1021/ic0486872","","","0.71073","MoKα","","0.1402","0.0605","","","0.1245","0.1413","","","","","","0.839","","","","has coordinates","179047","2020-10-21","18:00:00",""
"4301196","33.049","0.005","33.049","0.005","19.333","0.004","90","","90","","90","","21116","6","373","2","373","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C50 H49 Cl4 Fe2 N7 P2 -","- C50 H49 Cl4 Fe2 N7 P2 -","- C800 H784 Cl64 Fe32 N112 P32 -","16","1","","Christine Sui-Seng; F. Nipa Haque; Alen Hadzovic; Anna-Maria Pütz; Valerie Reuss; Nils Meyer; Alan J. Lough; Marco Zimmer-De Iuliis; Robert H. Morris","Synthesis and Characterization of Iron(II) Complexes with Tetradentate Diiminodiphosphine or Diaminodiphosphine Ligands as Precatalysts for the Hydrogenation of Acetophenone","Inorganic Chemistry","2009","48","","735","743","10.1021/ic801518h","","","0.71073","MoKα","","0.1242","0.0647","","","0.162","0.1832","","","","","","1.049","","","","has coordinates","179049","2020-10-21","18:00:00",""
"4301788","22.782","0.003","22.782","0.003","9.804","0.004","90","","90","","90","","5088","2","290","","290","","","","","","","","Synthesized by the authors. See text","5","I 41/a :2","-I 4ad","88","","","","- C33 H68 Cu2 N4 O28 -","- C33 H68 Cu2 N4 O28 -","- C132 H272 Cu8 N16 O112 -","4","0.25","","Patrick E. Ryan; Christophe Lescop; Dominic Laliberté; Tamara Hamilton; Thierry Maris; James D. Wuest","Engineering New Metal-Organic Frameworks Built from Flexible Tetrapyridines Coordinated to Cu(II) and Cu(I)","Inorganic Chemistry","2009","48","","2793","2807","10.1021/ic8019809","","","1.54178","CuKα","","0.0932","0.0792","","","0.1819","0.2115","","","","","","0.947","","","","has coordinates","179055","2020-10-21","18:00:00",""
"4301821","15.236","0.004","15.236","0.004","18.958","0.008","90","","90","","90","","4401","2","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C36 H44 Ba N4 O4 P2 S4 -","- C36 H44 Ba N4 O4 P2 S4 -","- C144 H176 Ba4 N16 O16 P8 S16 -","4","0.25","","Chengfu Pi; Li Wan; Weiping Liu; Zaifu Pan; Haoyu Wu; Yunhua Wang; Wenjun Zheng; Linhong Weng; Zhenxia Chen; Limin Wu","1,2,4-Diazaphospholide Complexes of Barium: Mechanism of Formation and Crystallographic Characterization","Inorganic Chemistry","2009","48","","2967","2975","10.1021/ic802157g","","","0.71073","MoKα","","0.0752","0.0528","","","0.1418","0.155","","","","","","0.962","","","","has coordinates,has disorder","179056","2020-10-21","18:00:00",""
"4302220","34.3706","0.0011","34.3706","0.0011","9.5456","0.0006","90","","90","","90","","11276.6","0.9","273","2","273","2","","","","","","","","6","I 41/a :2","-I 4ad","88","MONT-2","","","- C18 H16 I3 N3 O7 Zn -","- C18 H8 I3 N3 O7 Zn -","- C288 H128 I48 N48 O112 Zn16 -","16","1","","Fangna Dai; Haiyan He; Daofeng Sun","Polymorphism in High-Crystalline-Stability Metal-Organic Nanotubes","Inorganic Chemistry","2009","48","","4613","4615","10.1021/ic900283t","","","0.71073","MoKα","","0.0998","0.0582","","","0.1744","0.1986","","","","","","1.107","","","","has coordinates","179060","2020-10-21","18:00:00",""
"4302221","34.3606","0.0012","34.3606","0.0012","9.5669","0.0006","90","","90","","90","","11295.2","0.9","273","2","273","2","","","","","","","","6","I 41/a :2","-I 4ad","88","MONT-2-160","","","- C18 H14 I3 N3 O6 Zn -","- C18 H8 I3 N3 O6 Zn -","- C288 H128 I48 N48 O96 Zn16 -","16","1","","Fangna Dai; Haiyan He; Daofeng Sun","Polymorphism in High-Crystalline-Stability Metal-Organic Nanotubes","Inorganic Chemistry","2009","48","","4613","4615","10.1021/ic900283t","","","0.71073","MoKα","","0.0895","0.0475","","","0.1438","0.1684","","","","","","1.074","","","","has coordinates","179060","2020-10-21","18:00:00",""
"4302222","34.3007","0.0014","34.3007","0.0014","9.5627","0.0008","90","","90","","90","","11250.9","1.1","273","2","273","2","","","","","","","","6","I 41/a :2","-I 4ad","88","MONT-2-200","","","- C18 H12 I3 N3 O5 Zn -","- C18 H8 I3 N3 O5 Zn -","- C288 H128 I48 N48 O80 Zn16 -","16","1","","Fangna Dai; Haiyan He; Daofeng Sun","Polymorphism in High-Crystalline-Stability Metal-Organic Nanotubes","Inorganic Chemistry","2009","48","","4613","4615","10.1021/ic900283t","","","0.71073","MoKα","","0.1013","0.0463","","","0.1113","0.1391","","","","","","1.031","","","","has coordinates","179060","2020-10-21","18:00:00",""
"4302764","22.1627","0.0006","22.1627","0.0006","20.0135","0.0011","90","","90","","90","","9830.3","0.7","173","2","273","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C26 H30 N3 Si0.5 Sm -","- C26 H28.5 N3 Si0.5 Sm -","- C416 H456 N48 Si8 Sm16 -","16","1","","Cheng-Ling Pan; Wan Chen; Shuyan Song; Hongjie Zhang; Xingwei Li","Stabilization of Imidosamarium(III) Cubane by Amidinates","Inorganic Chemistry","2009","48","","6344","6346","10.1021/ic900808f","","","0.71073","MoKα","","0.0332","0.023","","","0.0623","0.0775","","","","","","1.189","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4303163","22.8537","0.0012","22.8537","0.0011","31.4028","0.0015","90","","90","","90","","16401.4","1.4","200.1","","","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C116 H144 Cl10 Fe5 N68 O40 -","- C116 H144 Cl10 Fe5 N68 O40 -","- C464 H576 Cl40 Fe20 N272 O160 -","4","0.25","","Yukinari Sunatsuki; Ryohei Kawamoto; Kunihiro Fujita; Hisashi Maruyama; Takayoshi Suzuki; Hiroyuki Ishida; Masaaki Kojima; Seiichiro Iijima; Naohide Matsumoto","Structures and Spin States of Bis(tridentate)-Type Mononuclear and Triple Helicate Dinuclear Iron(II) Complexes of Imidazole-4-carbaldehyde azine","Inorganic Chemistry","2009","48","","8784","8795","10.1021/ic900977m","","","0.71075","MoKα","","","0.072","","","","0.206","","","","","","1.065","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4303319","18.8385","0.0003","18.8385","0.0003","33.9644","0.0006","90","","90","","90","","12053.6","0.3","293","","293","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Al F6 K3 -","- Al F6 K3 -","- Al80 F480 K240 -","80","5","","Artem M. Abakumov; Graham King; Veronika K. Laurinavichute; Marina G. Rozova; Patrick M. Woodward; Evgeny V. Antipov","The Crystal Structure of α-K3AlF6: Elpasolites and Double Perovskites with Broken Corner-Sharing Connectivity of the Octahedral Framework","Inorganic Chemistry","2009","48","","9336","9344","10.1021/ic9013043","powder diffraction","","1.5406","CuKα","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4303329","33.6846","0.0004","33.6846","0.0004","20.3429","0.0003","90","","90","","90","","23082.1","0.5","173.1","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C65.5 H84 Mo2 N4 -","- C65.5 H84 Mo2 N4 -","- C1048 H1344 Mo32 N64 -","16","1","","Yuji Kajita; Takahiko Ogawa; Jun Matsumoto; Hideki Masuda","Synthesis and Characterization of a Benzene-Dimolybdenum Complex with a New Bridging Mode","Inorganic Chemistry","2009","48","","9069","9071","10.1021/ic901360c","","","0.7107","MoKα","","","0.0443","","","","0.0341","","","","","","0.946","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4303437","14.201","0.0003","14.201","0.0003","50.9312","0.0019","90","","90","","90","","10271.2","0.5","133","2","133","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C100 H92 Cu4 N24 -","- C100 H92 Cu4 N24 -","- C400 H368 Cu16 N96 -","4","0.25","","Michael Stollenz; Michael John; Henrike Gehring; Sebastian Dechert; Christian Grosse; Franc Meyer","Oligonuclear Homoleptic Copper(I) Pyrazolates with Multinucleating Ligand Scaffolds: High Structural Diversity in Solid-State and Solution","Inorganic Chemistry","2009","48","","10049","10059","10.1021/ic900727h","","","0.71073","MoKα","","0.1279","0.0756","","","0.1396","0.1579","","","","","","1.054","","","","has coordinates,has disorder","179072","2020-10-21","18:00:00",""
"4303467","28.2278","0.0005","28.2278","0.0005","20.1537","0.0006","90","","90","","90","","16058.6","0.6","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C39.5 H38 N2 Pt Si2 -","- C39.5 H38 N2 Pt Si2 -","- C632 H608 N32 Pt16 Si32 -","16","1","","Jun Ni; Yu-Hui Wu; Xu Zhang; Bin Li; Li-Yi Zhang; Zhong-Ning Chen","Luminescence Vapochromism of a Platinum(II) Complex for Detection of Low Molecular Weight Halohydrocarbon","Inorganic Chemistry","2009","48","","10202","10210","10.1021/ic9011982","","","0.71073","MoKα","","0.0598","0.046","","","0.1235","0.1411","","","","","","1.182","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4303601","21.226","0.002","21.226","0.002","49.463","0.005","90","","90","","90","","22285","4","120","","120","","","","","","","","","8","I 41/a :2","-I 4ad","88","LZn2La(OAc)2(PF6)(Et2O)1.5(H2O)0.25","","","- C48 H59.5 F6 La N4 O18.75 P Zn2 -","- C48 H59 F6 La N4 O18.75 P Zn2 -","- C768 H944 F96 La16 N64 O300 P16 Zn32 -","16","1","","Shigehisa Akine; Yoko Morita; Fumihiko Utsuno; Tatsuya Nabeshima","Multiple Folding Structures Mediated by Metal Coordination of Acyclic Multidentate Ligand","Inorganic Chemistry","2009","48","","10670","10678","10.1021/ic901372k","","","0.71069","MoKα","","0.0429","0.0405","","","0.1123","0.1144","","","","","","1.059","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4303602","21.1689","0.0018","21.1689","0.0018","48.97","0.005","90","","90","","90","","21945","3","120","","120","","","","","","","","","8","I 41/a :2","-I 4ad","88","LZn2Gd(OAc)2(PF6)(Et2O)1.5(H2O)0.25","","","- C48 H59.5 F6 Gd N4 O18.75 P Zn2 -","- C48 H59 F6 Gd N4 O18.75 P Zn2 -","- C768 H944 F96 Gd16 N64 O300 P16 Zn32 -","16","1","","Shigehisa Akine; Yoko Morita; Fumihiko Utsuno; Tatsuya Nabeshima","Multiple Folding Structures Mediated by Metal Coordination of Acyclic Multidentate Ligand","Inorganic Chemistry","2009","48","","10670","10678","10.1021/ic901372k","","","0.71069","MoKα","","0.0414","0.0361","","","0.0975","0.1013","","","","","","1.039","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4303603","21.204","0.003","21.204","0.003","49.387","0.006","90","","90","","90","","22205","5","120","","120","","","","","","","","","8","I 41/a :2","-I 4ad","88","[LZn2Ce(OAc)2](PF6)(Et2O)1.5(H2O)0.25","","","- C48 H59.5 Ce F6 N4 O18.75 P Zn2 -","- C48 H59 Ce F6 N4 O18.75 P Zn2 -","- C768 H944 Ce16 F96 N64 O300 P16 Zn32 -","16","1","","Shigehisa Akine; Yoko Morita; Fumihiko Utsuno; Tatsuya Nabeshima","Multiple Folding Structures Mediated by Metal Coordination of Acyclic Multidentate Ligand","Inorganic Chemistry","2009","48","","10670","10678","10.1021/ic901372k","","","0.71069","MoKα","","0.0536","0.0441","","","0.1095","0.1166","","","","","","1.05","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4303604","21.181","0.002","21.181","0.002","49.273","0.005","90","","90","","90","","22106","4","120","","120","","","","","","","","","8","I 41/a :2","-I 4ad","88","LZn2Pr(OAc)2(PF6)(Et2O)1.5(H2O)0.25","","","- C48 H59.5 F6 N4 O18.75 P Pr Zn2 -","- C48 H59 F6 N4 O18.75 P Pr Zn2 -","- C768 H944 F96 N64 O300 P16 Pr16 Zn32 -","16","1","","Shigehisa Akine; Yoko Morita; Fumihiko Utsuno; Tatsuya Nabeshima","Multiple Folding Structures Mediated by Metal Coordination of Acyclic Multidentate Ligand","Inorganic Chemistry","2009","48","","10670","10678","10.1021/ic901372k","","","0.71069","MoKα","","0.04","0.0381","","","0.1019","0.1028","","","","","","1.057","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4303605","21.163","0.003","21.163","0.003","49.188","0.005","90","","90","","90","","22030","5","120","","120","","","","","","","","","8","I 41/a :2","-I 4ad","88","[LZn2Nd(OAc)2](PF6)(Et2O)1.5(H2O)0.25","","","- C48 H59.5 F6 N4 Nd O18.75 P Zn2 -","- C48 H59 F6 N4 Nd O18.75 P Zn2 -","- C768 H944 F96 N64 Nd16 O300 P16 Zn32 -","16","1","","Shigehisa Akine; Yoko Morita; Fumihiko Utsuno; Tatsuya Nabeshima","Multiple Folding Structures Mediated by Metal Coordination of Acyclic Multidentate Ligand","Inorganic Chemistry","2009","48","","10670","10678","10.1021/ic901372k","","","0.71069","MoKα","","0.0466","0.0433","","","0.1114","0.1134","","","","","","1.084","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4303606","21.136","0.003","21.136","0.003","49.005","0.004","90","","90","","90","","21892","5","120","","120","","","","","","","","","8","I 41/a :2","-I 4ad","88","[LZn2Sm(OAc)2](PF6)(Et2O)1.5(H2O)0.25","","","- C48 H59.5 F6 N4 O18.75 P Sm Zn2 -","- C48 H59 F6 N4 O18.75 P Sm Zn2 -","- C768 H944 F96 N64 O300 P16 Sm16 Zn32 -","16","1","","Shigehisa Akine; Yoko Morita; Fumihiko Utsuno; Tatsuya Nabeshima","Multiple Folding Structures Mediated by Metal Coordination of Acyclic Multidentate Ligand","Inorganic Chemistry","2009","48","","10670","10678","10.1021/ic901372k","","","0.71069","MoKα","","0.0442","0.0408","","","0.1057","0.1087","","","","","","1.09","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4303607","21.154","0.002","21.154","0.002","48.989","0.006","90","","90","","90","","21922","4","120","","120","","","","","","","","","8","I 41/a :2","-I 4ad","88","[LZn2Eu(OAc)2(PF6)(Et2O)1.5(H2O)0.25","","","- C48 H59.5 Eu F6 N4 O18.75 P Zn2 -","- C48 H59 Eu F6 N4 O18.75 P Zn2 -","- C768 H944 Eu16 F96 N64 O300 P16 Zn32 -","16","1","","Shigehisa Akine; Yoko Morita; Fumihiko Utsuno; Tatsuya Nabeshima","Multiple Folding Structures Mediated by Metal Coordination of Acyclic Multidentate Ligand","Inorganic Chemistry","2009","48","","10670","10678","10.1021/ic901372k","","","0.71069","MoKα","","0.048","0.0434","","","0.1029","0.1051","","","","","","1.06","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4303733","20.959","0.005","20.959","0.005","14.36","0.004","90","","90","","90","","6308","3","173","2","173","2","","","","","","","synthesis as described","5","I 41/a :2","-I 4ad","88","","","","- C36 H84 Fe2 N16 Si8 -","- C36 H84 Fe2 N16 Si8 -","- C144 H336 Fe8 N64 Si32 -","4","0.25","","W. Marco Boesveld; Peter B. Hitchcock; Michael F. Lappert","Varied Reactions of [M(L)]3 with HgCl2, FeBr2, CeCl3, AgOTf; Ligand Transfer, Nucleophilic Attack with Recombination and/or Fragmentation [M = Li or Na; L = N(SiMe3){C(H)N}3SiMe3]","Inorganic Chemistry","2009","48","","11444","11450","10.1021/ic901687a","","","0.71073","MoKα","","0.0714","0.043","","","0.0927","0.1027","","","","","","1.002","","","","has coordinates,has disorder","179075","2020-10-21","18:00:00",""
"4303887","26.155","0.008","26.155","0.008","22.486","0.008","90","","90","","90","","15382","9","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Uranyl(V) Ar2nacnac Phenanthroline","","- C41 H49 N4 O2 U -","- C41 H49 N4 O2 U -","- C656 H784 N64 O32 U16 -","16","1","","Michael F. Schettini; Guang Wu; Trevor W. Hayton","Coordination of N-Donor Ligands to a Uranyl(V) β-Diketiminate Complex","Inorganic Chemistry","2009","48","","11799","11808","10.1021/ic9018508","","","0.71073","MoKα","","0.0843","0.0439","","","0.0935","0.1168","","","","","","0.908","","","","has coordinates","179076","2020-10-21","18:00:00",""
"4304639","26.043","0.0006","26.043","0.0006","12.272","0.0003","90","","90","","90","","8323.3","0.3","173","1","173","1","","","","","","","","6","I 41/a :2","-I 4ad","88","ana326","","","- C14 F10 N2 O Pt Tl2 -","- C14 F10 N2 O Pt Tl2 -","- C224 F160 N32 O16 Pt16 Tl32 -","16","1","","Juan Forniés; Ana García; Elena Lalinde; M. Teresa Moreno","Luminescent One- And Two-Dimensional Extended Structures and a Loosely Associated Dimer Based on Platinum(II)-Thallium(I) Backbones","Inorganic Chemistry","2008","47","","3651","3660","10.1021/ic702180c","","","0.71073","MoKα","","0.0667","0.0412","","","0.0863","0.0956","","","","","","1.086","","","","has coordinates","179084","2020-10-21","18:00:00",""
"4305126","22.5855","0.0002","22.5855","0.0002","17.4516","0.0003","90","","90","","90","","8902.15","0.19","100","","100","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- Co16 H176 Li2 N38.7 O137.98 S32 -","- Co16 Li2 N38.72 O137.976 S32 -","- Co32 Li4 N77.44 O275.952 S64 -","2","0.125","","George I. Chilas; Marios Stylianou; Maciej Kubicki; Tiverios Vaimakis; Paul Kögerler; Anastasios D. Keramidas; Themistoklis A. Kabanos","Polynuclear Cobalt(II/III) Sulfites: Synthesis, Structure, and Magnetic Properties of the Octanuclear Cluster (NH4)11(Li@[Co4IICo4III(SO3)16(NH3)8]).10H2O Encapsulating a Lithium Cation","Inorganic Chemistry","2008","47","","4451","4453","10.1021/ic8004213","","","0.71073","MoKα","","0.0655","0.049","","","0.1466","0.1558","","","","","","1.104","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4305420","17.77032","0.00011","17.77032","0.00011","40.3177","0.0004","90","","90","","90","","12731.7","0.17","173","2","173","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C47.5 H96 N6 O4 P4 Si4 Y2 -","- C47.5 H96 N6 O4 P4 Si4 Y2 -","- C380 H768 N48 O32 P32 Si32 Y16 -","8","0.5","","Rachel H. Platel; Andrew J. P. White; Charlotte K. Williams","A Series of Bis(phosphinic)diamido Yttrium Complexes As Initiators for Lactide Polymerization","Inorganic Chemistry","2008","47","","6840","6849","10.1021/ic800419t","","","0.71073","MoKα","","0.0743","0.0354","","","0.0764","0.094","","","","","","1.086","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4306073","18.208","0.002","18.208","0.002","21.189","0.003","90","","90","","90","","7024.8","1.5","150","","150","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C76 H100 Co N8 O -","- C76 H100 Co N8 O -","- C304 H400 Co4 N32 O4 -","4","0.25","","Sónia A. Carabineiro; Ronan M. Bellabarba; Pedro T. Gomes; Sofia I. Pascu; Luís F. Veiros; Cristina Freire; Laura C. J. Pereira; Rui T. Henriques; M. Conceição Oliveira; John E. Warren","Synthesis, Structure and Magnetic Behavior of Five-Coordinate Bis(iminopyrrolyl) Complexes of Cobalt(II) containing PMe3 and THF Ligands","Inorganic Chemistry","2008","47","","8896","8911","10.1021/ic800992f","","","0.6904","MoKα","","0.1303","0.0573","","0.1005","0.0659","0.0659","","","","","","1.1394","","","","has coordinates","179098","2020-10-21","18:00:00",""
"4306514","6.9182","0.0008","6.9182","0.0008","27.309","0.003","90","","90","","90","","1307","0.3","295","2","295","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- B Na3 O16 P4 Pb -","- B Na3 O16 P4 Pb -","- B4 Na12 O64 P16 Pb4 -","4","0.25","","Stefan Hoffmann; Harold B. Tanh Jeazet; Prashanth W. Menezes; Yurii Prots; Rüdiger Kniep","Na3PbII[B(O3POH)4]: An Alkali-Metal Lead Borophosphate with Heterocubane-like Units Na3PbO4","Inorganic Chemistry","2008","47","","10193","10195","10.1021/ic801334g","","","0.71073","MoKα","","","0.0358","","","","0.086","","","","","","1.128","","","","has coordinates","179103","2020-10-21","18:00:00",""
"4307036","15.0339","0.0007","15.0339","0.0007","14.7107","0.0013","90","","90","","90","","3324.9","0.4","293","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C28 H27 Gd3 N4 O24 -","- C24 H20 Gd3 N8 O24 -","- C96 H80 Gd12 N32 O96 -","4","0.25","","You-gui Huang; Ben-lai Wu; Da-qiang Yuan; Yan-qing Xu; Fei-long Jiang; Mao-chun Hong","New Lanthanide Hybrid as Clustered Infinite Nanotunnel with 3D Ln-O-Ln Framework and (3,4)-Connected Net","Inorganic Chemistry","2007","46","","1171","1176","10.1021/ic0615271","","","0.71073","MoKα","","0.0613","0.0599","","","0.1281","0.1287","","","","","","1.275","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307037","14.9695","0.0008","14.9695","0.0008","14.6577","0.0016","90","","90","","90","","3284.6","0.4","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C28 H27 Dy3 N4 O24 -","- C24 H20 Dy3 N8 O24 -","- C96 H80 Dy12 N32 O96 -","4","0.25","","You-gui Huang; Ben-lai Wu; Da-qiang Yuan; Yan-qing Xu; Fei-long Jiang; Mao-chun Hong","New Lanthanide Hybrid as Clustered Infinite Nanotunnel with 3D Ln-O-Ln Framework and (3,4)-Connected Net","Inorganic Chemistry","2007","46","","1171","1176","10.1021/ic0615271","","","0.71073","MoKα","","0.1051","0.1038","","","0.2388","0.2395","","","","","","1.245","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307038","14.815","0.0008","14.815","0.0008","14.6396","0.0014","90","","90","","90","","3213.2","0.4","130","2","130","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C28 H27 Er3 N8 O24 -","- C24 H20 Er3 N8 O24 -","- C96 H80 Er12 N32 O96 -","4","0.25","","You-gui Huang; Ben-lai Wu; Da-qiang Yuan; Yan-qing Xu; Fei-long Jiang; Mao-chun Hong","New Lanthanide Hybrid as Clustered Infinite Nanotunnel with 3D Ln-O-Ln Framework and (3,4)-Connected Net","Inorganic Chemistry","2007","46","","1171","1176","10.1021/ic0615271","","","0.71073","MoKα","","0.0673","0.0645","","","0.1263","0.1277","","","","","","1.149","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307039","14.9759","0.0007","14.9759","0.0007","14.731","0.0013","90","","90","","90","","3303.8","0.4","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C28 H27 Eu3 N4 O24 -","- C28 H20 Eu3 N4 O24 -","- C112 H80 Eu12 N16 O96 -","4","0.25","","You-gui Huang; Ben-lai Wu; Da-qiang Yuan; Yan-qing Xu; Fei-long Jiang; Mao-chun Hong","New Lanthanide Hybrid as Clustered Infinite Nanotunnel with 3D Ln-O-Ln Framework and (3,4)-Connected Net","Inorganic Chemistry","2007","46","","1171","1176","10.1021/ic0615271","","","0.71073","MoKα","","0.0507","0.0478","","","0.1043","0.1058","","","","","","1.264","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307040","15.0751","0.0006","15.0751","0.0006","14.7426","0.0007","90","","90","","90","","3350.4","0.2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24 H27 N8 O24 Sm3 -","- C24 H20 N8 O24 Sm3 -","- C96 H80 N32 O96 Sm12 -","4","0.25","","You-gui Huang; Ben-lai Wu; Da-qiang Yuan; Yan-qing Xu; Fei-long Jiang; Mao-chun Hong","New Lanthanide Hybrid as Clustered Infinite Nanotunnel with 3D Ln-O-Ln Framework and (3,4)-Connected Net","Inorganic Chemistry","2007","46","","1171","1176","10.1021/ic0615271","","","0.71073","MoKα","","","0.052","","","0.146","0.1482","","","","","","1.224","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307041","14.9579","0.0008","14.9579","0.0008","14.6505","0.0015","90","","90","","90","","3277.9","0.4","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C28 H27 N4 O24 Y3 -","- C24 H20 N8 O24 Y3 -","- C96 H80 N32 O96 Y12 -","4","0.25","","You-gui Huang; Ben-lai Wu; Da-qiang Yuan; Yan-qing Xu; Fei-long Jiang; Mao-chun Hong","New Lanthanide Hybrid as Clustered Infinite Nanotunnel with 3D Ln-O-Ln Framework and (3,4)-Connected Net","Inorganic Chemistry","2007","46","","1171","1176","10.1021/ic0615271","","","0.71073","MoKα","","0.0799","0.0751","","","0.1922","0.1953","","","","","","1.163","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307889","26.483","0.002","26.483","0.002","10.1423","0.0009","90","","90","","90","","7113.3","1","153","2","153","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H46 Mn2 N10 Se6 Sn2 -","- C16 H46 Mn2 N10 Se6 Sn2 -","- C128 H368 Mn16 N80 Se48 Sn16 -","8","0.5","","Jian Zhou; Guo-Qing Bian; Jie Dai; Yong Zhang; Ai-bin Tang; Qin-Yu Zhu","Synthesis of a Selenidostannate(IV), [Mn(tepa).Sn3Se7]n, Demonstrating the Transformation from Achiral to Chiral and Dimeric to Polymeric Structure","Inorganic Chemistry","2007","46","","1541","1543","10.1021/ic062403r","","","0.7107","MoKα","","0.0395","0.0356","","","0.0848","0.0868","","","","","","1.089","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307890","25.832","0.002","25.832","0.002","10.0295","0.0009","90","","90","","90","","6692.6","0.9","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H46 Mn2 N10 S6 Sn2 -","- C16 H46 Mn2 N10 S6 Sn2 -","- C128 H368 Mn16 N80 S48 Sn16 -","8","0.5","","Jian Zhou; Guo-Qing Bian; Jie Dai; Yong Zhang; Ai-bin Tang; Qin-Yu Zhu","Synthesis of a Selenidostannate(IV), [Mn(tepa).Sn3Se7]n, Demonstrating the Transformation from Achiral to Chiral and Dimeric to Polymeric Structure","Inorganic Chemistry","2007","46","","1541","1543","10.1021/ic062403r","","","0.7107","MoKα","","0.0467","0.0414","","","0.11","0.1135","","","","","","1.01","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307933","36.315","0.003","36.315","0.003","9.736","0.0018","90","","90","","90","","12840","3","193","2","193","2","","","","","","","","6","I 41/a :2","-I 4ad","88","(Et4N)[7]","","","- C26 H47 N S4 Se W -","- C26 H47 N S4 Se W -","- C416 H752 N16 S64 Se16 W16 -","16","1","","Stanislav Groysman; R. H. Holm","Synthesis and Structures of Bis(dithiolene)tungsten(IV,VI) Thiolate and Selenolate Complexes: Approaches to the Active Sites of Molybdenum and Tungsten Formate Dehydrogenases","Inorganic Chemistry","2007","46","","4090","4102","10.1021/ic062441a","","","0.71073","MoKα","","0.0606","0.0399","","","0.1025","0.1117","","","","","","1.025","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307940","36.01","0.02","36.01","0.02","9.885","0.008","90","","90","","90","","12818","14","193","2","193","2","","","","","","","","6","I 41/a :2","-I 4ad","88","(Et4N)[6]","","","- C26 H47 N S4 Se W -","- C26 H47 N S4 Se W -","- C416 H752 N16 S64 Se16 W16 -","16","1","","Stanislav Groysman; R. H. Holm","Synthesis and Structures of Bis(dithiolene)tungsten(IV,VI) Thiolate and Selenolate Complexes: Approaches to the Active Sites of Molybdenum and Tungsten Formate Dehydrogenases","Inorganic Chemistry","2007","46","","4090","4102","10.1021/ic062441a","","","0.71073","MoKα","","0.0667","0.0464","","","0.1141","0.1223","","","","","","1.118","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307964","25.0996","0.0005","25.0996","0.0005","70.9292","0.0016","90","","90","","90","","44684.7","1.6","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C216 H359.2 Mn40 N8 Na4 O169.6 -","- C216 H340 Mn40 N8 Na4 O169.6 -","- C864 H1360 Mn160 N32 Na16 O678.4 -","4","0.25","","Eleni E. Moushi; Christos Lampropoulos; Wolfgang Wernsdorfer; Vassilios Nastopoulos; George Christou; Anastasios J. Tasiopoulos","A Large [Mn10Na]4 Loop of Four Linked Mn10 Loops","Inorganic Chemistry","2007","46","","3795","3797","10.1021/ic062454o","","","0.71073","MoKα","","0.114","0.0545","","","0.1537","0.1723","","","","","","0.906","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308192","28.357","0.008","28.357","0.008","14.586","0.006","90","","90","","90","","11729","7","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C60 H86 N6 O2 Yb2 -","- C60 H86 N6 O2 Yb2 -","- C480 H688 N48 O16 Yb16 -","8","0.5","","Chengfu Pi; Ruiting Liu; Pengzhi Zheng; Zhenxia Chen; Xigeng Zhou","Selective Reaction Based on the Linked Diamido Ligands of Dinuclear Lanthanide Complexes","Inorganic Chemistry","2007","46","","5252","5259","10.1021/ic070203p","","","0.71073","MoKα","","0.1041","0.0708","","","0.1451","0.1544","","","","","","1.262","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308582","7.3","0.002","7.3","0.002","15.34","0.005","90","","90","","90","","817.5","0.4","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Caesium-tetracyanoborate","","- C4 B Cs N4 -","- C4 B Cs N4 -","- C16 B4 Cs4 N16 -","4","0.25","","Torsten Küppers; Eduard Bernhardt; Helge Willner; Henning W. Rohm; Martin Köckerling","Tetracyanoborate Salts M[B(CN)4] with M = Singly Charged Cations: Properties and Structures","Inorganic Chemistry","2005","44","","1015","1022","10.1021/ic048780q","","","0.71073","MoKα","","0.0414","0.0396","","","0.1","0.102","","","","","","1.036","","","","has coordinates","179123","2020-10-21","18:00:00",""
"4308587","7.132","0.001","7.132","0.001","14.745","0.004","90","","90","","90","","750","0.3","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Ammonium-tetracyanoborate","","- C4 H4 B N5 -","- C4 H4 B N5 -","- C16 H16 B4 N20 -","4","0.25","","Torsten Küppers; Eduard Bernhardt; Helge Willner; Henning W. Rohm; Martin Köckerling","Tetracyanoborate Salts M[B(CN)4] with M = Singly Charged Cations: Properties and Structures","Inorganic Chemistry","2005","44","","1015","1022","10.1021/ic048780q","","","0.71073","MoKα","","0.0684","0.0446","","","0.1082","0.1203","","","","","","1.066","","","","has coordinates","179123","2020-10-21","18:00:00",""
"4308589","7.1354","0.0002","7.1354","0.0002","14.8197","0.0006","90","","90","","90","","754.53","0.04","566","2","273","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Rubidium-tetracyanoborate","","- C4 B N4 Rb -","- C4 B N4 Rb -","- C16 B4 N16 Rb4 -","4","0.25","","Torsten Küppers; Eduard Bernhardt; Helge Willner; Henning W. Rohm; Martin Köckerling","Tetracyanoborate Salts M[B(CN)4] with M = Singly Charged Cations: Properties and Structures","Inorganic Chemistry","2005","44","","1015","1022","10.1021/ic048780q","","","0.71073","MoKα","","0.0414","0.025","","","0.0476","0.0523","","","","","","1.082","","","","has coordinates","179123","2020-10-21","18:00:00",""
"4308590","7.0644","0.0004","7.0644","0.0004","14.6791","0.0012","90","","90","","90","","732.57","0.08","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Thallium-tetracyanoborate","","- C4 B N4 Tl -","- C4 B N4 Tl -","- C16 B4 N16 Tl4 -","4","0.25","","Torsten Küppers; Eduard Bernhardt; Helge Willner; Henning W. Rohm; Martin Köckerling","Tetracyanoborate Salts M[B(CN)4] with M = Singly Charged Cations: Properties and Structures","Inorganic Chemistry","2005","44","","1015","1022","10.1021/ic048780q","","","0.71073","MoKα","","0.0691","0.052","","","0.1326","0.1403","","","","","","1.053","","","","has coordinates","179123","2020-10-21","18:00:00",""
"4308723","14.7645","0.0012","14.7645","0.0012","13.9225","0.0014","90","","90","","90","","3035","0.5","130","2","130","2","","","","","","","","4","I 41/a :2","-I 4ad","88","Ni(OEP-NH2)","","","- C36 H45 N5 Ni -","- C36 H45 N5 Ni -","- C144 H180 N20 Ni4 -","4","0.25","","Natasza Sprutta; Sankar Prasad Rath; Marilyn M. Olmstead; Alan L. Balch","Metal Complexes of meso-Amino-octaethylporphyrin and the Oxidation of NiII(meso-amino-octaethylporphyrin)","Inorganic Chemistry","2005","44","","1452","1459","10.1021/ic0486623","","","1.54178","CuKα","","0.0354","0.0313","","","0.076","0.0783","","","","","","1.111","","","","has coordinates,has disorder","179125","2020-10-21","18:00:00",""
"4308863","12.679","0.003","12.679","0.003","33.381","0.006","90","","90","","90","","5366","2","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C48 H72 Hg N6 O4 S4 -","- C48 H72 Hg N6 O4 S4 -","- C192 H288 Hg4 N24 O16 S16 -","4","0.25","","Masahiro Kato; Kazunori Kojima; Taka-aki Okamura; Hitoshi Yamamoto; Takeshi Yamamura; Norikazu Ueyama","Relation between Intramolecular NH...S Hydrogen Bonds and Coordination Number in Mercury(II) Complexes with Carbamoylbenzenethiol Derivatives","Inorganic Chemistry","2005","44","","4037","4044","10.1021/ic0481780","","","0.71069","MoKα","","0.193","0.0534","","","0.1356","0.181","","","","","","1.052","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308871","12.9165","0.0004","12.9165","0.0004","35.038","0.002","90","","90","","90","","5845.6","0.4","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C48 H80 Cl4 N4 O8 Zn4 -","- C48 H80 Cl4 N4 O8 Zn4 -","- C192 H320 Cl16 N16 O32 Zn16 -","4","0.25","","En-Che Yang; Cem Kirman; Jon Lawrence; Lev N. Zakharov; Arnold L. Rheingold; Stephen Hill; David N. Hendrickson","Single-Molecule Magnets: High-Field Electron Paramagnetic Resonance Evaluation of the Single-Ion Zero-Field Interaction in a ZnII3NiII Complex","Inorganic Chemistry","2005","44","","3827","3836","10.1021/ic0482279","","","0.71073","MoKα","","0.0233","0.0214","","","0.0546","0.0554","","","","","","1.055","","","","has coordinates","179126","2020-10-21","18:00:00",""
"4308988","7.547","0.0009","7.547","0.0009","14.987","0.002","90","","90","","90","","853.62","0.18","295","2","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C4 K N4 Tl -","- C4 K N4 Tl -","- C16 K4 N16 Tl4 -","4","0.25","","Péter Nagy; Andreas Fischer; Julius Glaser; Andrey Ilyukhin; Mikhail Maliarik; Imre Tóth","Solubility, Complex Formation, and Redox Reactions in the Tl2O3-HCN/CN‒H2O System. Crystal Structures of the Cyano Compounds Tl(CN)3.H2O, Na[Tl(CN)4].3H2O, K[Tl(CN)4], and TlI[TlIII(CN)4] and of TlI2C2O4","Inorganic Chemistry","2005","44","","2347","2357","10.1021/ic0485918","","","0.71073","MoKα","","0.146","0.0583","","","0.0973","0.113","","","","","","0.948","","","","has coordinates","179127","2020-10-21","18:00:00",""
"4309221","25.3442","0.0005","25.3442","0.0005","20.2084","0.0006","90","","90","","90","","12980.4","0.5","200","2","200","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C108 H144 Cd8.8 P4 Se16 Zn1.2 -","- C110.4 H146.4 Cd8.8 P4 Se16 Zn1.2 -","- C441.6 H585.6 Cd35.2 P16 Se64 Zn4.8 -","4","0.25","","Marty W. DeGroot; Nicholas J. Taylor; John F. Corrigan","Controlled Synthesis of Ternary II-II'-VI Nanoclusters and the Effects of Metal Ion Distribution on Their Spectral Properties","Inorganic Chemistry","2005","44","","5447","5458","10.1021/ic0481576","","x-ray","0.71073","MoKα","","0.1337","0.0525","","","0.1104","0.1324","","","","","","1.01","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4309222","25.91","0.0002","25.91","0.0002","21.6","0.0002","90","","90","","90","","14500.7","0.2","200","2","200","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C108 H144 Cd8 P4 Te16 Zn2 -","- C108 H144 Cd8 P4 Te16 Zn2 -","- C432 H576 Cd32 P16 Te64 Zn8 -","4","0.25","","Marty W. DeGroot; Nicholas J. Taylor; John F. Corrigan","Controlled Synthesis of Ternary II-II'-VI Nanoclusters and the Effects of Metal Ion Distribution on Their Spectral Properties","Inorganic Chemistry","2005","44","","5447","5458","10.1021/ic0481576","","x-ray","0.71073","MoKα","","0.0582","0.0309","","","0.0779","0.0843","","","","","","1.067","","","","has coordinates,has disorder","179130","2020-10-21","18:00:00",""
"4309436","29.512","0.005","29.512","0.005","23.318","0.007","90","","90","","90","","20309","8","173","2","173","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C57 H53 K N3 O P2 Sm -","- C57 H53 K N3 O P2 Sm -","- C912 H848 K16 N48 O16 P32 Sm16 -","16","1","","Michael T. Gamer; Peter W. Roesky","Lanthanide-Potassium Wheels","Inorganic Chemistry","2005","44","","5963","5965","10.1021/ic050557l","","","0.71073","MoKα","","0.0877","0.0509","","","0.1495","0.1745","","","","","","1.161","","","","has coordinates","179132","2020-10-21","18:00:00",""
"4309705","16.8992","0.0007","16.8992","0.0007","18.4603","0.0014","90","","90","","90","","5271.9","0.5","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C11 H10 Cl N4 O5 Zn0.5 -","- C11 H10 Cl N4 O5 Zn0.5 -","- C176 H160 Cl16 N64 O80 Zn8 -","16","1","","D. Krishna Kumar; D. Amilan Jose; Amitava Das; Parthasarathi Dastidar","From Diamondoid Network to (4,4) Net: Effect of Ligand Topology on the Supramolecular Structural Diversity","Inorganic Chemistry","2005","44","","6933","6935","10.1021/ic050972d","","","0.71073","MoKα","","0.0294","0.0251","","","0.065","0.0675","","","","","","1.058","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4310066","21.362","0.003","21.362","0.003","9.784","0.002","90","","90","","90","","4464.8","1.3","153","2","153","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C22 H8 N4 O8 Re2 -","- C22 H8 N4 O8 Re2 -","- C176 H64 N32 O64 Re16 -","8","0.5","","Peter H. Dinolfo; Kurt D. Benkstein; Charlotte L. Stern; Joseph T. Hupp","C- and Z-Shaped Coordination Compounds. Synthesis, Structure, and Spectroelectrochemistry of cis- and trans-[Re(CO)3(L)]2-2,2'-bisbenzimidizolate with L = 4-Phenylpyridine, 2,4'-Bipyridine, or Pyridine","Inorganic Chemistry","2005","44","","8707","8714","10.1021/ic050894u","","","0.71073","MoKα","","0.0224","0.0206","","","0.0461","0.0469","","","","","","1.198","","","","has coordinates","179139","2020-10-21","18:00:00",""
"4310608","13.4623","0.0016","13.4623","0.0016","46.472","0.012","90","","90","","90","","8422","3","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C24 H22.5 Cu F12 N8 O5.25 P2 -","- C24 H16 Cu F12 N8 O5.25 P2 -","- C192 H128 Cu8 F96 N64 O42 P16 -","8","0.5","","Miao Du; Ya-Mei Guo; Shen-Tan Chen; Xian-He Bu; Stuart R. Batten; Joan Ribas; Susumu Kitagawa","Preparation of Acentric Porous Coordination Frameworks from an Interpenetrated Diamondoid Array through Anion-Exchange Procedures: Crystal Structures and Properties","Inorganic Chemistry","2004","43","","1287","1293","10.1021/ic0351242","","","0.71073","MoKα","","0.1498","0.0738","","","0.1698","0.2091","","","","","","0.992","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4311376","38.222","0.002","38.222","0.002","12.5712","0.0009","90","","90","","90","","18365.5","1.9","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C55 H54 B Ni P3 S -","- C55 H54 B Ni P3 S -","- C880 H864 B16 Ni16 P48 S16 -","16","1","","Cora E. MacBeth; J. Christopher Thomas; Theodore A. Betley; Jonas C. Peters","The Coordination Chemistry of ""[BP3]NiX"" Platforms: Targeting Low-Valent Nickel Sources as Promising Candidates to L3NiE and L3Ni\τbE Linkages","Inorganic Chemistry","2004","43","","4645","4662","10.1021/ic049936p","","","0.71073","MoKα","","0.1198","0.0523","","","0.0648","0.0706","","","","","","1.388","","","","has coordinates","179152","2020-10-21","18:00:00",""
"4311716","30.775","0.007","30.775","0.007","14.528","0.007","90","","90","","90","","13759","8","168","2","168","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C16.5 H48 O33.5 Ti4 -","- C15.989 H23.663 O33.247 Ti4 -","- C255.824 H378.608 O531.952 Ti64 -","16","1","","Tim Kemmitt; Najeh I. Al-Salim; Graeme J. Gainsford; Andrea Bubendorfer; Mark Waterland","Unprecedented Oxo-Titanium Citrate Complex Precipitated from Aqueous Citrate Solutions, Exhibiting a Novel Bilayered Ti8O10 Structural Core","Inorganic Chemistry","2004","43","","6300","6306","10.1021/ic049760r","","x-ray","0.71073","MoKα","","0.0919","0.0464","","","0.1037","0.118","","","","","","1.016","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4311994","38.717","0.004","38.717","0.004","13.053","0.003","90","","90","","90","","19567","5","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","[N{(C3F7)C(Dipp)N}2]AgPPh3","","","- C50 H49 Ag F14 N3 P -","- C50 H49 Ag F14 N3 P -","- C800 H784 Ag16 F224 N48 P16 -","16","1","","H. V. Rasika Dias; Shreeyukta Singh","Silver(I) Complexes of a Sterically Demanding Fluorinated Triazapentadienyl Ligand [N{(C3F7)C(Dipp)N}2]- (Dipp = 2,6-Diisopropylphenyl)","Inorganic Chemistry","2004","43","","7396","7402","10.1021/ic0491231","","","0.71073","MoKα","","0.0568","0.0385","","","0.0904","0.1016","","","","","","1.02","","","","has coordinates","179158","2020-10-21","18:00:00",""
"4312293","41.4326","0.0005","41.4326","0.0005","17.7556","0.0001","90","","90","","90","","30480.3","0.5","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C75 H107 Mn3 N10 O11 -","- C75 H101 Mn3 N10 O11 -","- C1200 H1616 Mn48 N160 O176 -","16","1","","Dohyun Moon; Jiheh Song; Beom Jin Kim; Byoung Jin Suh; Myoung Soo Lah","Three-Dimensional Helical Coordination Networks of a Hexanuclear Manganese Metallamacrocycle as a Helical Tecton","Inorganic Chemistry","2004","43","","8230","8232","10.1021/ic049393j","","","0.71073","MoKα","","0.0573","0.049","","","0.1301","0.1393","","","","","","1.097","","","","has coordinates","179161","2020-10-21","18:00:00",""
"4312530","20.7966","0.0009","20.7966","0.0009","10.6931","0.0005","90","","90","","90","","4624.8","0.4","90","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C10 H15 N4 O2 -","- C10 H15 N4 O2 -","- C160 H240 N64 O32 -","16","1","","Chigusa Aoki; Takayuki Ishida; Takashi Nogami","Molecular Metamagnet [Ni(4ImNNH)2(NO3)2] (4ImNNH = 4-Imidazolyl Nitronyl Nitroxide) and the Related Compounds Showing Supramolecular H-Bonding Interactions","Inorganic Chemistry","2003","42","","7616","7625","10.1021/ic0349048","","","0.7107","MoKα","","","0.0402","","","","0.0874","","","","","","1.23","","","","has coordinates","193981","2020-10-21","18:00:00",""
"4313415","23.1924","0.0015","23.1924","0.0015","82.412","0.007","90","","90","","90","","44328","6","130","2","130","2","","","","","","","synthetic","6","I 41/a :2","-I 4ad","88","Ni(II) octa-(3-thienyl)tetraphenylporphyrin","Ni(II) 5,10,15,20-tetraphenyl-2,3,7,8,12,13-17,18-octakis(3- thienyl)porphyrin","","- C78.46 H43.92 Cl7.71 N4 Ni S8 -","- C78.4667 H43.9 Cl7.518 N4 Ni S7.96667 -","- C1883.2 H1053.6 Cl180.432 N96 Ni24 S191.2 -","24","1.5","","Craig J. Medforth; Raid E. Haddad; Cinzia M. Muzzi; Neal R. Dooley; Laurent Jaquinod; David C. Shyr; Daniel J. Nurco; Marilyn M. Olmstead; Kevin M. Smith; Jian-Guo Ma; John A. Shelnutt","Unusual Aryl-Porphyrin Rotational Barriers in Peripherally Crowded Porphyrins","Inorganic Chemistry","2003","42","","2227","2241","10.1021/ic010958a","","","1.54178","CuKα","","0.1724","0.1256","","","0.3086","0.3495","","","","","","1.04","","","","has coordinates,has disorder","179193","2020-10-21","18:00:00",""
"4313426","42.6851","0.0004","42.6851","0.0004","10.2428","0.0001","90","","90","","90","","18662.6","0.3","110","2","110","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C52.25 H45 Cl3 N2 O P2 Rh -","- C52.25 H45 Cl3 N2 O P2 Rh -","- C836 H720 Cl48 N32 O16 P32 Rh16 -","16","1","","Jean-Michel Camus; Jacques Andrieu; Rinaldo Poli; Philippe Richard; Clara Baldoli; Stefano Maiorana","Rh(I) Coordination Chemistry of Chiral α-Aminophosphine(η6-arene)chromium Tricarbonyl Ligands","Inorganic Chemistry","2003","42","","2384","2390","10.1021/ic025588k","","","0.71073","MoKα","","0.0758","0.0416","","","0.0814","0.09","","","","","","1.022","","","","has coordinates","288183","2023-12-08","14:42:59",""
"4313536","11.061","0.001","11.061","0.001","8.163","0.001","90","","90","","90","","998.71","0.18","291","2","291","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Tetramethylphosphoniumfluoride Tetrahydrate","","- C4 H20 F O4 P -","- C4 H20 F O4 P -","- C16 H80 F4 O16 P4 -","4","0.25","","Andreas Kornath; F. Neumann; H. Oberhammer","Tetramethylphosphonium Fluoride: ""Naked"" Fluoride and Phosphorane","Inorganic Chemistry","2003","42","","2894","2901","10.1021/ic020663c","","","0.71069","MoKα","","0.0679","0.0257","","0.0551","0.051","","","","0.857","1.045","1.045","","","","","has coordinates","179196","2020-10-21","18:00:00",""
"4313724","21.2748","0.0002","21.2748","0.0002","17.5715","0.0002","90","","90","","90","","7953.16","0.14","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","trans-[PtCl4{Z-NH=C(Et)NHC(Et)=O}2]","","","- C12 H24 Cl4 N4 O2 Pt -","- C12 H24 Cl4 N4 O2 Pt -","- C192 H384 Cl64 N64 O32 Pt16 -","16","1","","Nadezhda A. Bokach; Vadim Yu. Kukushkin; Matti Haukka; João J. R. Fraústo da Silva; Armando J. L. Pombeiro","Pop-the-Cork Strategy in Synthetic Utilization of Imines: Stabilization by Complexation and Activation via Liberation of the Ligated Species","Inorganic Chemistry","2003","42","","3602","3608","10.1021/ic034086j","","","0.71073","MoKα","","0.0268","0.0216","","","0.0512","0.054","","","","","","1.073","","","","has coordinates,has disorder","288183","2023-12-08","14:42:59",""
"4313748","16.9731","0.0002","16.9731","0.0002","30.6315","0.0007","90","","90","","90","","8824.5","0.2","296.2","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C18 H18 N12 Pd3 -","- C18 H18 N12 Pd3 -","- C288 H288 N192 Pd48 -","16","1","","Umakoshi, Keisuke; Yamauchi, Yoko; Nakamiya, Keiko; Kojima, Takashi; Yamasaki, Mikio; Kawano, Hiroyuki; Onishi, Masayoshi","Pyrazolato-Bridged Polynuclear Palladium and Platinum Complexes. Synthesis, Structure, and Reactivity","Inorganic Chemistry","2003","42","12","3907","3916","10.1021/ic026196g","","","0.71069","MoKα","","","0.0273","","","","0.0526","","","","","","1.038","","","","has coordinates","210302","2020-10-21","18:00:00",""
"4313910","10.5256","0.0006","10.5256","0.0006","21.807","0.003","90","","90","","90","","2416","0.4","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","Co(DPM)2","","","- C22 H38 Co O4 -","- C22 H38 Co O4 -","- C88 H152 Co4 O16 -","4","0.25","","F. Albert Cotton; Chun Y. Liu; Carlos A. Murillo; Xiaoping Wang","Trapping Tetramethoxyzincate and -cobaltate(II) between Mo~2~^4+^ Units","Inorganic Chemistry","2003","42","","4619","4623","10.1021/ic034167f","","","0.71073","MoKα","","0.0301","0.0272","","","0.0729","0.0754","","","","","","1.084","","","","has coordinates","179207","2020-10-21","18:00:00",""
"4314044","24.604","0.003","24.604","0.003","12.13","0.002","90","","90","","90","","7343","1.8","168","2","168","2","","","","","","","","4","I 41/a :2","-I 4ad","88","[K(OMP)2(THF)]infinite","","","- C9 H11 K O1.5 -","- C9 H11 K O1.5 -","- C288 H352 K32 O48 -","32","2","","Timothy J. Boyle; Nicholas L. Andrews; Mark A. Rodriguez; Charles Campana; Timothy Yiu","Structural Variations of Potassium Aryloxides","Inorganic Chemistry","2003","42","","5357","5366","10.1021/ic034222k","","","0.71073","MoKα","","0.0835","0.0542","","","0.1661","0.2037","","","","","","0.779","","","","has coordinates","264242","2021-04-16","08:52:17",""
"4314327","16.9731","0.0002","16.9731","0.0002","30.6315","0.0007","90","","90","","90","","8824.5","0.2","296.2","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C18 H18 N12 Pd3 -","- C18 H18 N12 Pd3 -","- C288 H288 N192 Pd48 -","16","1","","Umakoshi, Keisuke; Yamauchi, Yoko; Nakamiya, Keiko; Kojima, Takashi; Yamasaki, Mikio; Kawano, Hiroyuki; Onishi, Masayoshi","Pyrazolato-Bridged Polynuclear Palladium and Platinum Complexes. Synthesis, Structure, and Reactivity","Inorganic Chemistry","2003","42","20","6584","6584","10.1021/ic030215k","","","0.71069","MoKα","","","0.0273","","","","0.0526","","","","","","1.038","","","","has coordinates","210296","2020-10-21","18:00:00",""
"4315079","13.4012","0.0015","13.4012","0.0015","37.099","0.003","90","","90","","90","","6662.7","1.2","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C64 H68 Cl2 Fe4 N12 O21 -","- C64 H68 Cl2 Fe4 N12 O21 -","- C256 H272 Cl8 Fe16 N48 O84 -","4","0.25","","Mariappan Murali; Sanjit Nayak; José Sánchez Costa; Joan Ribas; Ilpo Mutikainen; Urho Turpeinen; Martin Clémancey; Ricardo Garcia-Serres; Jean-Marc Latour; Patrick Gamez; Geneviève Blondin; Jan Reedijk","Discrete Tetrairon(III) Cluster Exhibiting a Square-Planar Fe4(μ4-O) Core: Structural and Magnetic Properties","Inorganic Chemistry","2010","49","","2427","2434","10.1021/ic902360x","","","0.71073","MoKα","","0.0743","0.0517","","","0.1291","0.1505","","","","","","1.1","","","","has coordinates,has disorder","288183","2023-12-08","14:42:59",""
"4315111","14.067","0.0007","14.067","0.0007","39.336","0.004","90","","90","","90","","7783.8","1","291","2","291","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C60 H44 N16 Ni4 O20 -","- C60 H40 N16 Ni4 O20 -","- C240 H160 N64 Ni16 O80 -","4","0.25","","Xia Li; Benlai Wu; Ruiying Wang; Hongyun Zhang; Caoyuan Niu; Yunyin Niu; Hongwei Hou","Hierarchical Assembly of Extended Coordination Networks Constructed by Novel Metallacalix[4]arenes Building Blocks","Inorganic Chemistry","2010","49","","2600","2613","10.1021/ic901113p","","","0.71073","MoKα","","0.0825","0.066","","","0.1872","0.2067","","","","","","1.078","","","","has coordinates","179231","2020-10-21","18:00:00",""
"4316278","21.8528","0.0004","21.8528","0.0004","9.6461","0.0002","90","","90","","90","","4606.45","0.15","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","OD13","","","- C32 H40 Mn2 N24 Nb O4 -","- C32 H40 Mn2 N24 Nb O4 -","- C128 H160 Mn8 N96 Nb4 O16 -","4","0.25","","Dawid Pinkowicz; Robert Pełka; Olga Drath; Wojciech Nitek; Maria Bałanda; Anna Małgorzata Majcher; Giordano Poneti; Barbara Sieklucka","Nature of Magnetic Interactions in 3D {[MII(pyrazole)4]2[NbIV(CN)8].4H2O}n (M = Mn, Fe, Co, Ni) Molecular Magnets","Inorganic Chemistry","2010","49","","7565","7576","10.1021/ic100937h","","","0.71073","MoKα","","0.0713","0.0394","","","0.0861","0.0993","","","","","","1.067","","","","has coordinates","179242","2020-10-21","18:00:00",""
"4316279","21.659","0.005","21.659","0.005","9.618","0.005","90","0.005","90","0.005","90","0.005","4512","3","293","2","293","2","","","","","","","synthesis as described","6","I 41/a :2","-I 4ad","88","","","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Dawid Pinkowicz; Robert Pełka; Olga Drath; Wojciech Nitek; Maria Bałanda; Anna Małgorzata Majcher; Giordano Poneti; Barbara Sieklucka","Nature of Magnetic Interactions in 3D {[MII(pyrazole)4]2[NbIV(CN)8].4H2O}n (M = Mn, Fe, Co, Ni) Molecular Magnets","Inorganic Chemistry","2010","49","","7565","7576","10.1021/ic100937h","","x-ray","0.71073","MoKα","","0.0566","0.0407","","","0.0946","0.0977","","","","","","0.928","","","","has coordinates","179242","2020-10-21","18:00:00",""
"4316280","21.592","0.0004","21.592","0.0004","9.612","0.0002","90","","90","","90","","4481.25","0.15","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","Compound 1","","","- C32 H40 Co2 N24 Nb O4 -","- C32 H40 Co2 N24 Nb O4 -","- C128 H160 Co8 N96 Nb4 O16 -","4","0.25","","Dawid Pinkowicz; Robert Pełka; Olga Drath; Wojciech Nitek; Maria Bałanda; Anna Małgorzata Majcher; Giordano Poneti; Barbara Sieklucka","Nature of Magnetic Interactions in 3D {[MII(pyrazole)4]2[NbIV(CN)8].4H2O}n (M = Mn, Fe, Co, Ni) Molecular Magnets","Inorganic Chemistry","2010","49","","7565","7576","10.1021/ic100937h","","","0.71073","MoKα","","0.0526","0.0358","","","0.0644","0.0688","","","","","","1.128","","","","has coordinates","179242","2020-10-21","18:00:00",""
"4316281","21.434","0.0004","21.434","0.0004","9.641","0.0002","90","","90","","90","","4429.23","0.15","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","Compound X","","","- C32 H40 N24 Nb Ni2 O4 -","- C32 H40 N24 Nb Ni2 O4 -","- C128 H160 N96 Nb4 Ni8 O16 -","4","0.25","","Dawid Pinkowicz; Robert Pełka; Olga Drath; Wojciech Nitek; Maria Bałanda; Anna Małgorzata Majcher; Giordano Poneti; Barbara Sieklucka","Nature of Magnetic Interactions in 3D {[MII(pyrazole)4]2[NbIV(CN)8].4H2O}n (M = Mn, Fe, Co, Ni) Molecular Magnets","Inorganic Chemistry","2010","49","","7565","7576","10.1021/ic100937h","","","0.71073","MoKα","","0.0562","0.0358","","","0.0644","0.0692","","","","","","1.07","","","","has coordinates","179242","2020-10-21","18:00:00",""
"4316358","18.782","0.003","18.782","0.003","41.025","0.01","90","","90","","90","","14472","5","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C52 H86 Mn6 N6 O24 -","- C52 H79 Mn6 N6 O23.42 -","- C416 H632 Mn48 N48 O187.36 -","8","0.5","","Iurii L. Malaestean; Victor Ch. Kravtsov; Manfred Speldrich; Galina Dulcevscaia; Yurii A. Simonov; Janusz Lipkowski; Arkady Ellern; Svetlana G. Baca; Paul Kögerler","One-Dimensional Coordination Polymers from Hexanuclear Manganese Carboxylate Clusters Featuring a {MnII4MnIII2(μ4-O)2} Core and Spacer Linkers","Inorganic Chemistry","2010","49","","7764","7772","10.1021/ic100541m","","","0.71073","MoKα","","0.1458","0.0696","","","0.1924","0.2357","","","","","","1.007","","","","has coordinates,has disorder","179243","2020-10-21","18:00:00",""
"4316516","28.462","0.003","28.462","0.003","36.084","0.008","90","","90","","90","","29231","8","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C48 H30 N18 O9 S2 Zn5 -","- C48 H28 N18 O9 S2 Zn5 -","- C768 H448 N288 O144 S32 Zn80 -","16","1","","Zhangjing Zhang; Shengchang Xiang; Yu-Sheng Chen; Shengqian Ma; Yongwoo Lee; Thomas Phely-Bobin; Banglin Chen","A Robust Highly Interpenetrated Metal-Organic Framework Constructed from Pentanuclear Clusters for Selective Sorption of Gas Molecules","Inorganic Chemistry","2010","49","","8444","8448","10.1021/ic1010083","","","0.41328","synchrotron","","0.1064","0.0797","","","0.2268","0.2365","","","","","","1.023","","","","has coordinates,has disorder","179245","2020-10-21","18:00:00",""
"4317019","12.1221","0.0012","12.1221","0.0012","24.73","0.003","90","","90","","90","","3634","0.7","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C18 H30 Cd2 Cl10 N12 -","- C18 H30 Cd2 Cl10 N12 -","- C72 H120 Cd8 Cl40 N48 -","4","0.25","","Christopher J. Adams; Mukhtar A. Kurawa; A. Guy Orpen","Coordination Chemistry in the Solid State: Reactivity of Manganese and Cadmium Chlorides with Imidazole and Pyrazole and Their Hydrochlorides","Inorganic Chemistry","2010","49","","10475","10485","10.1021/ic101403j","","","0.71073","MoKα","","0.0291","0.0203","","","0.0437","0.0462","","","","","","1.043","","","","has coordinates,has disorder","179250","2020-10-21","18:00:00",""
"4317433","37.2074","0.0005","37.2074","0.0005","17.2586","0.0003","90","","90","","90","","23892.6","0.6","180","2","180","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C39.5 H90 Li4 N8 P2 Se6 -","- C39.5 H90 Li4 N8 P2 Se6 -","- C632 H1440 Li64 N128 P32 Se96 -","16","1","","Robert P. Davies; M. Giovanna Martinelli","Synthetic and Structural Studies of Lithium Complexes of Selenophosphorus Ligands","Inorganic Chemistry","2002","41","","348","352","10.1021/ic010835q","","","0.7107","MoKα","","0.0972","0.046","","","0.0907","0.1057","","","","","","1.01","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4317512","13.0303","0.0003","13.0303","0.0003","29.5638","0.0009","90","","90","","90","","5019.6","0.2","173.2","","","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C8 H20 Cl Fe2 P2 S8 W2 -","- C8 H20 Cl Fe2 P2 S8 W2 -","- C64 H160 Cl8 Fe16 P16 S64 W16 -","8","0.5","","Yasuhiro Arikawa; Hiroyuki Kawaguchi; Kazuo Kashiwabara; Kazuyuki Tatsumi","Trithiotungsten(VI) Complexes Having Phosphine-Thiolate Hybrid Ligands: Synthesis and Cluster Forming Reactions with CuBr, FeCl2, and [Fe(CH3CN)6](ClO4)2","Inorganic Chemistry","2002","41","","513","520","10.1021/ic010921q","","","0.7107","MoKα","","","0.0648","","","","0.0731","","","","","","2.496","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4317610","19.9109","0.0015","19.9109","0.0015","54.257","0.009","90","","90","","90","","21510","4","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C112 H188.8 Co4.8 N8 O90.4 Sr3.2 -","- C112 H104 Co4.8 N8 O90.4 Sr3.2 -","- C448 H416 Co19.2 N32 O361.6 Sr12.8 -","4","0.25","","Roger G. Harrison; O. Danny Fox; Mark O. Meng; N. Kent Dalley; Leonard J. Barbour","Cation Control of Pore and Channel Size in Cage-Based Metal-Organic Porous Materials","Inorganic Chemistry","2002","41","","838","843","10.1021/ic011135o","","","0.71073","MoKα","","0.1651","0.0878","","","0.25","0.3075","","","","","","1.063","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4318079","9.771","0.004","9.771","0.004","75.783","0.005","90","","90","","90","","7235","4","296.2","","296.2","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C11 H11 Br Mn0.25 O0.5 S4 Se4 -","- C10.5 H11 Br Mn0.0625 O0.5 S4 Se4 -","- C168 H176 Br16 Mn O8 S64 Se64 -","16","1","","Emiko Fujiwara; Victor Gritsenko; Hideki Fujiwara; Itaru Tamura; Hayao Kobayashi; Madoka Tokumoto; Akiko Kobayashi","Magnetic Molecular Conductors Based on BETS Molecules and Divalent Magnetic Anions [BETS = Bis(ethylenedithio)tetraselenafulvalene]","Inorganic Chemistry","2002","41","","3230","3238","10.1021/ic011160u","","","0.71069","MoKα","","","0.0683","","","","0.0633","","","","","","2.978","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4318842","19.3059","0.0007","19.3059","0.0007","20.201","0.001","90","","90","","90","","7529.3","0.5","163","2","163","2","","","","","","","","3","I 41/a :2","-I 4ad","88","nBu4Clx, 3","","","- C44 H56 O4 -","- C44 H56 O4 -","- C352 H448 O32 -","8","0.5","","Daniel R. Evans; Mingsheng Huang; James C. Fettinger; Tracie L. Williams","Synthesis and Characterization of Diametrically Substituted Tetra-O-n-butylcalix[4]arene Ligands and Their Chelated Complexes of Titanium, Molybdenum, and Palladium","Inorganic Chemistry","2002","41","","5986","6000","10.1021/ic020446b","","","0.71073","MoKα","","0.0393","0.0322","","","0.0778","0.0826","","","","","","1.02","","","","has coordinates","259535","2020-12-04","06:05:01",""
"4319071","14.5167","0.0019","14.5167","0.0019","22.23","0.004","90","","90","","90","","4684.6","1.2","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","[MoO(CNBut)4Cl][BPh4] at 300K","","","- C44 H56 B Cl Mo N4 O -","- C44 H56 B Cl Mo N4 O -","- C176 H224 B4 Cl4 Mo4 N16 O4 -","4","0.25","","Ryan E. Da Re; Michael D. Hopkins","Electronic Spectra and Structures of d2 Molybdenum-Oxo Complexes. Effects of Structural Distortions on Orbital Energies, Two-Electron Terms, and the Mixing of Singlet and Triplet States","Inorganic Chemistry","2002","41","","6973","6985","10.1021/ic020565r","","","0.71073","MoKα","","0.0945","0.0932","","","0.2522","0.2532","","","","","","1.211","","","","has coordinates","288534","2023-12-24","00:05:04",""
"4319553","25.746","0.003","25.746","0.003","8.6695","0.0009","90","","90","","90","","5746.6","1.1","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C7.5 H17 Ag B9 O3 Re -","- C7.5 H11 Ag B9 O3 Re -","- C120 H176 Ag16 B144 O48 Re16 -","16","1","","Dianne D. Ellis; John C. Jeffery; Paul A. Jelliss; Jason A. Kautz; F. Gordon A. Stone","Silver as an Exopolyhedral Auxiliary to the Rhenacarborane Anion [Re(CO)3(η5-7,8-C2B9H11)]-","Inorganic Chemistry","2001","40","","2041","2050","10.1021/ic001140c","","","0.71073","MoKα","","0.0358","0.0313","","","0.0792","0.0812","","","","","","1.194","","","","has coordinates","288183","2023-12-08","14:42:59",""
"4320222","20.2493","0.0004","20.2493","0.0004","12.1006","0.0005","90","","90","","90","","4961.7","0.2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","Compound 5","","","- C9 H17 Cl Ni O4 -","- C9 H17 Cl Ni O4 -","- C144 H272 Cl16 Ni16 O64 -","16","1","","Valery R. Polyakov; Marian Czerwinski","Hydrogen-Bonding in Ethanol Adducts to Bis(3-R-penta-2,4-dionato)Nickel(II) Species","Inorganic Chemistry","2001","40","","4798","4802","10.1021/ic991284v","","","0.71073","MoKα","","0.0906","0.064","","0.1768","0.1708","","","","1.11","1.26","1.26","","","","","has coordinates","192777","2020-10-21","18:00:00",""
"4320483","10.8095","0.0001","10.8095","0.0001","59.0159","0.0004","90","","90","","90","","6895.73","0.1","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H34 Cl2 Cu N4 O14 -","- C32 H34 Cl2 Cu N4 O14 -","- C256 H272 Cl16 Cu8 N32 O112 -","8","0.5","","Chang Tong Yang; Boujemaa Moubaraki; Keith S. Murray; John D. Ranford; Jagadese Jayapurandara Vittal","Interconversion of a Monomer and Two Coordination Polymers of a Copper(II)-Reduced Schiff Base Ligand-1,10-Phenanthroline Complex Based on Hydrogen- and Coordinative-Bonding","Inorganic Chemistry","2001","40","","5934","5941","10.1021/ic010479b","","","0.71073","MoKα","","0.076","0.0645","","","0.1669","0.175","","","","","","1.069","","","","has coordinates,has disorder","179307","2020-10-21","18:00:00",""
"4320539","15.114","0.002","15.114","0.002","13.128","0.003","90","","90","","90","","2998.9","0.9","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C12 H13.5 Cd N2 O7 P2 S -","- C11.5 H8 Cd N2 O6.5 P2 S0.5 -","- C92 H64 Cd8 N16 O52 P16 S4 -","8","0.5","","Ponnaiyan Ayyappan; Owen R. Evans; Bruce M. Foxman; Kraig A. Wheeler; Timothy H. Warren; Wenbin Lin","New Open Frameworks Based on Metal Pyridylphosphonates","Inorganic Chemistry","2001","40","","5954","5961","10.1021/ic010609g","","","0.71073","MoKα","","0.0781","0.0364","","","0.0844","0.0954","","","","","","1.057","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320896","20.2201","0.0002","20.2201","0.0002","11.7272","0.0001","90","","90","","90","","4794.69","0.08","223","2","223","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C7 H7 F6 In O2 -","- C7 H7 F6 In O2 -","- C112 H112 F96 In16 O32 -","16","1","","Chongying Xu; Thomas H. Baum; Ilia Guzei; Arnold L. Rheingold","Synthesis and Characterization of (hfac)In(CH3)2: A Volatile Compound Useful for CVD of Indium and Indium-Containing Materials","Inorganic Chemistry","2000","39","","2008","2010","10.1021/ic990266a","","","0.71073","MoKα","","0.0386","0.0301","","0.0914","0.0762","","","","1.022","1.057","1.057","","","","","has coordinates,has disorder","179311","2020-10-21","18:00:00",""
"4321091","40.352","0.013","40.352","0.013","17.813","0.008","90","","90","","90","","29005","19","190","1","190","1","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C63 H89 Mn3 N16 O17 -","- C57.58 H58.58 Mn3 N16 O14.58 -","- C921.28 H937.28 Mn48 N256 O233.28 -","16","1","","Mooshin Moon; Inhoe Kim; Myoung Soo Lah","Three-Dimensional Framework Constructed Using Nanometer-Sized Metallamacrocycle as a Secondary Building Unit","Inorganic Chemistry","2000","39","","2710","2711","10.1021/ic991079f","","","0.71073","MoKα","","0.0939","0.0822","","","0.2281","0.2421","","","","","","1.044","","","","has coordinates","179313","2020-10-21","18:00:00",""
"4321731","15.62","0.003","15.62","0.003","18.649","0.002","90","","90","","90","","4550.1","1.3","130","2","130","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C49 H38 Cl2 Fe N6 O7 -","- C49 H37.6 Cl2 Fe N6 O7 -","- C196 H150.4 Cl8 Fe4 N24 O28 -","4","0.25","","Mary K. Ellison; Charles E. Schulz; W. Robert Scheidt","Syntheses, Characterization, and Structural Studies of Several (Nitro)(nitrosyl)iron(III) Porphyrinates: [Fe(Porph)(NO2)(NO)]","Inorganic Chemistry","1999","38","","100","108","10.1021/ic981162n","","","0.71073","MoKα","","0.0855","0.0592","","0.1818","0.1539","","","","1.116","1.118","1.118","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321856","13.966","0.002","13.9663","","33.689","0.003","90","","90","","90","","6571.2","1.1","293.2","","293.2","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C12 H15 Cl Cu N4 O5 -","- C12 H13 Cl Cu N4 O3 -","- C192 H208 Cl16 Cu16 N64 O48 -","16","1","","Naohide Matsumoto; Yuri Motoda; Toshihiro Matsuo; Toshio Nakashima; Nazzareno Re; Francoise Dahan; Jean-Pierre Tuchagues","pH-Dependent Monomer \λeftarrow→Oligomer Interconversion of Copper(II) Complexes with N-(2-R-imidazol-4-ylmethylidene)-2-aminoethylpyridine (R = Methyl, Phenyl)","Inorganic Chemistry","1999","38","","1165","1173","10.1021/ic981158b","","","0.7107","MoKα","","0.0756","0.0756","","","0.0855","0.0855","","","","","","1.902","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321924","13.806","0.002","13.806","0.002","36.254","0.007","90","","90","","90","","6910.2","1.9","293","2","173","2","","","","","","","","8","I 41/a :2","-I 4ad","88","Tetrakis[(2-quinolylmethanolato)-zinc-(pentafluorothiophenolate)]","","","- C66 H36 Cl4 F20 N4 O4 S4 Zn4 -","- C66 H36 Cl4 F20 N4 O4 S4 Zn4 -","- C264 H144 Cl16 F80 N16 O16 S16 Zn16 -","4","0.25","","Bodo Müller; Astrid Schneider; Markus Tesmer; Heinrich Vahrenkamp","Alcohol and Aldehyde Adducts of Zinc Thiolates: Structural Modeling of Alcoholdehydrogenase","Inorganic Chemistry","1999","38","","1900","1907","10.1021/ic981227m","","","0.71073","MoKα","","0.0512","0.0405","","","0.104","0.1126","","","","","","1.054","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4322154","17.318","0.003","17.3177","","30.432","0.004","90","","90","","90","","9127","2","20","","20","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C15 H30 Cl Cu N7 O8 -","- C240 H352 Cl16 Cu16 N112 O116 -","- C240 H352 Cl16 Cu16 N112 O116 -","","","","Yoshiki Shii; Yuri Motoda; Toshihiro Matsuo; Fumiaki Kai; Toshio Nakashima; Jean-Pierre Tuchagues; Naohide Matsumoto","Deprotonation-Induced Enantioselective Aggregation and Deprotonation-Induced Ligand Rearrangement of Copper(II) Complexes Yield 1D Homochiral and Heterochiral Chains and a Cyclic Tetramer, Respectively","Inorganic Chemistry","1999","38","","3513","3522","10.1021/ic9813260","","","0.7107","MoKalpha","","","0.083","","","0.056","","","","","1.77","1.77","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322525","19.8952","0.0011","19.8952","0.0011","54.545","0.007","90","","90","","90","","21590","3","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C28 H54 Fe N2 O26 Sr -","- C28 H26 Fe N2 O26 Sr -","- C448 H416 Fe16 N32 O416 Sr16 -","16","1","","O. Danny Fox; N. Kent Dalley; Roger G. Harrison","Structure and Small Molecule Binding of a Tetranuclear Iron(II) Resorc[4]arene-Based Cage Complex","Inorganic Chemistry","1999","38","","5860","5863","10.1021/ic990834m","","","0.71073","MoKα","","0.2099","0.0953","","0.3541","0.2399","","","","1.055","1.22","1.22","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322526","19.822","0.004","19.822","0.004","54.339","0.02","90","","90","","90","","21350","10","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C112 H188.43 Br Fe4.6 N8 O90.2 Sr3.4 -","- C112 H104 Br Fe4.6 N8 O90.2 Sr3.4 -","- C448 H416 Br4 Fe18.4 N32 O360.8 Sr13.6 -","4","0.25","","O. Danny Fox; N. Kent Dalley; Roger G. Harrison","Structure and Small Molecule Binding of a Tetranuclear Iron(II) Resorc[4]arene-Based Cage Complex","Inorganic Chemistry","1999","38","","5860","5863","10.1021/ic990834m","","","0.71073","MoKα","","0.2145","0.1011","","0.3705","0.2487","","","","1.04","1.199","1.199","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322890","23.114","0.003","23.1144","","14.973","0.006","90","","90","","90","","8000","3","20","","20","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C14 H28 Cu N6 O5 -","- C224 H288 Cu16 N96 O80 -","- C224 H288 Cu16 N96 O80 -","","","","Masaaki Mimura; Toshihiro Matsuo; Toshio Nakashima; Naohide Matsumoto","Zigzag-Chain and Cyclic-Tetrameric Compounds Derived by Deprotonation of Mononuclear Copper(II) Complexes with N,N'-Bis(2-substituted-imidazol-4-ylmethyl- idene)-1,4-diaminobutane (2-Substituent = H, Me): Synthesis, Characterization, Structure, Substituent Effect, and Interconvertibility","Inorganic Chemistry","1998","37","","3553","3560","10.1021/ic971609c","","","0.7107","MoKalpha","","","0.048","","","0.03","","","","","2.09","2.09","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322921","21.389","0.003","21.389","0.003","29.359","0.006","90","","90","","90","","13431","4","173","2","173","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","bis((mu|3$-benziimidazole-2-thiolato-S,S,N)-(dicarbonyl-rhodium(i))- (chloride-dicarbonyl-rhodium(i))) dichloromethane solvate","","- C23 H12 Cl4 N4 O8 Rh4 S2 -","- C23 H12 Cl4 N4 O8 Rh4 S2 -","- C368 H192 Cl64 N64 O128 Rh64 S32 -","16","1","","Cristina Tejel; B. Eva Villarroya; Miguel A. Ciriano; Andrew J. Edwards; Fernando J. Lahoz; Luis A. Oro; Maurizio Lanfranchi; Antonio Tiripicchio; Marisa Tiripicchio-Camellini","Hydrogen Bonding and Isomerism Arising from the Coordination Modes of Bridging Benzimidazole-2-thiolate Ligands in Tetranuclear Rhodium Complexes","Inorganic Chemistry","1998","37","","3954","3963","10.1021/ic971376p","","","0.71073","MoKα","","0.0537","0.0463","","0.1253","0.1179","","","","1.062","1.073","1.073","","","","","has coordinates,has disorder","179332","2020-10-21","18:00:00",""
"4322927","13.874","0.003","13.874","0.003","25.14","0.03","90","","90","","90","","4839","6","293","","293","","","","","","","","","5","I 41/a :2","-I 4ad","88","","[Dimethyl(1,10-phenanthroline)bis(selenophenolato)platinum(IV)]","","- C26 H24 N2 Pt Se2 -","- C26 H24 N2 Pt Se2 -","- C208 H192 N16 Pt8 Se16 -","8","0.5","","Allan J. Canty; Hong Jin; Brian W. Skelton; Allan H. White","Oxidation of Complexes by (O2CPh)2 and (ER)2 (E = S, Se), Including Structures of Pd(CH2CH2CH2CH2)(SePh)2(bpy) (bpy = 2,2'-Bipyridine) and MMe2(SePh)2(L2) (M = Pd, Pt; L2= bpy, 1,10-Phenanthroline) and C...O and C...E Bond Formation at Palladium(IV)","Inorganic Chemistry","1998","37","","3975","3981","10.1021/ic9715005","","","0.71073","Mo_K","","0.074","0.036","","0.058","0.043","","","","1.103","1.078","1.078","","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4323239","38.555","0.003","38.555","0.003","11.865","0.002","90","","90","","90","","17637","4","130","2","130","2","","","","","","","","7","I 41/a :2","-I 4ad","88","[Fe~8~(μ-O)~4~(μ-BMDP)~4~(OH)~4~(OAc)~4~]{BF~4~]~3~[OH]^.^2CH~3~CN^.^8H~2~O","","","- C136 H179 B3 F12 Fe8 N34 O29 -","- C136 H152 B3 F12 Fe8 N34 O29 -","- C544 H608 B12 F48 Fe32 N136 O116 -","4","0.25","","Joe H. Satcher,; Marilyn M. Olmstead; Michael W. Droege; Sean R. Parkin; Bruce C. Noll; Leopold May; Alan L. Balch","Novel Square Arrangements in Tetranuclear and Octanuclear Iron(III) Complexes with Asymmetric Iron Environments Created by the Unsymmetric Bridging Ligand N,N,N'-Tris((N-methyl)-2-benzimidazolylmethyl)-N'-methyl-1,3-diamino-2-propanol","Inorganic Chemistry","1998","37","","6751","6758","10.1021/ic9802404","","","1.54178","CuKα","","0.1759","0.1175","","0.3837","0.324","","","","1.017","1.137","1.137","","","","","has coordinates,has disorder","179335","2020-10-21","18:00:00",""
"4323245","19.413","0.001","19.413","0.001","32.193","0.003","90","","90","","90","","12132.4","1.4","293","2","293","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C19 H30 B Cl2 N8 O2 P2 Re -","- C19 H28 B Cl2 N8 O2 P2 Re -","- C304 H448 B16 Cl32 N128 O32 P32 Re16 -","16","1","","António Paulo; K. Rajender Reddy; Ângela Domingos; Isabel Santos","Neutral trans-Dioxorhenium(V) Complexes with the Anionic Tetrakis(pyrazolyl)borate Ligand","Inorganic Chemistry","1998","37","","6807","6813","10.1021/ic980422y","","","0.71073","MoKα","","0.1434","0.0756","","0.2513","0.1896","","","","1.108","1.184","1.184","","","","","has coordinates","179335","2020-10-21","18:00:00",""
"4323549","33.196","0.002","33.196","0.002","15.236","0.002","90","","90","","90","","16790","3","293","2","293","2","","","","","","","reaction of ZrCl4 with HSnBu3 followed by addition of [Ph4P]Cl,crystallized in MeCN/hexane/Et2O system","5","I 41/a :2","-I 4ad","88","","tris(tetraphenylphosphnium) dodecakis-μ-chloro-hexachloro- pentahydrido-hexa-zirconium","","- C72 H65 Cl18 P3 Zr6 -","- C72 H60 Cl18 P3 Zr6 -","- C576 H480 Cl144 P24 Zr48 -","8","0.5","","Linfeng Chen; F. Albert Cotton; William A. Wojtczak","Synthesis and Structural Characterization of Compounds Containing the [Zr6Cl18H5]3- Cluster Anion. Determination of the Number of Cluster Hydrogen Atoms","Inorganic Chemistry","1997","36","","4047","4054","10.1021/ic960173i","","","0.71073","MoKα","","0.0809","0.0413","","0.0687","0.0635","","","","0.912","1.065","1.065","","","","","has coordinates","179338","2020-10-21","18:00:00",""
"4323802","15.798","0.003","15.798","0.003","23.728","0.004","90","","90","","90","","5922","1.9","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C18 H14 N O0.5 Pd S -","- C18 N O Pd S -","- C288 N16 O16 Pd16 S16 -","16","1","","Tatsuya Kawamoto; Isoroku Nagasawa; Hiro Kuma; Yoshihiko Kushi","Pd...H-C Interactions. Preparation and Structure of Orthometalated Tetranuclear Complexes of Palladium(II) and Platinum(II)","Inorganic Chemistry","1996","35","","2427","2432","10.1021/ic950769q","","","0.71073","MoKα","","","0.061","","","0.064","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4323803","15.496","0.002","15.496","0.002","24.348","0.003","90","","90","","90","","5846.6","1.3","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C17 H11 N Pt S -","- C17 N Pt S -","- C272 N16 Pt16 S16 -","16","1","","Tatsuya Kawamoto; Isoroku Nagasawa; Hiro Kuma; Yoshihiko Kushi","Pd...H-C Interactions. Preparation and Structure of Orthometalated Tetranuclear Complexes of Palladium(II) and Platinum(II)","Inorganic Chemistry","1996","35","","2427","2432","10.1021/ic950769q","","","1.54184","CuKα","","","0.083","","","0.085","","","","","","","","","","","has coordinates","190532","2020-10-21","18:00:00",""
"4324022","12.333","0.002","12.333","0.002","26.132","0.006","90","","90","","90","","3974.8","1.3","193","2","193","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C24 H62 Cl4 N12 Ni O5 P4 -","- C24 H62 Cl4 N12 Ni O5 P4 -","- C96 H248 Cl16 N48 Ni4 O20 P16 -","4","0.25","","Donald J. Darensbourg; Tara J. Decuir; Nicole White Stafford; Jeffrey B. Robertson; Jennifer D. Draper; Joseph H. Reibenspies; Agnes Kathó; Ferenc Joó","Water-Soluble Organometallic Compounds. 6.1Synthesis, Spectral Properties, and Crystal Structures of Complexes of 1,3,5-Triaza-7-phosphaadamantane with Group 10 Metals","Inorganic Chemistry","1997","36","","4218","4226","10.1021/ic970238x","","","0.71073","MoKα","","0.164","0.0683","","0.1544","0.1058","","","","1.001","1.119","1.119","","","","","has coordinates","179343","2020-10-21","18:00:00",""
"4324025","12.466","0.003","12.466","0.003","25.855","0.015","90","","90","","90","","4018","3","193","2","193","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C24 H56 Cl4 N12 O2 P4 Pt -","- C24 H56 Cl4 N12 O2 P4 Pt -","- C96 H224 Cl16 N48 O8 P16 Pt4 -","4","0.25","","Donald J. Darensbourg; Tara J. Decuir; Nicole White Stafford; Jeffrey B. Robertson; Jennifer D. Draper; Joseph H. Reibenspies; Agnes Kathó; Ferenc Joó","Water-Soluble Organometallic Compounds. 6.1Synthesis, Spectral Properties, and Crystal Structures of Complexes of 1,3,5-Triaza-7-phosphaadamantane with Group 10 Metals","Inorganic Chemistry","1997","36","","4218","4226","10.1021/ic970238x","","","0.71073","MoKα","","0.1023","0.0701","","0.2281","0.1663","","","","1.035","1.051","1.051","","","","","has coordinates","179343","2020-10-21","18:00:00",""
"4324122","9.5245","0.001","9.5245","0.001","24.571","0.006","90","","90","","90","","2229","0.6","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C16 H24 N4 O8 P4 -","- C16 H24 N4 O8 P4 -","- C64 H96 N16 O32 P16 -","4","0.25","","Dheeraj Kumar; Nem Singh; Karunesh Keshav; Anil J. Elias","Ring-Closing Metathesis Reactions of Terminal Alkene-Derived Cyclic Phosphazenes","Inorganic Chemistry","2011","50","","250","260","10.1021/ic101884s","","","0.71073","MoKα","","0.0434","0.0401","","","0.0966","0.0985","","","","","","1.124","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4324688","31.9811","0.0013","31.9811","0.0013","14.657","0.003","90","","90","","90","","14991","3","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C108 H88 Cl4 Fe12 N8 O56 -","- C108 H88 Cl4 Fe12 N8 O56 -","- C432 H352 Cl16 Fe48 N32 O224 -","4","0.25","","Jia-Ping Tong; Feng Shao; Jun Tao; Rong-Bin Huang; Lan-Sun Zheng","Microwave-Assisted Synthesis of a Ferrimagnetic Dodecanuclear Iron(III) Complex with a Fe4(OH)4 Cubane Core","Inorganic Chemistry","2011","50","","2067","2069","10.1021/ic102411u","","","0.71073","MoKα","","0.1983","0.0954","","","0.2345","0.2887","","","","","","0.988","","","","has coordinates","179349","2020-10-21","18:00:00",""
"4324943","12.6302","0.0005","12.6302","0.0005","28.8439","0.0012","90","","90","","90","","4601.2","0.3","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C42 H58 Cl4 Cu4 N4 O3 -","- C42 H58 Cl4 Cu4 N4 O3 -","- C168 H232 Cl16 Cu16 N16 O12 -","4","0.25","","Mrinal Sarkar; Rodolphe Clérac; Corine Mathonière; Nigel G. R. Hearns; Valerio Bertolasi; Debashis Ray","New Phenoxido-Bridged Quasi-Tetrahedral and Rhomboidal [Cu4] Compounds Bearing μ4-Oxido or μ1,1-Azido Ligands: Synthesis, Chemical Reactivity, and Magnetic Studies","Inorganic Chemistry","2011","50","","3922","3933","10.1021/ic102226j","","","0.71073","MoKα","","0.0816","0.0488","","","0.1819","0.2282","","","","","","0.844","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4325428","15.298","0.001","15.298","0.001","22.517","0.003","90","","90","","90","","5269.6","0.9","100","2","100","2","","","","","","","synthesis as described","5","I 41/a :2","-I 4ad","88","","poly-[(mu-acetato-K2-O,O')(mu3-adeninato-k3-N3:N7:N9)copper(II)]","","- C14 H20 Cu2 O7 n10 -","- C14 H14 Cu2 N10 O6.952 -","- C112 H112 Cu16 N80 O55.616 -","8","0.5","","Sonia Pérez-Yáñez; Garikoitz Beobide; Oscar Castillo; Javier Cepeda; Antonio Luque; Andrés T. Aguayo; Pascual Román","Open-Framework Copper Adeninate Compounds with Three-Dimensional Microchannels Tailored by Aliphatic Monocarboxylic Acids","Inorganic Chemistry","2011","50","","5330","5332","10.1021/ic200560b","","","0.71073","MoKα","","0.1165","0.0723","","","0.1931","0.209","","","","","","1.046","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4325429","15.348","0.005","15.348","0.005","22.702","0.005","90","","90","","90","","5348","3","100","2","100","2","","","","","","","synthesis as described","5","I 41/a :2","-I 4ad","88","","poly-[(mu3-adeninato-k3-N3:N7:N9)(mu-butanoato-K2-O,O')copper(II)]","","- C18 H28 Cu2 O7 n10 -","- C18 H22 Cu2 N10 O7 -","- C144 H176 Cu16 N80 O56 -","8","0.5","","Sonia Pérez-Yáñez; Garikoitz Beobide; Oscar Castillo; Javier Cepeda; Antonio Luque; Andrés T. Aguayo; Pascual Román","Open-Framework Copper Adeninate Compounds with Three-Dimensional Microchannels Tailored by Aliphatic Monocarboxylic Acids","Inorganic Chemistry","2011","50","","5330","5332","10.1021/ic200560b","","","0.71073","MoKα","","0.208","0.0622","","","0.083","0.1014","","","","","","1.068","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4325554","24.149","0.004","24.149","0.004","13.576","0.005","90","","90","","90","","7917","3","91","2","91","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C44 H32 B2 F8 N8 Pd -","- C44 H32 B2 F8 N8 Pd -","- C352 H256 B16 F64 N64 Pd8 -","8","0.5","","Kelly J. Kilpin; Emma L. Gavey; C. John McAdam; Christopher B. Anderson; Samuel J. Lind; Courtney C. Keep; Keith C. Gordon; James D. Crowley","Palladium(II) Complexes of Readily Functionalized Bidentate 2-Pyridyl-1,2,3-triazole ""Click"" Ligands: A Synthetic, Structural, Spectroscopic, and Computational Study","Inorganic Chemistry","2011","50","","6334","6346","10.1021/ic200789b","","","0.71073","MoKα","","0.0917","0.0627","","","0.1745","0.2005","","","","","","1.072","","","","has coordinates","179358","2020-10-21","18:00:00",""
"4325826","14.7107","0.0014","14.7107","0.0014","9.6386","0.0017","90","","90","","90","","2085.8","0.5","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Bis(1,1,1,5,5,5-hexafluoropentane-2,2,4,4-tetraolate)-tetratin(II)","","- C10 H4 F12 O8 Sn4 -","- C10 H4 F12 O8 Sn4 -","- C40 H16 F48 O32 Sn16 -","4","0.25","","Zheng Wei; Jen-Hsien Yang; Volodimir D. Vreshch; Alexander V. Zabula; Alexander S. Filatov; Evgeny V. Dikarev","Homoleptic Tetranuclear Complexes of Divalent Tin and Lead Tetraolates","Inorganic Chemistry","2011","50","","7295","7300","10.1021/ic200890h","","","0.71073","Mo-Kα","","0.0197","0.0187","","","0.051","0.052","","","","","","1.046","","","","has coordinates","179361","2020-10-21","18:00:00",""
"4325884","27.9354","0.0013","27.9354","0.0013","15.2254","0.0008","90","","90","","90","","11881.7","1","90","2","90","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C84 H96 Cl8 Cu0 N32 O40 Pb4 -","- C84 H96 Cl8 N32 O40 Pb4 -","- C336 H384 Cl32 N128 O160 Pb16 -","4","0.25","","Daniel J. Hutchinson; Lyall R. Hanton; Stephen C. Moratti","Metal Ion-Controlled Self-Assembly Using Pyrimidine Hydrazone Molecular Strands with Terminal Hydroxymethyl Groups: A Comparison of Pb(II) and Zn(II) Complexes","Inorganic Chemistry","2011","50","","7637","7649","10.1021/ic200670w","","","0.71073","MoKα","","0.0473","0.0402","","","0.117","0.1225","","","","","","1.193","","","","has coordinates,has disorder","179361","2020-10-21","18:00:00",""
"4325885","27.861","0.004","27.861","0.004","15.258","0.004","90","","90","","90","","11844","4","90","2","90","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C21.75 H24 Cl2 N8.75 O11.5 Pb -","- C21.75 H24 Cl2 N8.75 O11.5 Pb -","- C348 H384 Cl32 N140 O184 Pb16 -","16","1","","Daniel J. Hutchinson; Lyall R. Hanton; Stephen C. Moratti","Metal Ion-Controlled Self-Assembly Using Pyrimidine Hydrazone Molecular Strands with Terminal Hydroxymethyl Groups: A Comparison of Pb(II) and Zn(II) Complexes","Inorganic Chemistry","2011","50","","7637","7649","10.1021/ic200670w","","","0.71073","MoKα","","0.0584","0.0505","","","0.1104","0.1144","","","","","","1.161","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4326243","20.7511","0.0002","20.7511","0.0002","43.0804","0.0015","90","","90","","90","","18550.8","0.7","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C104 H122 As8 Cu8 Mo24 N48 O93 -","- C104 H120 As8 Cu8 Mo24 N48 O93 -","- C416 H480 As32 Cu32 Mo96 N192 O372 -","4","0.25","","Bo Liu; Zhen-Tao Yu; Jin Yang; Wu Hua; Ying-Ying Liu; Jian-Fang Ma","First Three-Dimensional Inorganic-Organic Hybrid Material Constructed From an ""Inverted Keggin"" Polyoxometalate and a Copper(I)-Organic Complex","Inorganic Chemistry","2011","50","","8967","8972","10.1021/ic201135g","","","0.71073","MoKα","","0.0904","0.0522","","","0.1109","0.1244","","","","","","1.074","","","","has coordinates","179365","2020-10-21","18:00:00",""
"4326411","12.832","0.003","12.832","0.003","9.817","0.002","90","","90","","90","","1616.5","0.6","100","2","100","2","","","","","","","","3","I 41/a :2","-I 4ad","88","Neptunium di-mue-thiotetrathiodiphosphate","","","- Np P4 S12 -","- Np P4 S12 -","- Np4 P16 S48 -","4","0.25","","Geng Bang Jin; S. Skanthakumar; Richard G. Haire; L. Soderholm; James A. Ibers","Neptunium Thiophosphate Chemistry: Intermediate Behavior between Uranium and Plutonium","Inorganic Chemistry","2011","50","","9688","9695","10.1021/ic201493w","","","0.71073","MoKα","","0.033","0.0237","","","0.0407","0.0425","","","","","","1.248","","","","has coordinates","179367","2020-10-21","18:00:00",""
"4327017","37.3334","0.0007","37.3334","0.0007","12.9469","0.0003","90","","90","","90","","18045.2","0.6","120","2","120","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C26 H68 Cl20 P8 U4 -","- C26 H68 Cl20 P8 U4 -","- C208 H544 Cl160 P64 U32 -","8","0.5","","Brian S. Newell; Trevor C. Schwaab; Matthew P. Shores","Synthesis and Characterization of a Novel Tetranuclear 5f Compound: A New Synthon for Exploring U(IV) Chemistry","Inorganic Chemistry","2011","50","","12108","12115","10.1021/ic201670z","","","0.71073","MoKα","","0.0724","0.0592","","","0.1808","0.1906","","","","","","1.093","","","","has coordinates,has disorder","179373","2020-10-21","18:00:00",""
"4327535","13.477","0.003","13.477","0.003","46.167","0.013","90","","90","","90","","8385","4","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C24 H26 Cl Cu N8 O11.5 -","- C24 H16 Cl Cu N8 O11.5 -","- C192 H128 Cl8 Cu8 N64 O92 -","8","0.5","","Miao Du; Xian-He Bu; Ya-Mei Guo; He Liu; Stuart R. Batten; Joan Ribas; Thomas C. W. Mak","First CuII Diamondoid Net with 2-Fold Interpenetrating Frameworks. The Role of Anions in the Construction of the Supramolecular Arrays","Inorganic Chemistry","2002","41","","4904","4908","10.1021/ic025559+","","","0.71073","MoKα","","0.1641","0.0579","","","0.1132","0.1419","","","","","","1.02","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4327944","22.616","0.001","22.616","0.001","16.932","0.001","90","","90","","90","","8660.4","0.7","150","0.1","150","0.1","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C72 H96 Cu4 I4 O14 P4 Si4 -","- C72 H96 Cu4 I4 O14 P4 Si4 -","- C288 H384 Cu16 I16 O56 P16 Si16 -","4","0.25","","Sandrine Perruchas; Nicolas Desboeufs; Sébastien Maron; Xavier F. Le Goff; Alexandre Fargues; Alain Garcia; Thierry Gacoin; Jean-Pierre Boilot","Siloxanol-Functionalized Copper Iodide Cluster as a Thermochromic Luminescent Building Block","Inorganic Chemistry","2012","51","","794","798","10.1021/ic200672r","","","0.71069","MoKα","","0.0484","0.0351","","","0.099","0.105","","","","","","1.074","","","","has coordinates","179382","2020-10-21","18:00:00",""
"4327989","18.3102","0.0006","18.3102","0.0006","30.8926","0.001","90","","90","","90","","10357.2","0.6","100","2","100","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C23 H22 Cl N3 O3.5 Pd S -","- C23 H22 Cl N3 O3.5 Pd S -","- C368 H352 Cl16 N48 O56 Pd16 S16 -","16","1","","Qi-Qiang Wang; Rowshan Ara Begum; Victor W. Day; Kristin Bowman-James","Molecular Thioamide \λeftarrow→Iminothiolate Switches for Sulfur Mustards","Inorganic Chemistry","2012","51","","760","762","10.1021/ic202087u","","","1.54178","CuKα","","0.0598","0.0584","","","0.1833","0.1848","","","","","","1.046","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4328032","17.52963","0.00004","17.52963","","32.85747","0.00009","90","","90","","90","","10096.7","0.04","298","","298","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Ga6 O25 Sc4 Sr10 -","- Ga6 O25 Sc4 Sr10 -","- Ga96 O400 Sc64 Sr160 -","16","1","","Sergey V. Chernov; Yuri A. Dobrovolsky; Sergey Ya. Istomin; Evgeny V. Antipov; Jekabs Grins; Gunnar Svensson; Nadezhda V. Tarakina; Artem M. Abakumov; Gustaaf Van Tendeloo; Sten G. Eriksson; Seikh M. H. Rahman","Sr2GaScO5, Sr10Ga6Sc4O25, and SrGa0.75Sc0.25O2.5: a Play in the Octahedra to Tetrahedra Ratio in Oxygen-Deficient Perovskites","Inorganic Chemistry","2012","51","","1094","1103","10.1021/ic202236h","powder diffraction","x-ray","1.5406","CuKα~1~","","","","","","","","0.02875","","1.89","","","","","","","has coordinates","179383","2020-10-21","18:00:00",""
"4328290","21.85","0.03","21.85","0.03","11.41","0.03","90","","90","","90","","5447","18","110","2","110","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C52 H12 Au4 F32 N8 -","- C52 H12 Au4 F32 N8 -","- C208 H48 Au16 F128 N32 -","4","0.25","","Hanan E. Abdou; Ahmed A. Mohamed; José M. López-de-Luzuriaga; Miguel Monge; John P. Fackler","Fine-Tuning the Luminescence and HOMO-LUMO Energy Levels in Tetranuclear Gold(I) Fluorinated Amidinate Complexes","Inorganic Chemistry","2012","51","","2010","2015","10.1021/ic2010634","","","0.71073","MoKα","","0.0621","0.0361","","","0.0986","0.1187","","","","","","1.107","","","","has coordinates","179385","2020-10-21","18:00:00",""
"4328349","21.739","0.005","21.739","0.005","26.188","0.006","90","","90","","90","","12376","5","273","2","273","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C24 H52 K Mo12 N4 Na O68 P8 -","- C24 H52 K Mo12 N4 Na O68 P8 -","- C96 H208 K4 Mo48 N16 Na4 O272 P32 -","4","0.25","","Hani El Moll; Anne Dolbecq; Israël Martyr Mbomekalle; Jérôme Marrot; Philippe Deniard; Rémi Dessapt; Pierre Mialane","Tuning the Photochromic Properties of Molybdenum Bisphosphonate Polyoxometalates","Inorganic Chemistry","2012","51","","2291","2302","10.1021/ic202299d","","","0.71073","MoKα","","0.0981","0.0571","","","0.1691","0.1798","","","","","","0.941","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4328879","18.067","0.003","18.067","0.003","43.026","0.009","90","","90","","90","","14044","4","153.2","0.2","153.2","0.2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C36 H22 F11 Ir N5 P -","- C36 H22 F11 Ir N5 P -","- C576 H352 F176 Ir16 N80 P16 -","16","1","","Lei He; Dongxin Ma; Lian Duan; Yongge Wei; Juan Qiao; Deqiang Zhang; Guifang Dong; Liduo Wang; Yong Qiu","Control of Intramolecular π-π Stacking Interaction in Cationic Iridium Complexes via Fluorination of Pendant Phenyl Rings","Inorganic Chemistry","2012","51","","4502","4510","10.1021/ic2021325","","","0.71073","MoKα","","0.05","0.0449","","","0.1028","0.1058","","","","","","1.13","","","","has coordinates,has disorder","179391","2020-10-21","18:00:00",""
"4329507","33.4404","0.0014","33.4404","0.0014","22.3622","0.0009","90","","90","","90","","25006.8","1.8","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C33 H81 Cu6 N12 O18 P2 -","- C33 H69 Cu6 N12 O18 P2 -","- C528 H1104 Cu96 N192 O288 P32 -","16","1","","Saskia Speed; Ramon Vicente; Daniel Aravena; Eliseo Ruiz; Olivier Roubeau; Simon J. Teat; M. Salah El Fallah","Hexanuclear Copper(II) Cages Built on a Central {μ3-O...H...μ3-O} Moiety, 1,3-Bis(dimethylamino)-2-propanolato and Capping R-phosphonates: Crystal Structures, Magnetic Behavior, and DFT Studies","Inorganic Chemistry","2012","51","","6842","6850","10.1021/ic300589h","","","0.7749","synchrotron","","0.0774","0.0692","","","0.1958","0.2075","","","","","","1.039","","","","has coordinates,has disorder","179398","2020-10-21","18:00:00",""
"4329815","16.812","0.0007","16.812","0.0007","17.5449","0.0009","90","","90","","90","","4958.9","0.4","133","2","133","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C48 H56 N8 Ni4 O13 -","- C48 H56 N8 Ni4 O13 -","- C192 H224 N32 Ni16 O52 -","4","0.25","","Animesh Das; Felix J. Klinke; Serhiy Demeshko; Steffen Meyer; Sebastian Dechert; Franc Meyer","Reversible Solvatomagnetic Effect in Novel Tetranuclear Cubane-Type Ni4 Complexes and Magnetostructural Correlations for the [Ni4(μ3-O)4] Core","Inorganic Chemistry","2012","51","","8141","8149","10.1021/ic300535d","","","0.71073","MoKα","","0.1179","0.0622","","","0.1373","0.154","","","","","","1.012","","","","has coordinates,has disorder","179401","2020-10-21","18:00:00",""
"4329956","17.5087","0.0011","17.5087","0.0011","15.1964","0.0012","90","","90","","90","","4658.5","0.6","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C22 H26 Cu2 N4 O7 -","- C22 H24 Cu2 N4 O7 -","- C176 H192 Cu16 N32 O56 -","8","0.5","","Elena Ilyes; Mihaela Florea; Augustin M. Madalan; Ionel Haiduc; Vasile I. Parvulescu; Marius Andruh","A Robust Metal-Organic Framework Constructed from Alkoxo-Bridged Binuclear Nodes and Hexamethylenetetramine Spacers: Crystal Structure and Sorption Studies","Inorganic Chemistry","2012","51","","7954","7956","10.1021/ic301139j","","","0.71073","MoKα","","0.0633","0.0428","","","0.0759","0.081","","","","","","1.098","","","","has coordinates","179402","2020-10-21","18:00:00",""
"4330314","19.449","0.005","19.449","0.005","23.283","0.005","90","0.005","90","0.005","90","0.005","8807","4","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","1.L3","","","- C46 H48 Mg N10 O8 -","- C46 H48 Mg N10 O8 -","- C368 H384 Mg8 N80 O64 -","8","0.5","","Sk Asif Ikbal; Sanfaori Brahma; Sankar Prasad Rath","Building-up Remarkably Stable Magnesium Porphyrin Polymers Self-Assembled via Bidentate Axial Ligands: Synthesis, Structure, Surface Morphology, and Effect of Bridging Ligands","Inorganic Chemistry","2012","51","","9666","9676","10.1021/ic300826p","","","0.71069","MoKα","","0.0837","0.0513","","","0.1185","0.139","","","","","","1.03","","","","has coordinates","179406","2020-10-21","18:00:00",""
"4330777","28.611","0.004","28.611","0.004","25.302","0.006","90","","90","","90","","20712","6","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","Fe(II)(TFPPCl8)(1-MeIm)2","","","- C52 H12 Cl8 F20 Fe N8 -","- C52 H12 Cl8 F20 Fe N8 -","- C832 H192 Cl128 F320 Fe16 N128 -","16","1","","Ranjan Patra; Dipankar Sahoo; Soumyajit Dey; Debangsu Sil; Sankar Prasad Rath","Switching Orientation of Two Axial Imidazole Ligands between Parallel and Perpendicular in Low-Spin Fe(III) and Fe(II) Nonplanar Porphyrinates","Inorganic Chemistry","2012","51","","11294","11305","10.1021/ic300229u","","","0.71073","MoKα","","0.167","0.0692","","","0.1386","0.1841","","","","","","1.011","","","","has coordinates","179410","2020-10-21","18:00:00",""
"4331095","39.35","0.008","39.35","0.008","16.83","0.004","90","","90","","90","","26060","10","153","","153","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C164 H288 Cu8 N8 Ni12 O76 -","- C164 H208 Cu8 N8 Ni12 O76 -","- C656 H832 Cu32 N32 Ni48 O304 -","4","0.25","","Takayuki Nakajima; Keiko Seto; Fumihiro Horikawa; Isao Shimizu; Andreas Scheurer; Bunsho Kure; Takashi Kajiwara; Tomoaki Tanase; Masahiro Mikuriya","Wheel-Shaped Icosanuclear Homo- and Heterometallic Complexes of NiII, CoII, and CuII Ions Supported by Unsymmetrical Aminoalcohol Ligands","Inorganic Chemistry","2012","51","","12503","12510","10.1021/ic3019106","","","0.71075","MoKα","","","0.0635","","","","0.1952","","","","","","1.094","","","","has coordinates","179413","2020-10-21","18:00:00",""
"4331582","30.2668","0.0015","30.2668","0.0015","13.6276","0.0007","90","","90","","90","","12484","1.1","141","2","141","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C30 H37 N5 O2 Si2 W -","- C30 H37 N5 O2 Si2 W -","- C480 H592 N80 O32 Si32 W16 -","16","1","","Hayton, Trevor W.; Boncella, James M.; Scott, Brian L.; Abboud, Khalil A.; Mills, Ryan C.","Coupling of an Aldehyde or Ketone to Pyridine Mediated by a Tungsten Imido Complex","Inorganic Chemistry","2005","44","25","9506","9517","10.1021/ic0511367","","","0.71073","mokα","","0.0619","0.0391","","","0.0897","0.1001","","","","","","1.06","","","","has coordinates","179418","2020-10-21","18:00:00",""
"4331765","15.315","0.002","15.315","0.002","39.624","0.007","90","","90","","90","","9294","2","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C56 H48 Mo8 O32 S6 -","- C56 H48 Mo8 O32 S6 -","- C224 H192 Mo32 O128 S24 -","4","0.25","","Byrnes, Matthew J.; Chisholm, Malcolm H.; Patmore, Nathan J.","New Metal−Organic Polygons Involving MM Quadruple Bonds: M8(O2CtBu)4(μ-SC4H2-3,4-{CO2}2)6(M = Mo, W)","Inorganic Chemistry","2005","44","25","9347","9352","10.1021/ic051516s","","","0.71073","MoKα","","0.0684","0.0506","","","0.1444","0.1544","","","","","","1.168","","","","has coordinates,has disorder","179420","2020-10-21","18:00:00",""
"4332323","20.357","0.002","20.357","0.002","14.742","0.002","90","","90","","90","","6109.2","1.2","203","2","203","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C68 H92 Co N4 -","- C68 H92 Co N4 -","- C272 H368 Co4 N16 -","4","0.25","","Chłopek, Krzysztof; Bothe, Eberhard; Neese, Frank; Weyhermüller, Thomas; Wieghardt, Karl","Molecular and Electronic Structures of Tetrahedral Complexes of Nickel and Cobalt ContainingN,N‘-Disubstituted, Bulkyo-Diiminobenzosemiquinonate(1−) π-Radical Ligands","Inorganic Chemistry","2006","45","16","6298","6307","10.1021/ic060242l","","","1.54178","CuKα","","0.0851","0.0769","","","0.1432","0.1467","","","","","","1.243","","","","has coordinates,has disorder","179426","2020-10-21","18:00:00",""
"4332468","14.9585","0.0006","14.9585","0.0006","28.5391","0.0014","90","","90","","90","","6385.8","0.5","293","2","293","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C48 H60 F6 I6 N4 Nd O2 S2 -","- C38 F6 I6 N5 Nd O4 S2 -","- C152 F24 I24 N20 Nd4 O16 S8 -","4","0.25","","Babai, Arash; Mudring, Anja-Verena","Crystal Engineering in Ionic Liquids. The Crystal Structures of [Mppyr]3[NdI6] and [Bmpyr]4[NdI6][Tf2N]","Inorganic Chemistry","2006","45","13","4874","4876","10.1021/ic060414e","","","0.71073","MoKα","","0.0646","0.0439","","","0.1228","0.1312","","","","","","0.953","","","","has coordinates","179427","2020-10-21","18:00:00",""
"4332552","28.2264","0.0006","28.2264","0.0006","21.7921","0.0008","90","","90","","90","","17362.4","0.8","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C292 H519 Cl3 Co N196 O207.5 -","- C389.44 H400.32 Cl4 Co1.32 N261.36 O276.72 -","- C389.44 H400.32 Cl4 Co1.32 N261.36 O276.72 -","1","0.0625","","Mitkina, Tatiana V.; Sokolov, Maxim N.; Naumov, Dmitry Y.; Kuratieva, Natalia V.; Gerasko, Olga A.; Fedin, Vladimir P.","Jørgensen Complex within a Molecular Container: Selective Encapsulation oftrans-[Co(en)2Cl2]+into Cucurbit[8]uril and Influence of Inclusion on Guest's Properties","Inorganic Chemistry","2006","45","17","6950","6955","10.1021/ic060502z","","x-ray","0.71073","MoKα","","0.1168","0.0546","","","0.2104","0.2901","","","","","","1.088","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4332588","40.032","0.01","40.032","0.01","9.257","0.006","90","","90","","90","","14835","11","295","","295","","","","","","","","?","7","I 41/a :2","-I 4ad","88","","","","- C36 H33 B F4 O3 P2 W2 -","- C36 H30 B F4 O3 P2 W2 -","- C576 H480 B16 F64 O48 P32 W32 -","16","1","","Alvarez, M. Angeles; García, M. Esther; Martínez, M. Eugenia; Ramos, Alberto; Ruiz, Miguel A.; Sáez, David; Vaissermann, Jacqueline","M−P versus MM Bonds as Protonation Sites in the Organophosphide-Bridged Complexes [M2Cp2(μ-PR2)(μ-PR‘2)(CO)2], (M = Mo, W; R, R‘ = Ph, Et, Cy)†","Inorganic Chemistry","2006","45","17","6965","6978","10.1021/ic060544n","","","0.71069","MoKα","","","0.0485","","","0.0556","","","","","1.0343","1.0343","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4332739","28.9096","0.0003","28.9096","0.0003","11.1722","0.0003","90","","90","","90","","9337.3","0.3","150","","150","","","","","","","","I. Gass/E. Brechin","5","I 41/a :2","-I 4ad","88","","","","- C96 H80 Fe8 N16 O20 -","- C96 H80 Fe8 N16 O20 -","- C384 H320 Fe32 N64 O80 -","4","0.25","","Gass, Ian A.; Milios, Constantinos J.; Whittaker, A. Gavin; Fabiani, Francesca P. A.; Parsons, Simon; Murrie, Mark; Perlepes, Spyros P.; Brechin, Euan K.","A Cube in a Tetrahedron: Microwave-Assisted Synthesis of an Octametallic FeIIICluster","Inorganic Chemistry","2006","45","14","5281","5283","10.1021/ic0607843","","","0.71073","MoKα","","0.0775","0.0384","","0.0867","0.0734","0.0867","","","","","","0.6355","","","","has coordinates","179430","2020-10-21","18:00:00",""
"4333105","21.2193","0.0016","21.2193","0.0016","18.4841","0.0014","90","","90","","90","","8322.6","1.1","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","3,5-bis(3,4,5-trimethoxyphenyl)pyrazole","","- C21 H24 N2 O6 -","- C21 H24 N2 O6 -","- C336 H384 N32 O96 -","16","1","","Giménez, Raquel; Elduque, Anabel; López, José Antonio; Barberá, Joaquín; Cavero, Emma; Lantero, Ignacio; Oro, Luis A.; Serrano, José Luis","Supramolecular Structures and Columnar Mesophase Induction in Nondiscoid Pyrazoles by Complexation to Rhodium(I)","Inorganic Chemistry","2006","45","25","10363","10370","10.1021/ic0614216","","x-ray","0.71073","MoKα","","0.0585","0.0396","","","0.0874","0.0954","","","","","","1.019","","","","has coordinates","179434","2020-10-21","18:00:00",""
"4333197","22.484","0.005","22.484","0.005","20.323","0.005","90","","90","","90","","10274","4","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C50 H93 Br2 Ni2 P4 -","- C50 H93 Br2 Ni2 P4 -","- C400 H744 Br16 Ni16 P32 -","8","0.5","","Tyree, William S.; Vicic, David A.; Piccoli, Paula M. B.; Schultz, Arthur J.","Structural Factors Influencing Linear M−H−M Bonding in Bis(dialkylphosphino)methane Complexes of Nickel","Inorganic Chemistry","2006","45","22","8853","8855","10.1021/ic0617036","","","0.7107","MoKα","","0.1888","0.1377","","","0.264","0.2944","","","","","","1.253","","","","has coordinates","179434","2020-10-21","18:00:00",""
"4333338","25.9568","0.0002","25.9568","0.0002","37.3385","0.0005","90","","90","","90","","25157","0.4","173","","173","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C61 H50 F12 N6 O2 P2 Ru -","- C61 H50 F12 N6 O2 P2 Ru -","- C976 H800 F192 N96 O32 P32 Ru16 -","16","1","","Bonnet, Sylvestre; Collin, Jean-Paul; Sauvage, Jean-Pierre","Light-Induced Geometrical Changes in Acyclic Ruthenium(II) Complexes and Their Ruthena−Macrocyclic Analogues","Inorganic Chemistry","2007","46","25","10520","10533","10.1021/ic700734q","","","0.71073","Mo-Kα","","0.109","0.065","","0.151","","0.087","","","1.366","","","1.209","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333424","28.1794","0.0014","28.1794","0.0014","17.0456","0.0012","90","","90","","90","","13535.5","1.3","373","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C72.5 H67 Cl2 N O16.5 V4 -","- C72.5 H66.5 Cl2 N O16.5 V4 -","- C580 H532 Cl16 N8 O132 V32 -","8","0.5","","Tidmarsh, Ian S.; Scales, Emma; Brearley, Paul R.; Wolowska, Joanna; Sorace, Lorenzo; Caneschi, Andrea; Laye, Rebecca H.; McInnes, Eric J. L.","Synthesis, structural, and magnetic studies on a redox family of tetrametallic vanadium clusters: {VIV4}, {VIII2VIV2}, and {VIII4} butterfly complexes.","Inorganic chemistry","2007","46","23","9743","9753","10.1021/ic7011183","","","0.71073","MoKα","","0.0569","0.0374","","","0.0991","0.1048","","","","","","0.943","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4333511","25.672","0.004","25.672","0.004","69.62","0.02","90","","90","","90","","45883","17","90","2","90","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C181 H103 N8 Ni2 Tm -","- C171.6 H103 N8 Ni2 Tm -","- C2745.6 H1648 N128 Ni32 Tm16 -","16","1","","Che, Yuliang; Yang, Hua; Wang, Zhimin; Jin, Hongxiao; Liu, Ziyang; Lu, Chunxin; Zuo, Tianming; Dorn, Harry C.; Beavers, Christine M.; Olmstead, Marilyn M.; Balch, Alan L.","Isolation and Structural Characterization of Two Very Large, and Largely Empty, Endohedral Fullerenes: Tm@C3v-C94and Ca@C3v-C94","Inorganic Chemistry","2009","48","13","6004","6010","10.1021/ic900322d","","","0.7749","synchrotron","","0.111","0.0934","","","0.236","0.2539","","","","","","1.035","","","","has coordinates,has disorder","179438","2020-10-21","18:00:00",""
"4333530","38.6769","0.0007","38.6769","0.0007","9.7217","0.0004","90","","90","","90","","14542.7","0.7","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C23 H18 Cl2 N2 Pt -","- C22 H16 N2 Pt -","- C704 H512 N64 Pt32 -","32","2","","D. Paul Rillema; Arvin J. Cruz; Curtis Moore; Khamis Siam; A. Jehan; Derek Base; T. Nguyen; Wei Huang","Electronic and Photophysical Properties of Platinum(II) Biphenyl Complexes Containing 2,2'-Bipyridine and 1,10-Phenanthroline Ligands","Inorganic Chemistry","2013","52","","596","607","10.1021/ic301393e","","","0.71073","MoKα","","0.0852","0.0552","","","0.1204","0.1301","","","","","","1.057","","","","has coordinates","179438","2020-10-21","18:00:00",""
"4333533","26.0902","0.001","26.0902","0.001","20.9852","0.0016","90","","90","","90","","14284.6","1.3","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C36.25 H55.5 Cl0.5 N3 O2 Zn -","- C36.25 H55.5 Cl0.5 N3 O2 Zn -","- C580 H888 Cl8 N48 O32 Zn16 -","16","1","","Mark Franks; Anastasia Gadzhieva; Laura Ghandhi; David Murrell; Alexander J. Blake; E. Stephen Davies; William Lewis; Fabrizio Moro; Jonathan McMaster; Martin Schröder","Five Coordinate M(II)-Diphenolate [M = Zn(II), Ni(II), and Cu(II)] Schiff Base Complexes Exhibiting Metal- and Ligand-Based Redox Chemistry","Inorganic Chemistry","2013","52","","660","670","10.1021/ic301731w","","","0.71073","MoKα","","0.0911","0.0496","","","0.111","0.138","","","","","","1.03","","","","has coordinates,has disorder","179438","2020-10-21","18:00:00",""
"4333537","26.0367","0.0017","26.0367","0.0017","20.857","0.003","90","","90","","90","","14139","2","90","2","90","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C36.25 H56 Cu N3 O2.25 -","- C36 H55 Cu N3 O2 -","- C576 H880 Cu16 N48 O32 -","16","1","","Mark Franks; Anastasia Gadzhieva; Laura Ghandhi; David Murrell; Alexander J. Blake; E. Stephen Davies; William Lewis; Fabrizio Moro; Jonathan McMaster; Martin Schröder","Five Coordinate M(II)-Diphenolate [M = Zn(II), Ni(II), and Cu(II)] Schiff Base Complexes Exhibiting Metal- and Ligand-Based Redox Chemistry","Inorganic Chemistry","2013","52","","660","670","10.1021/ic301731w","","","0.71073","MoKα","","0.0809","0.0582","","","0.1243","0.1334","","","","","","1.034","","","","has coordinates,has disorder","179438","2020-10-21","18:00:00",""
"4333807","13.0625","0.0005","13.0625","0.0005","52.565","0.002","90","","90","","90","","8969.1","0.6","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","CAU-8","","","- C15 H9 Al O6 -","- C15 H9 Al O6 -","- C240 H144 Al16 O96 -","16","1","","Helge Reinsch; Martin Krüger; Jerome Marrot; Norbert Stock","First Keto-Functionalized Microporous Al-Based Metal-Organic Framework: [Al(OH)(O2C-C6H4-CO-C6H4-CO2)]","Inorganic Chemistry","2013","52","","1854","1859","10.1021/ic301961q","","","0.71073","MoKα","","0.1752","0.0791","","","0.1968","0.2299","","","","","","1.017","","","","has coordinates","179441","2020-10-21","18:00:00",""
"4333965","17.6501","0.0004","17.6501","0.0004","15.1012","0.0007","90","","90","","90","","4704.4","0.3","120","","120","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C48 H68 F4 N2 P4 Pd2 -","- C48 H68 F4 N2 P4 Pd2 -","- C192 H272 F16 N8 P16 Pd8 -","4","0.25","","Justin R. Walensky; Claudia M. Fafard; Chengyun Guo; Christina M. Brammell; Bruce M. Foxman; Michael B. Hall; Oleg V. Ozerov","Understanding Pd-Pd Bond Length Variation in (PNP)Pd-Pd(PNP) Dimers","Inorganic Chemistry","2013","52","","2317","2322","10.1021/ic301629m","","","0.71073","MoKα","","0.0161","0.0148","","0.039","0.0386","0.039","","","","","","0.9899","","","","has coordinates","264242","2021-04-16","08:52:18",""
"4334507","18.261","0.003","18.261","0.003","44.911","0.009","90","","90","","90","","14976","5","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C112 H192 N16 O48 Tb8 -","- C112 H192 N16 O48 Tb8 -","- C448 H768 N64 O192 Tb32 -","4","0.25","","Vadapalli Chandrasekhar; Prasenjit Bag; Enrique Colacio","Octanuclear {Ln(III)8} (Ln = Gd, Tb, Dy, Ho) Macrocyclic Complexes in a Cyclooctadiene-like Conformation: Manifestation of Slow Relaxation of Magnetization in the Dy(III) Derivative","Inorganic Chemistry","2013","52","","4562","4570","10.1021/ic400091j","","","0.71073","MoKα","","0.0585","0.0475","","","0.1242","0.1333","","","","","","1.051","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4334508","18.228","0.003","18.228","0.003","44.831","0.009","90","","90","","90","","14896","5","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C116 H200 Dy8 N16 O48 -","- C116 H200 Dy8 N16 O48 -","- C464 H800 Dy32 N64 O192 -","4","0.25","","Vadapalli Chandrasekhar; Prasenjit Bag; Enrique Colacio","Octanuclear {Ln(III)8} (Ln = Gd, Tb, Dy, Ho) Macrocyclic Complexes in a Cyclooctadiene-like Conformation: Manifestation of Slow Relaxation of Magnetization in the Dy(III) Derivative","Inorganic Chemistry","2013","52","","4562","4570","10.1021/ic400091j","","","0.71073","MoKα","","0.082","0.0548","","","0.1439","0.1685","","","","","","1.053","","","","has coordinates","179448","2020-10-21","18:00:00",""
"4334509","18.183","0.003","18.183","0.003","44.626","0.009","90","","90","","90","","14754","5","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C112 H192 Ho8 N16 O48 -","- C112 H192 Ho8 N16 O48 -","- C448 H768 Ho32 N64 O192 -","4","0.25","","Vadapalli Chandrasekhar; Prasenjit Bag; Enrique Colacio","Octanuclear {Ln(III)8} (Ln = Gd, Tb, Dy, Ho) Macrocyclic Complexes in a Cyclooctadiene-like Conformation: Manifestation of Slow Relaxation of Magnetization in the Dy(III) Derivative","Inorganic Chemistry","2013","52","","4562","4570","10.1021/ic400091j","","","0.71073","MoKα","","0.0647","0.0492","","","0.1222","0.1327","","","","","","1.05","","","","has coordinates","179448","2020-10-21","18:00:00",""
"4334662","11.285","0.003","11.285","0.003","23.543","0.01","90","","90","","90","","2998.2","1.7","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C6 H16 Br4 P2 Si -","- C6 H16 Br4 P2 Si -","- C48 H128 Br32 P16 Si8 -","8","0.5","","William Levason; David Pugh; Gillian Reid","Phosphine and Diphosphine Complexes of Silicon(IV) Halides","Inorganic Chemistry","2013","52","","5185","5193","10.1021/ic400077z","","","0.71075","MoKα","","0.0237","0.0196","","","0.0393","0.0402","","","","","","0.993","","","","has coordinates","179449","2020-10-21","18:00:00",""
"4334855","20.2651","0.0005","20.2651","0.0005","43.292","0.0009","90","","90","","90","","17778.9","0.7","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C68 H64 F24 P8 Pt2 S4 -","- C68 H64 F24 P8 Pt2 S4 -","- C544 H512 F192 P64 Pt16 S32 -","8","0.5","","Robert D. Kennedy; Charles W. Machan; C. Michael McGuirk; Mari S. Rosen; Charlotte L. Stern; Amy A. Sarjeant; Chad A. Mirkin","General Strategy for the Synthesis of Rigid Weak-Link Approach Platinum(II) Complexes: Tweezers, Triple-Layer Complexes, and Macrocycles","Inorganic Chemistry","2013","52","","5876","5888","10.1021/ic302855f","","","1.54178","CuKα","","0.1299","0.097","","","0.2577","0.2814","","","","","","1.029","","","","has coordinates,has disorder","179451","2020-10-21","18:00:00",""
"4335158","6.287","0.005","6.287","0.005","12.937","0.005","90","","90","","90","","511.4","0.6","100","2","100","2","","","","","","","","2","I 41/a :2","-I 4ad","88","","","","- F5 K -","- F5 K -","- F20 K4 -","4","0.25","","Maria V. Ivanova; Tobias Köchner; Hélène P. A. Mercier; Gary J. Schrobilgen","Synthesis and Lewis Acid Properties of (ReO3F)∞and the X-ray Crystal Structures of (HF)2ReO3F.HF and [N(CH3)4]2-[{ReO3(μ-F)}3(μ3-O)].CH3CN","Inorganic Chemistry","2013","52","","6806","6819","10.1021/ic302221y","","","0.71073","MoKα","","0.0381","0.0298","","","0.0795","0.0838","","","","","","1.22","","","","has coordinates","179454","2020-10-21","18:00:00",""
"4335498","20.0824","0.0009","20.0824","0.0009","22.9594","0.0012","90","","90","","90","","9259.6","0.8","143","1","143","1","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C44 H20 Ce F30 N3 O2 -","- C44 H20 Ce F30 N3 O2 -","- C352 H160 Ce8 F240 N24 O16 -","8","0.5","","Haolin Yin; Andrew J. Lewis; Patrick Carroll; Eric J. Schelter","Electrophilic Ln(III) Cations Protected by C-F →Ln Interactions and Their Coordination Chemistry with Weak σ- and π-Donors","Inorganic Chemistry","2013","52","","8234","8243","10.1021/ic401130e","","","0.71073","MoKα","","0.0581","0.0299","","","0.0633","0.0675","","","","","","1.015","","","","has coordinates","179457","2020-10-21","18:00:00",""
"4336078","19.1065","0.0004","19.1065","0.0004","10.8977","0.0003","90","","90","","90","","3978.3","0.16","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C28 H32 O4 P4 Se8 Th -","- C28 H32 O4 P4 Se8 Th -","- C112 H128 O16 P16 Se32 Th4 -","4","0.25","","Andrew C. Behrle; Charles L. Barnes; Nikolas Kaltsoyannis; Justin R. Walensky","Systematic Investigation of Thorium(IV)- and Uranium(IV)-Ligand Bonding in Dithiophosphonate, Thioselenophosphinate, and Diselenophosphonate Complexes","Inorganic Chemistry","2013","52","","10623","10631","10.1021/ic401642a","","","1.54178","CuKα","","0.0248","0.0238","","","0.0637","0.0653","","","","","","1.083","","","","has coordinates","179463","2020-10-21","18:00:00",""
"4336150","13.065","0.002","13.065","0.002","32.007","0.005","90","","90","","90","","5463.4","1.5","223","2","223","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H66 As4 Co6 N16 S16 -","- C16 H16 As4 Co6 N16 S16 -","- C64 H64 As16 Co24 N64 S64 -","4","0.25","","Chunying Tang; Fang Wang; Wenqing Jiang; Yong Zhang; Dingxian Jia","Clusters [Co(As3S3)2]2-, [Ni(As3S3)2]2-, and [{Co(en)}6(μ3-S)4(AsS3)4]2- with Co-As or Ni-As Bonds: Solvothermal Syntheses and Characterizations of Thioarsenates Containing Transition-Metal Complexes","Inorganic Chemistry","2013","52","","10860","10868","10.1021/ic4007982","","","0.71073","MoKα","","0.0585","0.0451","","","0.1322","0.1406","","","","","","1.117","","","","has coordinates","179464","2020-10-21","18:00:00",""
"4336469","19.618","0.0012","19.618","0.0012","16.414","0.001","90","","90","","90","","6317.2","0.7","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C7 H18 Cl2 O4 Os S3 -","- C7 H18 Cl2 O4 Os S3 -","- C112 H288 Cl32 O64 Os16 S48 -","16","1","","Ioannis Bratsos; Simone Calmo; Ennio Zangrando; Gabriele Balducci; Enzo Alessio","New Cationic and Neutral Ru(II)- and Os(II)-dmso carbonyl Compounds","Inorganic Chemistry","2013","52","","12120","12130","10.1021/ic401940z","","","1.5418","CuKα","","0.0748","0.0554","","","0.1296","0.1358","","","","","","0.995","","","","has coordinates","179467","2020-10-21","18:00:00",""
"4336474","21.129","0.003","21.129","0.003","36.05","0.007","90","","90","","90","","16094","4","180","","180","","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C44 H46 B Cu F4 N2 O P2 -","- C44 H46 B Cu F4 N2 O P2 -","- C704 H736 B16 Cu16 F64 N32 O16 P32 -","16","1","","Adrien Kaeser; Meera Mohankumar; John Mohanraj; Filippo Monti; Michel Holler; Juan-José Cid; Omar Moudam; Iwona Nierengarten; Lydia Karmazin-Brelot; Carine Duhayon; Béatrice Delavaux-Nicot; Nicola Armaroli; Jean-François Nierengarten","Heteroleptic Copper(I) Complexes Prepared from Phenanthroline and Bis-Phosphine Ligands","Inorganic Chemistry","2013","52","","12140","12151","10.1021/ic4020042","","","0.71073","MoKα","","0.1376","0.0804","","0.1348","0.096","0.096","","","","","","1.096","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4337035","33.6475","0.0004","33.6475","0.0004","17.4253","0.0003","90","","90","","90","","19728.1","0.5","100","0.1","100","0.1","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C108 H96 Cl4 O40 Zr12 -","- C108 H96 Cl4 O40 Zr12 -","- C432 H384 Cl16 O160 Zr48 -","4","0.25","","Guoliang Liu; Zhanfeng Ju; Daqiang Yuan; Maochun Hong","In Situ Construction of a Coordination Zirconocene Tetrahedron","Inorganic Chemistry","2013","52","","13815","13817","10.1021/ic402428m","","","1.54184","CuKα","","0.1019","0.0842","","","0.2341","0.2478","","","","","","1.163","","","","has coordinates","264764","2021-05-03","08:11:06",""
"4337675","21.6694","0.0005","21.6694","0.0005","23.9946","0.0007","90","","90","","90","","11267","0.5","123","","123","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C76 H104 Cl8 N8 O20 V8 -","- C76 H104 Cl8 N8 O20 V8 -","- C304 H416 Cl32 N32 O80 V32 -","4","0.25","","Kodama, Shintaro; Taya, Nobuto; Ishii, Youichi","A Novel Octanuclear Vanadium(V) Oxide Cluster Complex Having an Unprecedented Neutral V8O20 Core Functionalized with 4,4'-Di-tert-butyl-2,2'-bipyridine.","Inorganic chemistry","2014","53","6","2754","2756","10.1021/ic4031393","","","0.71075","MoKα","","","0.048","","","","0.1325","","","","","","1.155","","","","has coordinates","179479","2020-10-21","18:00:00",""
"4337780","17.276","0.002","17.276","0.002","30.908","0.005","90","","90","","90","","9225","2","153","2","153","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C72 H96 Cl4 Co4 N32 O32 -","- C72 H64 Cl4 Co4 N32 O32 -","- C288 H256 Cl16 Co16 N128 O128 -","4","0.25","","Wu, Shu-Qi; Wang, Yi-Tong; Cui, Ai-Li; Kou, Hui-Zhong","Toward Higher Nuclearity: Tetranuclear Cobalt(II) Metallogrid Exhibiting Spin Crossover.","Inorganic chemistry","2014","53","5","2613","2618","10.1021/ic402971a","","","0.71073","MoKα","","0.0807","0.0745","","","0.1818","0.1863","","","","","","1.156","","","","has coordinates","179480","2020-10-21","18:00:00",""
"4337806","18.443","0.0002","18.443","0.0002","22.9755","0.0003","90","","90","","90","","7814.98","0.16","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C14 H20 Au2 N2 S4 -","- C14 H20 Au2 N2 S4 -","- C224 H320 Au32 N32 S64 -","16","1","","Naeem, Saira; Serapian, Stefano A.; Toscani, Anita; White, Andrew J. P.; Hogarth, Graeme; Wilton-Ely, James D E T","Ring-closing metathesis and nanoparticle formation based on diallyldithiocarbamate complexes of gold(i): synthetic, structural, and computational studies.","Inorganic chemistry","2014","53","5","2404","2416","10.1021/ic402048a","","","0.71073","MoKα","","0.0375","0.0242","","","0.0463","0.0494","","","","","","1.079","","","","has coordinates,has disorder","179481","2020-10-21","18:00:00",""
"4338043","32.2442","0.0009","32.2442","0.0009","17.789","0.0007","90","","90","","90","","18495","1","173","","173","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C112 H244 Fe4 Na O S8 Si24 -","- C112 H236 Fe4 Na O S8 Si24 -","- C448 H944 Fe16 Na4 O4 S32 Si96 -","4","0.25","","Tanifuji, Kazuki; Yamada, Norihiro; Tajima, Tomoyuki; Sasamori, Takahiro; Tokitoh, Norihiro; Matsuo, Tsukasa; Tamao, Kohei; Ohki, Yasuhiro; Tatsumi, Kazuyuki","A convenient route to synthetic analogues of the oxidized form of high-potential iron-sulfur proteins.","Inorganic chemistry","2014","53","8","4000","4009","10.1021/ic402890k","","","0.7107","MoKα","","","0.0831","","","","0.2554","","","","","","1.097","","","","has coordinates","179483","2020-10-21","18:00:00",""
"4338523","14.329","0.0012","14.329","0.0012","44.554","0.004","90","","90","","90","","9147.8","1.4","113","2","113","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C36 H28 B2 Cu F8 N12 O2 -","- C36 H28 B2 Cu F8 N12 O2 -","- C288 H224 B16 Cu8 F64 N96 O16 -","8","0.5","","Liu, Ju-Yan; Wang, Qian; Zhang, Li-Jun; Yuan, Bin; Xu, Yao-Yao; Zhang, Xin; Zhao, Cong-Ying; Wang, Dan; Yuan, Yue; Wang, Ying; Ding, Bin; Zhao, Xiao-Jun; Yue, Min Min","Anion-Exchange and Anthracene-Encapsulation within Copper(II) and Manganese(II)-Triazole Metal-Organic Confined Space in a Single Crystal-to-Single Crystal Transformation Fashion.","Inorganic chemistry","2014","53","12","5972","5985","10.1021/ic500183b","","","0.71073","MoKα","","0.0632","0.0564","","","0.1381","0.1428","","","","","","1.084","","","","has coordinates,has disorder","179488","2020-10-21","18:00:00",""
"4338524","14.353","0.002","14.353","0.002","44.533","0.009","90","","90","","90","","9174","3","113","2","113","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C36 H41.13 Cl2 Cu N12 O15.56 -","- C36 H28 Cl2 Cu N12 O15.565 -","- C288 H224 Cl16 Cu8 N96 O124.52 -","8","0.5","","Liu, Ju-Yan; Wang, Qian; Zhang, Li-Jun; Yuan, Bin; Xu, Yao-Yao; Zhang, Xin; Zhao, Cong-Ying; Wang, Dan; Yuan, Yue; Wang, Ying; Ding, Bin; Zhao, Xiao-Jun; Yue, Min Min","Anion-Exchange and Anthracene-Encapsulation within Copper(II) and Manganese(II)-Triazole Metal-Organic Confined Space in a Single Crystal-to-Single Crystal Transformation Fashion.","Inorganic chemistry","2014","53","12","5972","5985","10.1021/ic500183b","","","0.71073","MoKα","","0.0839","0.0816","","","0.2309","0.2337","","","","","","1.125","","","","has coordinates,has disorder","179488","2020-10-21","18:00:00",""
"4338718","22.7959","0.0004","22.7959","0.0004","35.2149","0.0007","90","","90","","90","","18299.5","0.6","108","","108","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C39 H53.5 N9 O14.75 Tb -","- C39 H36 N9 O14.75 Tb -","- C624 H576 N144 O236 Tb16 -","16","1","","Yamauchi, Suguru; Fujinami, Takeshi; Matsumoto, Naohide; Mochida, Naotaka; Ishida, Takayuki; Sunatsuki, Yukinari; Watanabe, Masayuki; Tsuchimoto, Masanobu; Coletti, Cecilia; Re, Nazzareno","Synthesis, Structure, Luminescence, and Magnetic Properties of a Single-Ion Magnet ""mer""-[Tris(N-[(imidazol-4-yl)-methylidene]-dl-phenylalaninato)terbium(III) and Related ""fac""-dl-Alaninato Derivative.","Inorganic chemistry","2014","53","12","5961","5971","10.1021/ic5001599","","","0.71075","MoKα","","","0.0678","","","","0.1908","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339058","20.866","0.003","20.866","0.003","13.156","0.002","90","","90","","90","","5728","1.5","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Bis(1,3-bis(2-methoxy)benzene-triazenide-N,O)-palladium)","","- C28 H28 N6 O4 Pd2 -","- C28 H28 N6 O4 Pd2 -","- C224 H224 N48 O32 Pd16 -","8","0.5","","Nuricumbo-Escobar, Juan José; Campos-Alvarado, Carlos; Ríos-Moreno, Gustavo; Morales-Morales, David; Walsh, Patrick J.; Parra-Hake, Miguel","Binuclear palladium(I) and palladium(II) complexes of ortho-functionalized 1,3-bis(aryl)triazenido ligands.","Inorganic chemistry","2007","46","15","6182","6189","10.1021/ic700516p","","","0.71073","MoKα","","0.054","0.0318","","","0.0445","0.0466","","","","","","1.013","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339479","34.5691","0.0018","34.5691","0.0018","13.4536","0.001","90","","90","","90","","16077.4","1.7","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C42 H38 B Br Co N4 -","- C42 H38 B Br Co N4 -","- C672 H608 B16 Br16 Co16 N64 -","16","1","","Jones, Matthew B.; MacBeth, Cora E.","Tripodal phenylamine-based ligands and their CoII complexes.","Inorganic chemistry","2007","46","20","8117","8119","10.1021/ic701289y","","","0.71073","MoKα","","0.1028","0.06","","","0.1274","0.1457","","","","","","1.022","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339675","23.6564","0.0003","23.6564","0.0003","24.307","0.0007","90","","90","","90","","13602.8","0.5","273","2","273","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C48 H40 Cl4 Cu2 N8 O8 P4 -","- C48 H40 Cl4 Cu2 N8 O9.002 P4 -","- C384 H320 Cl32 Cu16 N64 O72.016 P32 -","8","0.5","","Ainscough, Eric W.; Brodie, Andrew M.; Derwahl, Andreas; Kirk, Steve; Otter, Carl A.","Conformationally rigid chelate rings in metal complexes of pyridyloxy-substituted 2,2'-dioxybiphenyl-cyclotetra- and cyclotriphosphazene platforms.","Inorganic chemistry","2007","46","23","9841","9852","10.1021/ic701241v","","","0.71073","MoKα","","0.0566","0.051","","","0.1608","0.1655","","","","","","1.116","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339920","25.8252","0.0019","25.8252","0.0019","19.463","0.003","90","","90","","90","","12981","2","193","2","193","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C28.75 H37.5 Al Cl5.5 N3 O -","- C28.75 H36 Al Cl5.5 N3 O -","- C460 H576 Al16 Cl88 N48 O16 -","16","1","","Chomitz, Wayne A.; Minasian, Stefan G.; Sutton, Andrew D.; Arnold, John","Synthesis and reactivity of metal complexes supported by the tetradentate monoanionic ligand bis(2-picolyl)(2-hydroxy-3,5-di-tert-butylbenzyl)amide (BPPA).","Inorganic chemistry","2007","46","17","7199","7209","10.1021/ic700775k","","","0.7749","","","0.0862","0.058","","","0.1405","0.1489","","","","","","0.91","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339921","25.908","0.003","25.908","0.003","19.64","0.002","90","","90","","90","","13183","3","155.2","","","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C28.5 H37 Cl5.5 N3 O Ti -","- C28.5 H36 Cl5.5 N3 O Ti -","- C456 H576 Cl88 N48 O16 Ti16 -","16","1","","Chomitz, Wayne A.; Minasian, Stefan G.; Sutton, Andrew D.; Arnold, John","Synthesis and reactivity of metal complexes supported by the tetradentate monoanionic ligand bis(2-picolyl)(2-hydroxy-3,5-di-tert-butylbenzyl)amide (BPPA).","Inorganic chemistry","2007","46","17","7199","7209","10.1021/ic700775k","","","0.7107","MoKα","","0.0694","0.0459","","0.0636","","0.0605","","","","","","2.287","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339922","28.218","0.002","28.218","0.002","15.866","0.0009","90","","90","","90","","12633.4","1.5","157.2","","","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C28 H36 Cl4 N3 O Y -","- C28 H34 Cl4 N3 O Y -","- C448 H544 Cl64 N48 O16 Y16 -","16","1","","Chomitz, Wayne A.; Minasian, Stefan G.; Sutton, Andrew D.; Arnold, John","Synthesis and reactivity of metal complexes supported by the tetradentate monoanionic ligand bis(2-picolyl)(2-hydroxy-3,5-di-tert-butylbenzyl)amide (BPPA).","Inorganic chemistry","2007","46","17","7199","7209","10.1021/ic700775k","","","0.7107","MoKα","","0.0851","0.044","","0.056","","0.0514","","","","","","2.111","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339923","25.573","0.004","25.573","0.004","19.42","0.005","90","","90","","90","","12700","4","453","2","453","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C29 H34 Cl5.1 Ga N3 O -","- C29 H34 Cl5.1 Ga N3 O -","- C464 H544 Cl81.6 Ga16 N48 O16 -","16","1","","Chomitz, Wayne A.; Minasian, Stefan G.; Sutton, Andrew D.; Arnold, John","Synthesis and reactivity of metal complexes supported by the tetradentate monoanionic ligand bis(2-picolyl)(2-hydroxy-3,5-di-tert-butylbenzyl)amide (BPPA).","Inorganic chemistry","2007","46","17","7199","7209","10.1021/ic700775k","","","0.71073","MoKα","","0.162","0.0862","","","0.2407","0.2528","","","","","","1.01","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4340049","45.3648","0.0006","45.3648","0.0006","12.0304","0.0009","90","","90","","90","","24758.1","1.9","85","2","85","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Eu(III)[15-MC Zn(II),picHA-5](NO3)3(py)4","","- C50 H44 Eu N17 O21 Zn5 -","- C50 H40 Eu N17 O20.99 Zn5 -","- C800 H640 Eu16 N272 O335.84 Zn80 -","16","1","","Jankolovits, Joseph; Kampf, Jeff W.; Pecoraro, Vincent L.","Solvent dependent assembly of lanthanide metallacrowns using building blocks with incompatible symmetry preferences.","Inorganic chemistry","2014","53","14","7534","7546","10.1021/ic500832u","","","1.54178","CuKα","","0.0607","0.056","","","0.1608","0.1648","","","","","","1.084","","","","has coordinates,has disorder","179503","2020-10-21","18:00:00",""
"4341236","18.0482","0.0013","18.0482","0.0013","12.2439","0.0009","90","","90","","90","","3988.3","0.5","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C40 H36 Co F20 N -","- C40 H36 Co F20 N -","- C160 H144 Co4 F80 N4 -","4","0.25","","García-Monforte, M. Angeles; Ara, Irene; Martín, Antonio; Menjón, Babil; Tomás, Milagros; Alonso, Pablo J.; Arauzo, Ana B.; Martínez, Jesús I.; Rillo, Conrado","Homoleptic Organocobalt(III) Compounds with Intermediate Spin","Inorganic Chemistry","2014","","","141006123300006","","10.1021/ic501719y","","","0.71073","MoKα","","0.0328","0.0272","","","0.0675","0.0693","","","","","","1.03","","","","has coordinates","179515","2020-10-21","18:00:00",""
"4341349","25.5583","0.0011","25.5583","0.0011","15.3021","0.0007","90","","90","","90","","9995.7","0.8","100","2","100","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C23 H33 Cl2 N3 O S Zn -","- C23 H33 Cl2 N3 O S Zn -","- C368 H528 Cl32 N48 O16 S16 Zn16 -","16","1","","Sharma, Anuj K.; Kim, Jaekwang; Prior, John T.; Hawco, Nicholas J.; Rath, Nigam P.; Kim, Jungsu; Mirica, Liviu M.","Small Bifunctional Chelators That Do Not Disaggregate Amyloid β Fibrils Exhibit Reduced Cellular Toxicity.","Inorganic chemistry","2014","53","21","11367","11376","10.1021/ic500926c","","","0.71073","MoKα","","0.0305","0.023","","","0.0553","0.0594","","","","","","1.056","","","","has coordinates","179516","2020-10-21","18:00:00",""
"4341551","19.8588","0.0003","19.8588","0.0003","40.44","0.0012","90","","90","","90","","15948.4","0.6","240","2","240","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C66 H106 N6 Ni3 O24 -","- C66 H106 N6 Ni3 O24 -","- C528 H848 N48 Ni24 O192 -","8","0.5","","Ovcharenko, Victor; Kuznetsova, Olga; Fursova, Elena; Romanenko, Galina; Polushkin, Alexey; Sagdeev, Renad","Redox-induced change in the ligand coordination mode.","Inorganic chemistry","2014","53","19","10033","10035","10.1021/ic501787m","","","0.71073","MoKα","","0.0623","0.0383","","","0.1058","0.116","","","","","","0.966","","","","has coordinates","179518","2020-10-21","18:00:00",""
"4341907","31.5696","0.001","31.5696","0.001","12.3207","0.0008","90","","90","","90","","12279.3","1","291","2","291","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C72 H48 F8 Ir2 N8 O -","- C72 H48 F8 Ir2 N8 O -","- C576 H384 F64 Ir16 N64 O8 -","8","0.5","","Li, Tian-Yi; Liang, Xiao; Zhou, Liang; Wu, Chen; Zhang, Song; Liu, Xuan; Lu, Guang-Zhao; Xue, Li-Sha; Zheng, You-Xuan; Zuo, Jing-Lin","N-Heterocyclic Carbenes: Versatile Second Cyclometalated Ligands for Neutral Iridium(III) Heteroleptic Complexes.","Inorganic chemistry","2015","54","1","161","173","10.1021/ic501949h","","","0.71073","MoKα","","0.0397","0.0384","","","0.0946","0.0955","","","","","","1.003","","","","has coordinates,has disorder","179522","2020-10-21","18:00:00",""
"4341914","31.7027","0.0008","31.7027","0.0008","12.3108","0.0006","90","","90","","90","","12373.1","0.7","291","2","291","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C36 H24 F5 Ir N4 O -","- C36 H24 F5 Ir N4 O -","- C576 H384 F80 Ir16 N64 O16 -","16","1","","Li, Tian-Yi; Liang, Xiao; Zhou, Liang; Wu, Chen; Zhang, Song; Liu, Xuan; Lu, Guang-Zhao; Xue, Li-Sha; Zheng, You-Xuan; Zuo, Jing-Lin","N-Heterocyclic Carbenes: Versatile Second Cyclometalated Ligands for Neutral Iridium(III) Heteroleptic Complexes.","Inorganic chemistry","2015","54","1","161","173","10.1021/ic501949h","","","0.71073","MoKα","","0.0427","0.0419","","","0.1015","0.1016","","","","","","1.057","","","","has coordinates","179522","2020-10-21","18:00:00",""
"4341948","9.7606","0.0002","9.7606","0.0002","18.4399","0.0008","90","","90","","90","","1756.76","0.09","120","2","120","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Ag20 Ge40 Li50.55 -","- Ag20 Ge40 Li50.56 -","- Ag20 Ge40 Li50.56 -","1","0.0625","","Henze, Alexander; Hlukhyy, Viktor; Fässler, Thomas F","Fully and Partially Li-Stuffed Diamond Polytypes with Ag-Ge Structures: Li2AgGe and Li2.53AgGe2.","Inorganic chemistry","2015","54","3","1152","1158","10.1021/ic5025263","","","0.71073","MoKα","","0.0504","0.0403","","","0.0802","0.0818","","","","","","1.427","","","","has coordinates","179522","2020-10-21","18:00:00",""
"4342703","13.8532","0.0001","13.8532","0.0001","37.6585","0.0004","90","","90","","90","","7227.09","0.11","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C40 H32 F6 N8 P Ru -","- C40 H32 F6 N8 P Ru -","- C320 H256 F48 N64 P8 Ru8 -","8","0.5","","Das, Ankita; Ghosh, Prabir; Plebst, Sebastian; Schwederski, Brigitte; Mobin, Shaikh M.; Kaim, Wolfgang; Lahiri, Goutam Kumar","Ancillary Ligand Control of Electronic Structure in o-Benzoquinonediimine-Ruthenium Complex Redox Series: Structures, Electron Paramagnetic Resonance (EPR), and Ultraviolet-Visible-Near-Infrared (UV-vis-NIR) Spectroelectrochemistry.","Inorganic chemistry","2015","54","7","3376","3386","10.1021/ic503070j","","","1.54184","CuKα","","0.0491","0.0482","","","0.1372","0.1381","","","","","","1.066","","","","has coordinates","179530","2020-10-21","18:00:00",""
"4343110","43.3289","0.0007","43.3289","0.0007","15.9207","0.0002","90","","90","","90","","29889.4","0.8","160","2","160","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C244 H315.6 N12 Ni20 O79.8 -","- C244 H220 N12 Ni20 O79.8 -","- C976 H880 N48 Ni80 O319.2 -","4","0.25","","Alexopoulou, Konstantina I.; Terzis, Aris; Raptopoulou, Catherine P.; Psycharis, Vassilis; Escuer, Albert; Perlepes, Spyros P.","Ni(II)20 ""Bowls"" from the Use of Tridentate Schiff Bases.","Inorganic chemistry","2015","54","12","5615","5617","10.1021/acs.inorgchem.5b00521","","","1.54178","CuKα","","0.0771","0.0653","","","0.1854","0.1966","","","","","","1.023","","","","has coordinates,has disorder","176429","2020-10-21","18:00:00",""
"4343794","9.816","","9.816","","20.341","","90","","90","","90","","1959.93","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Te (O Te F5)4 F2","","- F22 O4 Te5 -","- F22 O4 Te5 -","- F88 O16 Te20 -","4","0.25","","Pritzkow, H.; Seppelt, K.","Crystal and molecular structure of Te5 O4 F22 : trans-F2 Te (O Te F5)4","Inorganic Chemistry","1977","16","","2685","2687","","","","","","","","","","","","","","","","","","","","","","has coordinates","149777","2020-10-21","18:00:00",""
"4344179","5.1335","","5.1335","","10.588","","90","","90","","90","","279.024","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Li Yb F4","","- F4 Li Yb -","- F4 Li Yb -","- F16 Li4 Yb4 -","4","0.25","","Thoma, R.E.; Keenan, T.K.; Brunton, G.D.; Penneman, R.A.","Equilibrium Relations and Crystal Structure of Lithium Fluorolanthanate Phases","Inorganic Chemistry","1970","9","","1096","1101","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344812","20.4062","0.0017","20.4062","0.0017","15.3975","0.0012","90","","90","","90","","6411.7","0.9","298","2","298","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H48 Cd5 Cl10 N48 O16 -","- C16 H48 Cd5 Cl10 N48 O16 -","- C64 H192 Cd20 Cl40 N192 O64 -","4","0.25","","Xu, Caixia; Zhang, Jianguo; Yin, Xin; Cheng, Zhenxuan","Structural Diversity and Properties of M(II) Coordination Compounds Constructed by 3-Hydrazino-4-amino-1,2,4-triazole Dihydrochloride as Starting Material.","Inorganic chemistry","2015","55","1","322","","10.1021/acs.inorgchem.5b02434","","","0.71073","MoKα","","0.0917","0.0465","","","0.1067","0.1333","","","","","","1.025","","","","has coordinates,has disorder","175647","2020-10-21","18:00:00",""
"4345285","10.9718","0.0002","10.9718","0.0002","35.1588","0.0019","90","","90","","90","","4232.4","0.3","296.65","0.11","296.65","0.11","","","","","","","","6","I 41/a :2","-I 4ad","88","","T2@MV-1","","- C24 H40 Ge4 N4 O6 S10 -","- C24 H40 Ge4 N4 O6 S10 -","- C96 H160 Ge16 N16 O24 S40 -","4","0.25","","Lin, Jian; Fu, Zhixing; Zhang, Jiaxu; Zhu, Yujia; Hu, Dandan; Li, Dongsheng; Wu, Tao","Substituent-Modulated Assembly Formation: An Approach to Enhancing the Photostability of Photoelectric-Sensitive Chalcogenide-Based Ion-Pair Hybrids.","Inorganic chemistry","2017","56","6","3119","3122","10.1021/acs.inorgchem.6b03061","","","0.71073","MoKα","","0.0313","0.0261","","","0.0669","0.069","","","","","","1.073","","","","has coordinates","194823","2020-10-21","18:00:00",""
"4345996","20.0352","0.0019","20.0352","0.0019","13.988","0.003","90","","90","","90","","5614.9","1.4","203","1","141","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C56 H52 N4 S8 U2 -","- C56 H52 N4 S8 U2 -","- C224 H208 N16 S32 U8 -","4","0.25","","Andrew J. Gaunt; Brian L. Scott; Mary P. Neu","U(IV) Chalcogenolates Synthesized via Oxidation of Uranium Metal by Dichalcogenides","Inorganic Chemistry","2006","45","","7401","7407","10.1021/ic060560k","","","0.71073","MoKα","","0.0548","0.0394","","","0.1365","0.1502","","","","","","1.803","","","","has coordinates","231085","2020-10-21","18:00:00",""
"4345997","20.203","0.003","20.203","0.003","13.99","0.004","90","","90","","90","","5710","2","141","2","141","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C56 H52 N4 Se8 U2 -","- C56 H52 N4 Se8 U2 -","- C224 H208 N16 Se32 U8 -","4","0.25","","Andrew J. Gaunt; Brian L. Scott; Mary P. Neu","U(IV) Chalcogenolates Synthesized via Oxidation of Uranium Metal by Dichalcogenides","Inorganic Chemistry","2006","45","","7401","7407","10.1021/ic060560k","","","0.71073","MoKα","","0.0958","0.0415","","","0.0821","0.0989","","","","","","0.956","","","","has coordinates","231085","2020-10-21","18:00:00",""
"4346278","18.7948","0.0004","18.7948","0.0004","19.6996","0.0004","90","","90","","90","","6958.8","0.3","100","","100","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H10 Cu I2 N O4 -","- C16 H10 Cu I2 N O4 -","- C256 H160 Cu16 I32 N16 O64 -","16","1","","Takahashi, Kiyonori; Hoshino, Norihisa; Takeda, Takashi; Noro, Shin-Ichiro; Nakamura, Takayoshi; Takeda, Sadamu; Akutagawa, Tomoyuki","Structural flexibilities and gas adsorption properties of one-dimensional copper(II) polymers with paddle-wheel units by modification of benzoate ligands.","Inorganic chemistry","2015","54","19","9423","9431","10.1021/acs.inorgchem.5b01168","","","1.54187","CuKα","","","0.0683","","","","0.1756","","","","","","1.188","","","","has coordinates","231705","2020-10-21","18:00:00",""
"4346323","43.5493","0.0011","43.5493","0.0011","16.3262","0.0007","90","","90","","90","","30963.3","1.7","150","2","150","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C120 H152 Cl8 N6 O38 P8 Zn8 -","- C120 H152 Cl8 N6 O38 P8 Zn8 -","- C960 H1216 Cl64 N48 O304 P64 Zn64 -","8","0.5","","Dar, Aijaz A.; Sen, Saumik; Gupta, Sandeep K.; Patwari, G. Naresh; Murugavel, Ramaswamy","Octanuclear zinc phosphates with hitherto unknown cluster architectures: ancillary ligand and solvent assisted structural transformations thereof.","Inorganic chemistry","2015","54","19","9458","9469","10.1021/acs.inorgchem.5b01308","","","0.71075","MoKα","","0.0787","0.0665","","","0.169","0.18","","","","","","1.036","","","","has coordinates","231728","2020-10-21","18:00:00",""
"4346324","43.962","0.002","43.962","0.002","16.4549","0.001","90","","90","","90","","31802","3","150","2","150","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C120 H158 Br8 N6 O38 P8 Zn8 -","- C120 H158 Br8 N6 O38 P8 Zn8 -","- C960 H1264 Br64 N48 O304 P64 Zn64 -","8","0.5","","Dar, Aijaz A.; Sen, Saumik; Gupta, Sandeep K.; Patwari, G. Naresh; Murugavel, Ramaswamy","Octanuclear zinc phosphates with hitherto unknown cluster architectures: ancillary ligand and solvent assisted structural transformations thereof.","Inorganic chemistry","2015","54","19","9458","9469","10.1021/acs.inorgchem.5b01308","","","0.71075","MoKα","","0.1192","0.1143","","","0.2276","0.2305","","","","","","1.219","","","","has coordinates","231728","2020-10-21","18:00:00",""
"4346502","17.583","0.005","17.583","0.005","29.716","0.005","90","0.005","90","0.005","90","0.005","9187","4","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","transoid_DyCu2","[{(Cu(salpn))Me(CO)Me}2Dy(NO3)3]","","- C40 H44 Cu2 Dy N7 O15 -","- C40 H44 Cu2 Dy N7 O15 -","- C320 H352 Cu16 Dy8 N56 O120 -","8","0.5","","Ida, Yumi; Ghosh, Soumavo; Ghosh, Ashutosh; Nojiri, Hiroyuki; Ishida, Takayuki","Strong ferromagnetic exchange interactions in hinge-like Dy(O2Cu)2 complexes involving double oxygen bridges.","Inorganic chemistry","2015","54","19","9543","9555","10.1021/acs.inorgchem.5b01583","","","0.71073","MoKα","","0.0438","0.0347","","","0.0824","0.089","","","","","","1.058","","","","has coordinates,has disorder","231814","2020-10-21","18:00:00",""
"4347162","17.542","0.004","17.542","0.003","23.549","0.003","90","","90","","90","","7247","2","200","2","200","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C36 H56 Cl4 N8 S4 Ta4 -","- C36 H56 Cl4 N8 S4 Ta4 -","- C144 H224 Cl16 N32 S16 Ta16 -","4","0.25","","Gómez, Manuel; Hernández-Prieto, Cristina; Martín, Avelino; Mena, Miguel; Santamaría, Cristina","Systematic Approach for the Construction of Niobium and Tantalum Sulfide Clusters.","Inorganic chemistry","2016","55","8","3815","3821","10.1021/acs.inorgchem.5b02816","","x-ray","0.71073","MoKα","","0.0818","0.0458","","","0.0965","0.1306","","","","","","1.167","","","","has coordinates","232195","2020-10-21","18:00:00",""
"4347657","14.0845","0.00019","14.0845","0.00019","44.2036","0.001","90","","90","","90","","8768.8","0.3","173","0.1","173","0.1","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C36 H44 Cu N14 O16 -","- C36 H44 Cu N14 O16 -","- C288 H352 Cu8 N112 O128 -","8","0.5","","Wang, Ying; Meng, Shan-Shan; Lin, Peng-Xiang; Xiao, Yi-Wei; Ma, Qing-Qing; Xie, Qiong; Chen, Yuan-Yuan; Zhao, Xiao-Jun; Chen, Jun","Solvent-Induced Single Crystal-Single Crystal Transformation of an Interpenetrated Three-Dimensional Copper Triazole Catalytic Framework.","Inorganic chemistry","2016","55","9","4069","4071","10.1021/acs.inorgchem.6b00433","","x-ray","1.54184","CuKα","","0.0438","0.041","","","0.1066","0.1089","","","","","","1.046","","","","has coordinates","232423","2020-10-21","18:00:00",""
"4347709","15.5591","0.0003","15.5591","0.0003","13.8922","0.0005","90","","90","","90","","3363.1","0.15","15","2","15","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C24 H56 Co N2 P4 S4 -","- C24 H40 Co N2 P4 S4 -","- C96 H160 Co4 N8 P16 S16 -","4","0.25","","Sottini, Silvia; Poneti, Giordano; Ciattini, Samuele; Levesanos, Nikolaos; Ferentinos, Eleftherios; Krzystek, J.; Sorace, Lorenzo; Kyritsis, Panayotis","Magnetic Anisotropy of Tetrahedral Co<sup>II</sup> Single-Ion Magnets: Solid-State Effects.","Inorganic chemistry","2016","55","19","9537","9548","10.1021/acs.inorgchem.6b00508","","","0.71069","MoKα","","0.0662","0.0477","","","","0.1268","","","","","","1.06","","","","has coordinates,has disorder","232457","2020-10-21","18:00:00",""
"4347711","15.5878","0.0003","15.5878","0.0003","14.0473","0.0005","90","","90","","90","","3413.21","0.15","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C24 H56 Co N2 P4 S4 -","- C24 H40 Co N2 P4 S4 -","- C96 H160 Co4 N8 P16 S16 -","4","0.25","","Sottini, Silvia; Poneti, Giordano; Ciattini, Samuele; Levesanos, Nikolaos; Ferentinos, Eleftherios; Krzystek, J.; Sorace, Lorenzo; Kyritsis, Panayotis","Magnetic Anisotropy of Tetrahedral Co<sup>II</sup> Single-Ion Magnets: Solid-State Effects.","Inorganic chemistry","2016","55","19","9537","9548","10.1021/acs.inorgchem.6b00508","","","0.71073","MoKα","","0.0673","0.054","","","","0.1507","","","","","","1.045","","","","has coordinates,has disorder","232459","2020-10-21","18:00:00",""
"4347728","23.205","0.003","23.205","0.003","34.382","0.005","90","","90","","90","","18514","4","296","2","296","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C92 H104 Cl2 Cu5 Dy4 N36 O36 S8 -","- C92 H68 Cl2 Cu5 Dy4 N36 O36 S8 -","- C368 H272 Cl8 Cu20 Dy16 N144 O144 S32 -","4","0.25","","Wu, Jianfeng; Zhao, Lang; Zhang, Li; Li, Xiao-Lei; Guo, Mei; Tang, Jinkui","Metallosupramolecular Coordination Complexes: The Design of Heterometallic 3d-4f Gridlike Structures.","Inorganic chemistry","2016","55","11","5514","5519","10.1021/acs.inorgchem.6b00529","","","0.71073","MoKα","","0.0984","0.0703","","","0.2124","0.2431","","","","","","1.113","","","","has coordinates","232471","2020-10-21","18:00:00",""
"4347729","24.0282","0.0016","24.0282","0.0016","34.364","0.002","90","","90","","90","","19840","2","273","2","273","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C88 H92 Dy4 N32 O32 S4 Zn4 -","- C88 H92 Dy4 N32 O32 S4 Zn4 -","- C352 H368 Dy16 N128 O128 S16 Zn16 -","4","0.25","","Wu, Jianfeng; Zhao, Lang; Zhang, Li; Li, Xiao-Lei; Guo, Mei; Tang, Jinkui","Metallosupramolecular Coordination Complexes: The Design of Heterometallic 3d-4f Gridlike Structures.","Inorganic chemistry","2016","55","11","5514","5519","10.1021/acs.inorgchem.6b00529","","","0.71073","MoKα","","0.1412","0.0911","","","0.2816","0.3122","","","","","","1.078","","","","has coordinates","232471","2020-10-21","18:00:00",""
"4347836","17.6001","0.0006","17.6001","0.0006","33.3526","0.0013","90","","90","","90","","10331.4","0.6","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C18 H35 Cl4 N4 Ta -","- C18 H35 Cl4 N4 Ta -","- C288 H560 Cl64 N64 Ta16 -","16","1","","Rahman, Md Mamdudur; Smith, Mark D.; Peryshkov, Dmitry V.","Formation of a Cationic Vinylimido Group upon C-H Activation of Nitriles by Trialkylamines in the Presence of TaCl5.","Inorganic chemistry","2016","55","11","5101","5103","10.1021/acs.inorgchem.6b00677","","x-ray","0.71073","MoKα","","0.0322","0.0205","","","0.0421","0.0454","","","","","","1.036","","","","has coordinates,has disorder","232533","2020-10-21","18:00:00",""
"4348016","36.913","0.01","36.913","0.01","15.452","0.004","90","","90","","90","","21054","10","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C58 H36 F15 Ir N6 -","- C58 H36 F15 Ir N6 -","- C928 H576 F240 Ir16 N96 -","16","1","","Maurya, Yogesh Kumar; Ishikawa, Takahiro; Kawabe, Yasunori; Ishida, Masatoshi; Toganoh, Motoki; Mori, Shigeki; Yasutake, Yuhsuke; Fukatsu, Susumu; Furuta, Hiroyuki","Near-Infrared Phosphorescent Iridium(III) Benzonorrole Complexes Possessing Pyridine-based Axial Ligands.","Inorganic chemistry","2016","55","12","6223","6230","10.1021/acs.inorgchem.6b00853","","","0.71075","MoKα","","0.0775","0.074","","","0.1524","0.154","","","","","","1.219","","","","has coordinates","232643","2020-10-21","18:00:00",""
"4348380","15.1973","0.0005","15.1973","0.0005","22.1529","0.0008","90","","90","","90","","5116.4","0.3","100","2","100","2","","","","","","","synthesis as described","5","I 41/a :2","-I 4ad","88","","poly-[(mu3-adeninato-k3-N3:N7:N9)(mu-butanoato-k2-O,O')nickel(II)]","","- C18 H22 N10 Ni2 O4 -","- C18 H22 N10 Ni2 O4 -","- C144 H176 N80 Ni16 O32 -","8","0.5","","Lanchas, Mónica; Arcediano, Sandra; Beobide, Garikoitz; Castillo, Oscar; Luque, Antonio; Pérez-Yáñez, Sonia","Towards multicomponent MOFs via solvent-free synthesis under conventional oven and microwave assisted heating","Inorganic Chemistry Frontiers","2015","2","5","425","","10.1039/C4QI00208C","","","1.54184","CuKα","","0.1204","0.1155","","","0.2708","0.274","","","","","","1.064","","","","has coordinates","232895","2020-10-21","18:00:00",""
"4348400","29.809","0.004","29.809","0.004","8.4384","0.0015","90","","90","","90","","7498.2","1.9","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C17 H24 Cu1.5 N O9.25 -","- C17 H24 Cu1.5 N O9.25 -","- C272 H384 Cu24 N16 O148 -","16","1","","Dias, Sara S. P.; Kirillova, Marina V.; André, Vânia; Kłak, Julia; Kirillov, Alexander M.","New tricopper(ii) cores self-assembled from aminoalcohol biobuffers and homophthalic acid: synthesis, structural and topological features, magnetic properties and mild catalytic oxidation of cyclic and linear C5‒C8 alkanes","Inorganic Chemistry Frontiers","2015","2","6","525","","10.1039/C4QI00220B","","","0.71069","MoKα","","0.132","0.0735","","","0.1707","0.1994","","","","","","1.014","","","","has coordinates","232900","2020-10-21","18:00:00",""
"4348555","25.1335","0.0002","25.1335","0.0002","9.74539","0.00012","90","","90","","90","","6156.09","0.1","292.7","0.18","292.7","0.18","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C11 H16 In N2 O10 -","- C11 H16 In N2 O10 -","- C176 H256 In16 N32 O160 -","16","1","","Guo, Furong; Chen, Cheng; Wang, Kangcai; Zhang, Qinghua; Lin, Zhien","Supramolecular Templating Approach for the Solvent-Free Synthesis of Open-Framework Metal Oxalates.","Inorganic chemistry","2016","55","16","7817","7819","10.1021/acs.inorgchem.6b01341","","x-ray","1.54184","CuKα","","0.0432","0.0409","","","0.103","0.1056","","","","","","1.066","","","","has coordinates","233083","2020-10-21","18:00:00",""
"4348556","26.0767","0.0006","26.0767","0.0006","8.9467","0.0003","90","","90","","90","","6083.7","0.3","293.55","0.1","293.55","0.1","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C9 H16 In N2 O10 S -","- C9 H16 In N2 O10 S -","- C144 H256 In16 N32 O160 S16 -","16","1","","Guo, Furong; Chen, Cheng; Wang, Kangcai; Zhang, Qinghua; Lin, Zhien","Supramolecular Templating Approach for the Solvent-Free Synthesis of Open-Framework Metal Oxalates.","Inorganic chemistry","2016","55","16","7817","7819","10.1021/acs.inorgchem.6b01341","","x-ray","0.71073","MoKα","","0.0325","0.0266","","","0.064","0.0684","","","","","","1.033","","","","has coordinates","233085","2020-10-21","18:00:00",""
"4348589","24.268","0.003","24.268","0.003","15.248","0.002","90","","90","","90","","8980","2","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C76 H100 Co4 N4 O24 -","- C76 H100 Co4 N4 O24 -","- C304 H400 Co16 N16 O96 -","4","0.25","","Modak, Ritwik; Sikdar, Yeasin; Thuijs, Annaliese E.; Christou, George; Goswami, Sanchita","Co<sup>II</sup><sub>4</sub>, Co<sup>II</sup><sub>7</sub>, and a Series of Co<sup>II</sup><sub>2</sub>Ln<sup>III</sup> (Ln<sup>III</sup> = Nd<sup>III</sup>, Sm<sup>III</sup>, Gd<sup>III</sup>, Tb<sup>III</sup>, Dy<sup>III</sup>) Coordination Clusters: Search for Single Molecule Magnets.","Inorganic chemistry","2016","55","20","10192","10202","10.1021/acs.inorgchem.6b01402","","","0.71073","MoKα","","0.1195","0.0761","","","0.2482","0.2894","","","","","","1.095","","","","has coordinates","233146","2020-10-21","18:00:00",""
"4348741","39.188","0.003","39.188","0.003","12.8242","0.0011","90","","90","","90","","19694","3","100","2","100","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C43 H38 Cl10 Ir N O2 P2 -","- C42 H37 Cl7 Ir N O2 P2 -","- C672 H592 Cl112 Ir16 N16 O32 P32 -","16","1","","Zumeta, Itziar; Mendicute-Fierro, Claudio; Bustos, Itxaso; Huertos, Miguel A.; Rodríguez-Diéguez, Antonio; Seco, José M; San Sebastian, Eider; Garralda, María A","Irida-β-ketoimines Derived from Hydrazines To Afford Metallapyrazoles or N-N Bond Cleavage: A Missing Metallacycle Disclosed by a Theoretical and Experimental Study.","Inorganic chemistry","2016","55","20","10284","10293","10.1021/acs.inorgchem.6b01550","","","0.71073","MoKα","","0.0448","0.0355","","","0.0786","0.082","","","","","","1.054","","","","has coordinates","233304","2020-10-21","18:00:00",""
"4349537","6.9113","0.001","6.9113","0.001","28.4262","0.0014","90","","90","","90","","1357.8","0.3","173","0.2","173","0.2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C14 H6 Co K N2 O8 -","- C14 H6 Co K N2 O8 -","- C56 H24 Co4 K4 N8 O32 -","4","0.25","","Kim, Saet Byeol; Kim, Jeung Yoon; Jeong, Nak Cheon; Ok, Kang Min","Anisotropic Li+ ion conductivity in a large single crystal of a Co(iii) coordination complex","Inorganic Chemistry Frontiers","2017","4","1","79","","10.1039/C6QI00314A","","x-ray","0.71073","MoKα","","0.0659","0.0397","","","0.1023","0.1115","","","","","","0.99","","","","has coordinates","234864","2020-10-21","18:00:00",""
"4349538","7.026","0.001","7.026","0.001","27.891","0.003","90","","90","","90","","1376.8","0.3","173","0.2","173","0.2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C14 H8 Co N2 O9 -","- C14 H8 Co N2 O9 -","- C56 H32 Co4 N8 O36 -","4","0.25","","Kim, Saet Byeol; Kim, Jeung Yoon; Jeong, Nak Cheon; Ok, Kang Min","Anisotropic Li+ ion conductivity in a large single crystal of a Co(iii) coordination complex","Inorganic Chemistry Frontiers","2017","4","1","79","","10.1039/C6QI00314A","","x-ray","0.71073","MoKα","","0.029","0.0262","","","0.0706","0.0717","","","","","","1.088","","","","has coordinates","234864","2020-10-21","18:00:00",""
"4349555","26.541","0.004","26.541","0.004","34.867","0.005","90","","90","","90","","24561","6","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C54 H34 F8 Fe N10 -","- C54 H34 F8 Fe N10 -","- C432 H272 F64 Fe8 N80 -","8","0.5","","Zhang, Li; Hou, Lei; Zhao, Xin; Zhang, Zengqi; Wang, Yongsong; Li, Jun","Three metalloporphyrin frameworks containing imidazole groups: synthesis, characterization and properties","Inorganic Chemistry Frontiers","2017","4","2","360","","10.1039/C6QI00381H","","","0.71073","MoKα","","0.1199","0.0772","","","0.1448","0.1847","","","","","","0.848","","","","has coordinates","234878","2020-10-21","18:00:00",""
"4349574","17.4289","0.0004","17.4289","0.0004","37.4287","0.0013","90","","90","","90","","11369.6","0.5","100.01","0.15","100.01","0.15","","","","","","","no","6","I 41/a :2","-I 4ad","88","8-1","8-1","","- C35 H31 B Fe0.5 N3 O2 -","- C35 H31 B Fe0.5 N3 O2 -","- C560 H496 B16 Fe8 N48 O32 -","16","1","","Zhu, Yuan-Yuan; Li, Hong-Qing; Ding, Zhong-Yu; Lü, Xiao-Jin; Zhao, Liang; Meng, Yin-Shan; Liu, Tao; Gao, Song","Spin transitions in a series of [Fe(pybox)2]2+ complexes modulated by ligand structures, counter anions, and solvents","Inorganic Chemistry Frontiers","2016","3","12","1624","","10.1039/C6QI00417B","","","0.71073","MoKα","","0.0708","0.0437","","","0.0961","0.1124","","","","","","1.027","","","","has coordinates","234891","2020-10-21","18:00:00",""
"4349575","17.51122","0.00011","17.51122","0.00011","37.5872","0.0004","90","","90","","90","","11525.8","0.16","180.01","0.1","180.01","0.1","","","","","","","no","6","I 41/a :2","-I 4ad","88","8-2","8-2","","- C35 H31 B Fe0.5 N3 O2 -","- C35 H31 B Fe0.5 N3 O2 -","- C560 H496 B16 Fe8 N48 O32 -","16","1","","Zhu, Yuan-Yuan; Li, Hong-Qing; Ding, Zhong-Yu; Lü, Xiao-Jin; Zhao, Liang; Meng, Yin-Shan; Liu, Tao; Gao, Song","Spin transitions in a series of [Fe(pybox)2]2+ complexes modulated by ligand structures, counter anions, and solvents","Inorganic Chemistry Frontiers","2016","3","12","1624","","10.1039/C6QI00417B","","","1.54184","CuKα","","0.1447","0.1407","","","0.3442","0.3458","","","","","","1.095","","","","has coordinates","234891","2020-10-21","18:00:00",""
"4349576","17.6175","0.0003","17.6175","0.0003","37.7194","0.001","90","","90","","90","","11707.2","0.4","300","0.1","300","0.1","","","","","","","no","6","I 41/a :2","-I 4ad","88","8-3","8-3","","- C35 H31 B Fe0.5 N3 O2 -","- C35 H31 B Fe0.5 N3 O2 -","- C560 H496 B16 Fe8 N48 O32 -","16","1","","Zhu, Yuan-Yuan; Li, Hong-Qing; Ding, Zhong-Yu; Lü, Xiao-Jin; Zhao, Liang; Meng, Yin-Shan; Liu, Tao; Gao, Song","Spin transitions in a series of [Fe(pybox)2]2+ complexes modulated by ligand structures, counter anions, and solvents","Inorganic Chemistry Frontiers","2016","3","12","1624","","10.1039/C6QI00417B","","","0.71073","MoKα","","0.0666","0.0403","","","0.1021","0.1202","","","","","","1.036","","","","has coordinates","234891","2020-10-21","18:00:00",""
"4350269","13.2334","0.0002","13.2334","0.0002","38.5792","0.0009","90","","90","","90","","6756.1","0.2","174","2","174","2","","","","","","","","6","I 41/a :2","-I 4ad","88","[L14Cu4]","","","- C64 H100 Cu4 N4 O8 S4 -","- C64 H100 Cu4 N4 O8 S4 -","- C256 H400 Cu16 N16 O32 S16 -","4","0.25","","Tesema, Yohannes T.; Pham, David M.; Franz, Katherine J.","Synthesis and characterization of copper(II) complexes of cysteinyldopa and benzothiazine model ligands related to pheomelanin.","Inorganic chemistry","2006","45","16","6102","6104","10.1021/ic060262n","","","0.71073","MoKα","","0.0637","0.046","","","0.1149","0.1273","","","","","","1.015","","","","has coordinates","239820","2020-10-21","18:00:00",""
"4350795","17.3984","0.0002","17.3984","0.0002","16.7004","0.0003","90","","90","","90","","5055.28","0.12","93","2","93","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C44 H84 Cl4 N4 P4 Re2 -","- C44 H84 Cl4 N4 P4 Re2 -","- C176 H336 Cl16 N16 P16 Re8 -","4","0.25","","Weber, Jeremy E.; Hasanayn, Faraj; Fataftah, Majed; Mercado, Brandon Q.; Crabtree, Robert H.; Holland, Patrick L.","Electronic and Spin-State Effects on Dinitrogen Splitting to Nitrides in a Rhenium Pincer System.","Inorganic chemistry","2021","60","9","6115","6124","10.1021/acs.inorgchem.0c03778","","","1.54184","CuKα","","0.0194","0.0186","","","0.0463","0.0468","","","","","","1.042","","","","has coordinates","264806","2021-05-03","22:04:44",""
"4500047","30.5053","0.0009","30.5053","0.0009","12.156","0.0004","90","","90","","90","","11312","0.6","220","2","220","2","","","","","","","Synthesized by the authors. See text","5","I 41/a :2","-I 4ad","88","","","","- C31 H35 B N2 O5 -","- C31 H35 B N2 O5 -","- C496 H560 B16 N32 O80 -","16","1","","Emilie Voisin; Thierry Maris; James D. Wuest","Crystal Structures of Spiroborates Derived from 2,2'-Dihydroxybiphenyl","Cryst. Growth & Design","2008","8","","308","318","10.1021/cg700803k","","","1.54178","CuKα","","0.1109","0.0715","","","0.1983","0.2183","","","","","","1.066","","","","has coordinates,has disorder","179531","2020-10-21","18:00:00",""
"4500068","16.8018","0.0008","16.8018","0.0008","7.1674","0.0004","90","","90","","90","","2023.36","0.18","223","2","223","2","","","","","","","Synthesized by the authors. See text","3","I 41/a :2","-I 4ad","88","tetrakis(4-aminophenyl)methane","tetrakis(4-aminophenyl)methane","","- C25 H24 N4 -","- C25 H24 N4 -","- C100 H96 N16 -","4","0.25","","Dominic Laliberté,; Thierry Maris; Eric Demers; Fatima Helzy; Mathieu Arseneault; James D. Wuest","Molecular Tectonics. Hydrogen-Bonded Networks Built from Tetra- and Hexaanilines","Cryst. Growth & Design","2005","5","","1451","1456","10.1021/cg049566f","","","1.54178","CuKα","","0.0475","0.0412","","","0.1191","0.1245","","","","","","1.082","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500079","12.3873","0.0003","12.3873","0.0003","24.1863","0.0007","90","","90","","90","","3711.27","0.17","223","2","223","2","","","","","","","Synthesized by the authors. See text","4","I 41/a :2","-I 4ad","88","","","","- C49 H28 N4 O8 -","- C49 H28 N4 O8 -","- C196 H112 N16 O32 -","4","0.25","","Eric Demers; Thierry Maris; Janie Cabana; Jean-Hugues Fournier; James D. Wuest","Weakly Bonded Molecular Networks Built from Tetranitro and Tetracyanospirobifluorenes","Cryst. Growth & Design","2005","5","","1237","1245","10.1021/cg049590t","","","1.54178","CuKα","","0.044","0.0429","","","0.1096","0.1104","","","","","","1.034","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500080","13.2114","0.0009","13.2114","0.0009","21.539","0.003","90","","90","","90","","3759.4","0.6","223","2","223","2","","","","","","","Synthesized by the authors. See text","3","I 41/a :2","-I 4ad","88","","","","- C53 H28 N4 -","- C53 H28 N4 -","- C212 H112 N16 -","4","0.25","","Eric Demers; Thierry Maris; Janie Cabana; Jean-Hugues Fournier; James D. Wuest","Weakly Bonded Molecular Networks Built from Tetranitro and Tetracyanospirobifluorenes","Cryst. Growth & Design","2005","5","","1237","1245","10.1021/cg049590t","","","1.54178","CuKα","","0.0664","0.0629","","","0.1509","0.1517","","","","","","1.063","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500081","17.1641","0.0002","17.1641","0.0002","7.2676","0.0001","90","","90","","90","","2141.08","0.05","226","","226","","","","","","","","Synthesized by the authors. See text","4","I 41/a :2","-I 4ad","88","Tetrakis(3-hydroxyphenyl)silane","","","- C24 H20 O4 Si -","- C24 H20 O4 Si -","- C96 H80 O16 Si4 -","4","0.25","","Jean-Hugues Fournier; Thierry Maris; Michel Simard; James D. Wuest","Molecular Tectonics. Hydrogen-Bonded Networks Built from Tetraphenols Derived from Tetraphenylmethane and Tetraphenylsilane","Cryst. Growth & Design","2003","2","","535","540","","","","1.5418","CuKα","","0.0446","0.0445","","","0.1319","0.1321","","","","","","1.157","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500218","18.052","0.003","18.052","0.003","19.523","0.004","90","","90","","90","","6362","2","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","Lithium and Lead(II) Butanoate","Lithium and Lead(II) Tributanoate","","- C12 H21 Li O6 Pb -","- C12 H21 Li O6 Pb -","- C192 H336 Li16 O96 Pb16 -","16","1","","Casado, F. J. Martínez; Riesco, M. Ramos; Silva, I. da; Yélamos, M. I. Redondo; Labrador, A.; Cheda, J. A. Rodríguez","Lithium and Lead(II) Butyrates Binary System. Pure Compounds and an Intermediate Salt: From 2D to 3D Coordination Polymers","Crystal Growth & Design","2011","11","3","759","","10.1021/cg101272n","","","0.7379","Synchrotron","","0.0864","0.0731","","","0.1949","0.2133","","","","","","1.061","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500219","18.417","0.003","18.417","0.003","19.88","0.004","90","","90","","90","","6743","2","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","Lithium and Lead(II) Butanoate","Lithium and Lead(II) Tributanoate","","- C12 H21 Li O6 Pb -","- C12 H21 Li O6 Pb -","- C192 H336 Li16 O96 Pb16 -","16","1","","Casado, F. J. Martínez; Riesco, M. Ramos; Silva, I. da; Yélamos, M. I. Redondo; Labrador, A.; Cheda, J. A. Rodríguez","Lithium and Lead(II) Butyrates Binary System. Pure Compounds and an Intermediate Salt: From 2D to 3D Coordination Polymers","Crystal Growth & Design","2011","11","3","759","","10.1021/cg101272n","","","0.7513","Synchrotron","","0.0405","0.0376","","","0.0991","0.1021","","","","","","1.092","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500239","22.3848","0.0017","22.3848","0.0017","3.7128","0.0003","90","","90","","90","","1860.4","0.3","100","","100","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C16 H4 Ag Cl4 N8 -","- C16 H4 Ag Cl4 N8 -","- C64 H16 Ag4 Cl16 N32 -","4","0.25","","Naito, Toshio; Kakizaki, Akihiro; Inabe, Tamotsu; Sakai, Riu; Nishibori, Eiji; Sawa, Hiroshi","Growth of Nanocrystals in a Single Crystal of Different Materials: A Way of Giving Function to Molecular Crystals","Crystal Growth & Design","2011","11","2","501","","10.1021/cg101295p","","","0.71073","MoKα","","0.0538","0.044","","0.0884","0.0859","0.0859","","","","","","0.9189","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500240","22.377","0.0011","22.377","0.0011","3.7289","0.0002","90","","90","","90","","1867.17","0.16","300","","300","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C16 H4 Ag Cl4 N8 -","- C16 H4 Ag Cl4 N8 -","- C64 H16 Ag4 Cl16 N32 -","4","0.25","","Naito, Toshio; Kakizaki, Akihiro; Inabe, Tamotsu; Sakai, Riu; Nishibori, Eiji; Sawa, Hiroshi","Growth of Nanocrystals in a Single Crystal of Different Materials: A Way of Giving Function to Molecular Crystals","Crystal Growth & Design","2011","11","2","501","","10.1021/cg101295p","","","0.71073","MoKα","","0.0505","0.0392","","0.0322","0.0319","0.0319","","","","","","1.6109","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500241","22.4002","0.0019","22.4002","0.0019","3.7333","0.0003","90","","90","","90","","1873.3","0.3","100","","100","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C16 H4 Ag Cl4 N8 -","- C16 H4 Ag Cl4 N8 -","- C64 H16 Ag4 Cl16 N32 -","4","0.25","","Naito, Toshio; Kakizaki, Akihiro; Inabe, Tamotsu; Sakai, Riu; Nishibori, Eiji; Sawa, Hiroshi","Growth of Nanocrystals in a Single Crystal of Different Materials: A Way of Giving Function to Molecular Crystals","Crystal Growth & Design","2011","11","2","501","","10.1021/cg101295p","","","0.71073","MoKα","","0.0711","0.0665","","0.072","0.0719","0.0719","","","","","","1.0788","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500798","20.5738","0.001","20.5738","0.001","36.261","0.004","90","","90","","90","","15349","2","85","2","85","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C68 H57 Br8 O12 Si8 -","- C64 H52 Br8 O12 Si8 -","- C512 H416 Br64 O96 Si64 -","8","0.5","","Roll, Mark F.; Kampf, Jeffrey W.; Laine, Richard M.","Halogen Bonding Motifs in Polyhedral Phenylsilsesquioxanes: Effects of Systematic Variations in Geometry or Substitution","Crystal Growth & Design","2011","11","10","4360","","10.1021/cg200312g","","","0.71073","MoKα","","0.0626","0.0526","","","0.146","0.153","","","","","","1.089","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4501446","22.9061","0.0019","22.9061","0.0019","14.7776","0.0013","90","","90","","90","","7753.7","1.1","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C22 H16 Cl N3 O -","- C22 H16 Cl N3 O -","- C352 H256 Cl16 N48 O16 -","16","1","","Wang, Shu-Liang; Ding, Jie; Jiang, Bo; Gao, Yuan; Tu, Shu-Jiang","Microwave-assisted solvent-dependent reaction: chemoselective synthesis of quinoxalin-2(1H)-ones, benzo[d]imidazoles and dipeptides.","ACS combinatorial science","2011","13","5","572","577","10.1021/co2001247","","","0.71073","MoKα","","0.153","0.0491","","","0.0718","0.0853","","","","","","0.952","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4502042","14.7793","0.0007","14.7793","0.0007","17.2923","0.0006","90","","90","","90","","3777.1","0.3","110","2","110","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C40 H24 Cl4 Cu5 N8 -","- C40 H24 Cl4 Cu5 N8 -","- C160 H96 Cl16 Cu20 N32 -","4","0.25","","Lipstman, Sophia; Goldberg, Israel","Versatile Molecular Recognition Features of Tetra(3-pyridyl)porphyrin in Crystal Engineering","Crystal Growth & Design","2010","10","10","4596","","10.1021/cg1008973","","","0.71073","MoKα","","0.0803","0.0683","","","0.1574","0.1633","","","","","","1.159","","","","has coordinates","179551","2020-10-21","18:00:00",""
"4502043","15.414","0.0004","15.414","0.0004","17.4352","0.0004","90","","90","","90","","4142.45","0.18","110","2","110","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C40 H24 Cu5 I4 N8 -","- C40 H24 Cu5 I4 N8 -","- C160 H96 Cu20 I16 N32 -","4","0.25","","Lipstman, Sophia; Goldberg, Israel","Versatile Molecular Recognition Features of Tetra(3-pyridyl)porphyrin in Crystal Engineering","Crystal Growth & Design","2010","10","10","4596","","10.1021/cg1008973","","","0.71073","MoKα","","0.0692","0.0397","","","0.0803","0.09","","","","","","1.069","","","","has coordinates","179551","2020-10-21","18:00:00",""
"4502136","15.0113","0.0003","15.0113","0.0003","17.3605","0.0004","90","","90","","90","","3912","0.14","110","2","110","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C40 H24 Br4 Cu5 N8 -","- C40 H24 Br4 Cu5 N8 -","- C160 H96 Br16 Cu20 N32 -","4","0.25","","Lipstman, Sophia; Goldberg, Israel","Supramolecular Crystal Chemistry of Tetra(3-pyridyl)porphyrin. 2. Two- and Three-Dimensional Coordination Networks with Cobalt and Cadmium Ions","Crystal Growth & Design","2010","10","11","5001","","10.1021/cg1011007","","","0.71073","MoKα","","0.0531","0.0379","","","0.0965","0.1028","","","","","","1.101","","","","has coordinates","179552","2020-10-21","18:00:00",""
"4502285","19.431","0.007","19.431","0.007","18.713","0.004","90","","90","","90","","7065","4","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C18 H10 N10 O0 Zn -","- C18 H10 N10 Zn -","- C288 H160 N160 Zn16 -","16","1","","Tao, Ying; Li, Jian-Rong; Chang, Ze; Bu, Xian-He","ZnIIand HgIIComplexes with 2,3-Substituted-5,6-di(1H-tetrazol-5-yl)pyrazine Ligands: Roles of Substituting Groups and Synthetic Conditions on the Formation of Complexes","Crystal Growth & Design","2010","10","2","564","","10.1021/cg900934u","","","0.71073","MoKα","","0.1238","0.0836","","","0.1215","0.1331","","","","","","1.186","","","","has coordinates","179553","2020-10-21","18:00:00",""
"4502750","24.7304","0.0001","24.7304","0.0001","35.59","0.0003","90","","90","","90","","21766.6","0.2","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C55 H55 N9 O11 Zn2 -","- C55 H55 N9 O11 Zn2 -","- C880 H880 N144 O176 Zn32 -","16","1","","Yang, Ping; Wu, Jin-Ji; Zhou, Hai-Yun; Ye, Bao-Hui","Ligand-Directed Construction of Zn(II) Complexes from Zero-Dimensional Metallomacrocycle to One-, Two-, and Three-Dimensional Coordination Polymers Based on N-Donor and β-Diketone Bifunctional Ligands","Crystal Growth & Design","2012","12","1","99","","10.1021/cg200850r","","","1.54178","CuKα","","0.1027","0.0702","","","0.207","0.2316","","","","","","1.06","","","","has coordinates","179558","2020-10-21","18:00:00",""
"4503060","27.9342","0.0019","27.9342","0.0019","3.7655","0.0005","90","","90","","90","","2938.3","0.5","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","1-nitro-3,4-dichlorobenzene","","- C6 H3 Cl2 N O2 -","- C6 H3 Cl2 N O2 -","- C96 H48 Cl32 N16 O32 -","16","1","","Barnett, Sarah A.; Johnston, Andrea; Florence, Alastair J.; Price, Sarah L.; Tocher, Derek A.","A Systematic Experimental and Theoretical Study of the Crystalline State of Six Chloronitrobenzenes","Crystal Growth & Design","2008","8","1","24","","10.1021/cg070131c","","","0.71073","MoKα","","0.0477","0.0428","","","0.0873","0.0892","","","","","","1.204","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4503400","9.9847","0.0008","9.9847","0.0008","61.68","0.008","90","","90","","90","","6149.1","1.1","273","2","273","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C17 H20 N2 -","- C17 H20 N2 -","- C272 H320 N32 -","16","1","","Huang, Xue-Feng; Fu, Da-Wei; Xiong, Ren-Gen","Copper(I) Bromide-Mediated Coupling of Imidazoles. Trapping and X-Ray Crystal Structures of the Reaction Intermediates","Crystal Growth & Design","2008","8","6","1795","","10.1021/cg701085c","","","0.71073","MoKα","","0.0895","0.0511","","","0.1028","0.1071","","","","","","1.093","","","","has coordinates,has disorder","179565","2020-10-21","18:00:00",""
"4504036","24.332","0.006","24.332","0.006","12.343","0.008","90","","90","","90","","7308","5","170","2","170","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Bencylamide of 7,7-diethyl-5-hydroxymethyl-6-oxa-bicyclo[3.2.1] -1-carboxylic acid [1h]","","- C20 H29 N O3 -","- C20 H29 N O3 -","- C320 H464 N16 O48 -","16","1","","Foces-Foces, Concepción; López-Rodríguez, Matías; Pérez, Cirilo; Martín, Julio D.; Pérez-Hernández, Natalia","Role of the Molecular Conformation in the Two- and Three-Dimensional Supramolecular Structure of 10 Hydroxyl-N-alkylamides","Crystal Growth & Design","2007","7","5","905","","10.1021/cg060671u","","","0.71073","MoKα","","0.1034","0.0955","","","0.2384","0.2441","","","","","","1.088","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504039","24.666","0.0005","24.666","0.0005","10.555","0.0004","90","","90","","90","","6421.8","0.3","170","2","170","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Ethylamide of 7,7-dicyclopropyl-5-hydroxymethyl-6-oxa-bicyclo[3.2.1] -1-carboxylic acid [1n]","","- C17 H27 N O3 -","- C17 H27 N O3 -","- C272 H432 N16 O48 -","16","1","","Foces-Foces, Concepción; López-Rodríguez, Matías; Pérez, Cirilo; Martín, Julio D.; Pérez-Hernández, Natalia","Role of the Molecular Conformation in the Two- and Three-Dimensional Supramolecular Structure of 10 Hydroxyl-N-alkylamides","Crystal Growth & Design","2007","7","5","905","","10.1021/cg060671u","","","0.71073","MoKα","","0.0941","0.0839","","","0.2093","0.2256","","","","","","1.045","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504501","28.7889","0.0013","28.7889","0.0013","12.7959","0.0008","90","","90","","90","","10605.3","0.9","91","2","91","2","","","","","","","","4","I 41/a :2","-I 4ad","88","C70.H2F20TPP.8benzene","","","- C162 H58 F20 N4 -","- C162 H58 F20 N4 -","- C648 H232 F80 N16 -","4","0.25","","Olmstead, Marilyn M.; Nurco, Daniel J.","Fluorinated Tetraphenylporphyrins as Cocrystallizing Agents for C60and C70","Crystal Growth & Design","2006","6","1","109","","10.1021/cg050225r","","","0.71073","MoKα","","0.1422","0.0848","","","0.2518","0.2892","","","","","","1.117","","","","has coordinates,has disorder","179580","2020-10-21","18:00:00",""
"4504502","28.3348","0.0019","28.3348","0.0019","12.4941","0.0016","90","","90","","90","","10031","1.6","10","3","10","3","","","","","","","","5","I 41/a :2","-I 4ad","88","C60.NiF20TPP.8benzene","","","- C152 H56 F20 N4 Ni -","- C152 H56 F20 N4 Ni -","- C608 H224 F80 N16 Ni4 -","4","0.25","","Olmstead, Marilyn M.; Nurco, Daniel J.","Fluorinated Tetraphenylporphyrins as Cocrystallizing Agents for C60and C70","Crystal Growth & Design","2006","6","1","109","","10.1021/cg050225r","","","0.71073","MoKα","","0.0962","0.0455","","","0.093","0.1196","","","","","","1.003","","","","has coordinates","179580","2020-10-21","18:00:00",""
"4504571","32.336","0.003","32.336","0.003","15.235","0.002","90","","90","","90","","15930","3","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C67 H91 Cl3 N6 O18 Sn6 -","- C67 H91 Cl3 N6 O18 Sn6 -","- C536 H728 Cl24 N48 O144 Sn48 -","8","0.5","","Chandrasekhar, Vadapalli; Gopal, Kandasamy; Nagendran, Selvarajan; Steiner, Alexander; Zacchini, Stefano","Influence of Aromatic Substituents on the Supramolecular Architectures of Monoorganooxotin Drums","Crystal Growth & Design","2006","6","1","267","","10.1021/cg050323c","","","0.71073","MoKα","","0.0664","0.0433","","","0.1123","0.1254","","","","","","1.009","","","","has coordinates,has disorder","179580","2020-10-21","18:00:00",""
"4504585","28.7056","0.0003","28.7056","0.0003","12.3929","0.0001","90","","90","","90","","10211.9","0.17","87","","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C152 H56 F20 N4 -","- C152 H56 F20 N4 -","- C608 H224 F80 N16 -","4","0.25","","Hosseini, Ali; Hodgson, Michael C.; Tham, Fook S.; Reed, Christopher A.; Boyd, Peter D. W.","Tapes, Sheets, and Prisms. Identification of the Weak C−F Interactions that Steer Fullerene−Porphyrin Cocrystallization","Crystal Growth & Design","2006","6","2","397","","10.1021/cg050352n","","","0.71073","MoKα","","0.1717","0.0742","","","0.1178","0.1474","","","","","","1.053","","","","has coordinates","179580","2020-10-21","18:00:00",""
"4504743","16.9462","0.0015","16.9462","0.0015","18.477","0.003","90","","90","","90","","5306.1","1.1","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","5","","","- C22 H20 Cl2 N8 O10 Zn -","- C22 H20 Cl2 N8 O10 Zn -","- C176 H160 Cl16 N64 O80 Zn8 -","8","0.5","","Custelcean, Radu; Moyer, Bruce A.; Bryantsev, Vyacheslav S.; Hay, Benjamin P.","Anion Coordination in Metal−Organic Frameworks Functionalized with Urea Hydrogen-Bonding Groups","Crystal Growth & Design","2006","6","2","555","","10.1021/cg0505057","","","0.71073","MoKα","","0.0654","0.0632","","","0.1404","0.1417","","","","","","1.381","","","","has coordinates","179582","2020-10-21","18:00:00",""
"4505161","23.83","0.005","23.83","0.005","5.196","0.001","90","","90","","90","","2950.6","1","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","Yana-370","","","- C5 H6 Cl N3 O -","- C5 H6 Cl N3 O -","- C80 H96 Cl16 N48 O16 -","16","1","","Kaftory, Menahem; Botoshansky, Mark; Sheinin, Yana","Dimormorphism and Cocrystal Formation of 3-(Chloroacetamido)pyrazole","Crystal Growth & Design","2005","5","6","2242","","10.1021/cg0501229","","","0.71073","MoKα","","0.1481","0.0488","","","0.114","0.1465","","","","","","0.81","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505193","16.975","0.002","16.975","0.002","17.007","0.002","90","","90","","90","","4900.6","1","296","","296","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C21 H36 N4 S2 -","- C19.5 H32.5 N4 S2 -","- C156 H260 N32 S16 -","8","0.5","","Succaw, Gary L.; Weakley, Timothy J. R.; Han, Fusan; Doxsee, Kenneth M.","Crystal Engineering with Bis(thiourea) Derivatives†","Crystal Growth & Design","2005","5","6","2288","","10.1021/cg050162c","","","0.71073","MoKα","","0.107","0.078","","0.149","","0.072","","","1.84","","","2.44","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505195","16.755","0.002","16.755","0.002","18.559","0.003","90","","90","","90","","5210.1","1.2","296","","296","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C22 H38 N4 S2 -","- C20.5 H37.5 N4 S2 -","- C164 H300 N32 S16 -","8","0.5","","Succaw, Gary L.; Weakley, Timothy J. R.; Han, Fusan; Doxsee, Kenneth M.","Crystal Engineering with Bis(thiourea) Derivatives†","Crystal Growth & Design","2005","5","6","2288","","10.1021/cg050162c","","","0.71073","MoKα","","0.074","0.069","","0.143","","0.079","","","1.75","","","2.66","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505197","16.854","0.003","16.854","0.003","18.943","0.004","90","","90","","90","","5380.9","1.8","273","2","273","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C23 H40 N4 S2 -","- C21 H34 N4 S2 -","- C168 H272 N32 S16 -","8","0.5","","Succaw, Gary L.; Weakley, Timothy J. R.; Han, Fusan; Doxsee, Kenneth M.","Crystal Engineering with Bis(thiourea) Derivatives†","Crystal Growth & Design","2005","5","6","2288","","10.1021/cg050162c","","","0.71073","MoKα","","0.141","0.085","","","0.2348","0.2567","","","","","","1.283","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505201","16.699","0.004","16.693","0.006","18.989","0.004","90","","90","","90","","5293","3","273","","273","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C22 H38 N4 S2 -","- C20.5 H37.5 N4 S2 -","- C164 H300 N32 S16 -","8","0.5","","Succaw, Gary L.; Weakley, Timothy J. R.; Han, Fusan; Doxsee, Kenneth M.","Crystal Engineering with Bis(thiourea) Derivatives†","Crystal Growth & Design","2005","5","6","2288","","10.1021/cg050162c","","","0.71073","MoKα","","0.184","0.116","","0.152","","0.071","","","1.19","","","1.82","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505202","16.705","0.004","16.705","0.004","19.205","0.007","90","","90","","90","","5359","3","273","2","273","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C24 H42 N4 S2 -","- C24.2 H33 N4 S2 -","- C193.6 H264 N32 S16 -","8","0.5","","Succaw, Gary L.; Weakley, Timothy J. R.; Han, Fusan; Doxsee, Kenneth M.","Crystal Engineering with Bis(thiourea) Derivatives†","Crystal Growth & Design","2005","5","6","2288","","10.1021/cg050162c","","","0.71073","MoKα","","0.1536","0.1102","","","0.2229","0.2406","","","","","","1.243","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505325","14.3972","0.0009","14.3972","0.0009","26.008","0.003","90","","90","","90","","5390.9","0.8","273","2","273","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C9 H13 Au N2 O3 S2 -","- C9 H13 Au N2 O3 S2 -","- C144 H208 Au16 N32 O48 S32 -","16","1","","Tzeng, Biing-Chiau; Liu, Wei-Hsin; Liao, Ju-Hsiou; Lee, Gene-Hsiang; Peng, Shie-Ming","Self-Assembly of Gold(I) Compounds with (Aza-15-crown-5)dithiocarbamate and 2-Mercapto-4-methyl-5-thiazoleacetic Acid","Crystal Growth & Design","2004","4","3","573","","10.1021/cg034198l","","","0.71073","MoKα","","0.0622","0.036","","","0.0833","0.0892","","","","","","0.896","","","","has coordinates","179588","2020-10-21","18:00:00",""
"4505445","29.53","0.006","29.53","0.006","10.639","0.002","90","","90","","90","","9277","3","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C32 H20 N2 O2 -","- C32 H20 N2 O2 -","- C512 H320 N32 O32 -","16","1","","Klare, Jennifer E.; Tulevski, George S.; Nuckolls, Colin","Chemical reactions with upright monolayers of cruciform pi-systems.","Langmuir : the ACS journal of surfaces and colloids","2004","20","23","10068","10072","10.1021/la0479152","","","0.71073","MoKα","","0.4408","0.1284","","","0.2185","0.3404","","","","","","1.007","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505570","9.159","0.003","9.159","0.003","24.445","0.014","90","","90","","90","","2050.6","1.5","100","2","100","2","","","","","","","synthesis as described","5","I 41/a :2","-I 4ad","88","","poly-{[tetramethylammonium (mu-pyrazine-2,5-dicarboxylato)-k2N,O:k2N',O') indate(III)]dihydrate}","","- C16 H20 In N5 O10 -","- C16 H20 In N5 O10 -","- C64 H80 In4 N20 O40 -","4","0.25","","Cepeda, Javier; Beobide, Garikoitz; Castillo, Oscar; Luque, Antonio; Pérez-Yáñez, Sonia; Román, Pascual","Structure-Directing Effect of Organic Cations in the Assembly of Anionic In(III)/Diazinedicarboxylate Architectures","Crystal Growth & Design","2012","12","3","1501","","10.1021/cg201572y","","","0.71073","MoKα","","0.048","0.0313","","","0.0698","0.0728","","","","","","0.943","","","","has coordinates","179590","2020-10-21","18:00:00",""
"4505699","11.453","0.0003","11.453","0.0003","49.674","0.0013","90","","90","","90","","6515.8","0.3","110","2","110","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C68 H48 Ag Cl N12 O4 -","- C68 H48 Ag Cl N12 O5 -","- C272 H192 Ag4 Cl4 N48 O20 -","4","0.25","","Patra, Goutam Kumar; Goldberg, Israel","Supramolecular Design of Coordination Complexes of Silver(I) with Polyimine Ligands: Synthesis, Materials Characterization, and Structure of New Polymeric and Oligomeric Materials","Crystal Growth & Design","2003","3","3","321","","10.1021/cg034011q","","","0.71073","MoKα","","0.0939","0.0657","","","0.1884","0.2163","","","","","","0.868","","","","has coordinates","179591","2020-10-21","18:00:00",""
"4505708","17.1641","0.0002","17.1641","0.0002","7.2676","0.0001","90","","90","","90","","2141.08","0.05","226","","226","","","","","","","","Synthesized by the authors. See text","4","I 41/a :2","-I 4ad","88","Tetrakis(3-hydroxyphenyl)silane","","","- C24 H20 O4 Si -","- C24 H20 O4 Si -","- C96 H80 O16 Si4 -","4","0.25","","Fournier, Jean-Hugues; Maris, Thierry; Simard, Michel; Wuest, James D.","Molecular Tectonics. Hydrogen-Bonded Networks Built from Tetraphenols Derived from Tetraphenylmethane and Tetraphenylsilane","Crystal Growth & Design","2003","3","4","535","","10.1021/cg034043d","","","1.5418","CuKα","","0.0446","0.0445","","","0.1319","0.1321","","","","","","1.157","","","","has coordinates","179593","2020-10-21","18:00:00",""
"4505903","31.7204","0.001","31.7204","0.001","13.7906","0.0006","90","","90","","90","","13875.9","0.9","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","tris(2,2'-bipyridine-4,4'-diamine)cadmium(II) chloride hydrate","","- C30 H35.5 Cd Cl2 N12 O2.75 -","- C30 H30 Cd Cl2 N12 O2.75 -","- C480 H480 Cd16 Cl32 N192 O44 -","16","1","","Rigby, Nicola; Jacobs, Tia; Reddy, Jayarama Prakasha; Hardie, Michaele J.","Metal Complexes of 2,2′-Bipyridine-4,4′-diamine as Metallo-Tectons for Hydrogen Bonded Networks","Crystal Growth & Design","2012","12","4","1871","","10.1021/cg201512q","","","0.71073","MoKα","","0.0742","0.0524","","","0.1372","0.1546","","","","","","1.026","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4506336","15.403","0.001","15.403","0.001","22.617","0.003","90","","90","","90","","5365.9","0.9","293","2","293","2","","","","","","","synthesis as described","5","I 41/a :2","-I 4ad","88","","poly-[(mu-glutarato-K2-O,O')(mu3-adeninato-k3-N3:N7:N9)copper(II)]dihydrate","","- C20 H28 Cu2 N10 O10 -","- C20 H26 Cu2 N10 O10 -","- C160 H208 Cu16 N80 O80 -","8","0.5","","Pérez-Yáñez, Sonia; Beobide, Garikoitz; Castillo, Oscar; Cepeda, Javier; Luque, Antonio; Román, Pascual","Directing the Formation of Adenine Coordination Polymers from Tunable Copper(II)/Dicarboxylato/Adenine Paddle-Wheel Building Units","Crystal Growth & Design","2012","12","6","3324","","10.1021/cg300446d","","","0.71073","MoKα","","0.1379","0.0552","","","0.1077","0.1227","","","","","","1.131","","","","has coordinates","179599","2020-10-21","18:00:00",""
"4506337","14.688","0.001","14.688","0.001","24.331","0.003","90","","90","","90","","5249.1","0.8","100","2","100","2","","","","","","","synthesis as described","5","I 41/a :2","-I 4ad","88","","poly-[(mu-adipato-K2-O,O')(mu3-adeninato-k3-N3:N7:N9)copper(II)]","","- C22 H26 Cu2 N10 O8 -","- C22 H26 Cu2 N10 O8 -","- C176 H208 Cu16 N80 O64 -","8","0.5","","Pérez-Yáñez, Sonia; Beobide, Garikoitz; Castillo, Oscar; Cepeda, Javier; Luque, Antonio; Román, Pascual","Directing the Formation of Adenine Coordination Polymers from Tunable Copper(II)/Dicarboxylato/Adenine Paddle-Wheel Building Units","Crystal Growth & Design","2012","12","6","3324","","10.1021/cg300446d","","","0.71073","MoKα","","0.1497","0.0606","","","0.0881","0.1092","","","","","","1.082","","","","has coordinates,has disorder","179599","2020-10-21","18:00:00",""
"4506338","15.6854","0.0005","15.6854","0.0005","23.2536","0.0009","90","","90","","90","","5721.1","0.3","100","2","100","2","","","","","","","synthesis as described","5","I 41/a :2","-I 4ad","88","","poly-[(mu-pimelato-K2-O,O')(mu3-adeninato-k3-N3:N7:N9)copper(II)]","","- C24 H30 Cu2 N10 O8 -","- C24 H30 Cu2 N10 O8 -","- C192 H240 Cu16 N80 O64 -","8","0.5","","Pérez-Yáñez, Sonia; Beobide, Garikoitz; Castillo, Oscar; Cepeda, Javier; Luque, Antonio; Román, Pascual","Directing the Formation of Adenine Coordination Polymers from Tunable Copper(II)/Dicarboxylato/Adenine Paddle-Wheel Building Units","Crystal Growth & Design","2012","12","6","3324","","10.1021/cg300446d","","","0.71073","MoKα","","0.0866","0.0601","","","0.1289","0.1391","","","","","","1.072","","","","has coordinates,has disorder","179599","2020-10-21","18:00:00",""
"4506698","15.588","0.003","15.588","0.003","35.69","0.01","90","","90","","90","","8672","3","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C72 H92 Cd4 N16 O26 -","- C72 H72 Cd4 N16 O26 -","- C288 H288 Cd16 N64 O104 -","4","0.25","","Deng, Ji-Hua; Zhong, Di-Chang; Luo, Xu-Zhong; Liu, Hui-Jin; Lu, Tong-Bu","2-Propyl-4,5-dicarboxylate-imidazole (H3PIDC) Based Cadmium(II) Coordination Compounds Stabilized by Supramolecular Interactions: From Mononuclear and Tetranuclear Oligomers to One-Dimensional (1D) Chain and Two-Dimensional (2D) Layer Polymers","Crystal Growth & Design","2012","12","10","4861","","10.1021/cg300678h","","","0.71073","MoKα","","0.1935","0.0781","","","0.177","0.2283","","","","","","1.101","","","","has coordinates","179602","2020-10-21","18:00:00",""
"4506754","30.5283","0.0002","30.5283","0.0002","14.0942","0.0001","90","","90","","90","","13135.5","0.15","93.1","","296.1","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C39 H30 Cl3 N O3 S -","- C39 H30 Cl3 N O3 S -","- C624 H480 Cl48 N16 O48 S16 -","16","1","","Yamamoto, Atsushi; Uehara, Shinji; Hamada, Tomoya; Miyata, Mikiji; Hisaki, Ichiro; Tohnai, Norimitsu","Diamondoid Porous Organic Salts toward Applicable Strategy for Construction of Versatile Porous Structures","Crystal Growth & Design","2012","12","9","4600","","10.1021/cg300796u","","","0.7","synchrotron","","","0.0684","","","","0.1769","","","","","","1.049","","","","has coordinates","179603","2020-10-21","18:00:00",""
"4506755","27.0647","0.0006","27.0647","0.0006","35.4072","0.0009","90","","90","","90","","25935.7","1","296.1","","296.1","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C79 H66 N2 O6 S2 -","- C79 H66 N2 O6 S2 -","- C1264 H1056 N32 O96 S32 -","16","1","","Yamamoto, Atsushi; Uehara, Shinji; Hamada, Tomoya; Miyata, Mikiji; Hisaki, Ichiro; Tohnai, Norimitsu","Diamondoid Porous Organic Salts toward Applicable Strategy for Construction of Versatile Porous Structures","Crystal Growth & Design","2012","12","9","4600","","10.1021/cg300796u","","","1.54178","CuKα","","","0.1143","","","","0.3598","","","","","","1.135","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4506910","52.91","0.002","52.91","0.002","48.89","0.002","90","","90","","90","","136866","9","100","2","100","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C274 H198 N24 Na12.62 Ni6 O135.26 S16 -","- C274 H198 N24 Na12.6 Ni6 O135.2 S16 -","- C2192 H1584 N192 Na100.8 Ni48 O1081.6 S128 -","8","0.5","","Brancatelli, Giovanna; De Zorzi, Rita; Hickey, Neal; Siega, Patrizia; Zingone, Guglielmo; Geremia, Silvano","New Multicomponent Porous Architecture of Self-Assembled Porphyrins/Calixarenes Driven by Nickel Ions","Crystal Growth & Design","2012","12","10","5111","","10.1021/cg3010689","","","1","","","0.2034","0.1445","","","0.3371","0.3585","","","","","","1.704","","","","has coordinates","286259","2023-09-07","06:04:50",""
"4507206","22.429","0.0008","22.429","0.0008","10.2923","0.0007","90","","90","","90","","5177.6","0.4","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H26 Cu N8 O8 -","- C20 H26 Cu N8 O8 -","- C160 H208 Cu8 N64 O64 -","8","0.5","","Di Nicola, Corrado; Forlin, Enrico; Garau, Federica; Gazzano, Massimo; Lanza, Arianna; Monari, Magda; Nestola, Fabrizio; Pandolfo, Luciano; Pettinari, Claudio; Zorzi, Alberto; Zorzi, Federico","Coordination Polymers Based on the Trinuclear Triangular Secondary Building Unit [Cu3(μ3-OH)(μ-pz)3]2+(pz = pyrazolate) and Succinate Anion","Crystal Growth & Design","2013","13","1","126","","10.1021/cg3012712","","","0.71073","MoKα","","0.0554","0.0317","","","0.0421","0.044","","","","","","1.039","","","","has coordinates","179608","2020-10-21","18:00:00",""
"4507346","18.6293","0.0004","18.6293","0.0004","17.6086","0.0005","90","","90","","90","","6111.1","0.3","120","2","120","2","","","","","","","see text","5","I 41/a :2","-I 4ad","88","","","","- C12 H13 Cl2 N5 O2 -","- C12 H13 Cl2 N5 O2 -","- C192 H208 Cl32 N80 O32 -","16","1","","Chadha, Renu; Saini, Anupam; Khullar, Sadhika; Jain, Dharamvir Singh; Mandal, Sanjay K.; Guru Row, T. N.","Crystal Structures and Physicochemical Properties of Four New Lamotrigine Multicomponent Forms","Crystal Growth & Design","2013","13","2","858","","10.1021/cg301556j","","x-ray","0.71073","MoKα","","0.0786","0.0508","","","0.1374","0.1521","","","","","","1.173","","","","has coordinates","179609","2020-10-21","18:00:00",""
"4507354","21.9976","0.0006","21.9976","0.0006","16.5598","0.0009","90","","90","","90","","8013.2","0.5","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H16 Br2 Cd2 N6 O12 -","- C32 H16 Br2 Cd2 N6 O12 -","- C256 H128 Br16 Cd16 N48 O96 -","8","0.5","","Zhang, Yu; Guo, Beibei; Li, Li; Liu, Shaofeng; Li, Gang","Construction and Properties of Six Metal‒Organic Frameworks Based on the Newly Designed 2-(p-Bromophenyl)-Imidazole Dicarboxylate Ligand","Crystal Growth & Design","2013","13","1","367","","10.1021/cg301570p","","","0.71073","MoKα","","0.047","0.0338","","","0.0911","0.094","","","","","","1.034","","","","has coordinates","179609","2020-10-21","18:00:00",""
"4507980","43.719","0.006","43.719","0.006","8.5159","0.0017","90","","90","","90","","16277","5","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C31 H25 N4 O6 Zn2 -","- C31 H25 N4 O6 Zn2 -","- C496 H400 N64 O96 Zn32 -","16","1","","Li, Ting; Wang, Feng-Lan; Wu, Shu-Ting; Huang, Xi-He; Chen, Shu-Mei; Huang, Chang-Cang","A Highly Chemical and Thermal Stable Porous Metal‒Organic Framework with Unusual 5-ConnectedzfyTopology","Crystal Growth & Design","2013","13","8","3271","","10.1021/cg400587j","","","0.71073","MoKα","","0.1226","0.0613","","","0.1019","0.1269","","","","","","1.054","","","","has coordinates","179615","2020-10-21","18:00:00",""
"4508223","14.164","0.005","14.164","0.005","34.886","0.013","90","","90","","90","","6999","4","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C60 H68 Cl4 N24 Ni4 O8 -","- C60 H60 Cl4 N24 Ni4 O8 -","- C240 H240 Cl16 N96 Ni16 O32 -","4","0.25","","Moustapha-Sow, Mouhamadou; Diouf, Ousmane; Gaye, Mohamed; Salam-Sall, Abdou; Castro, Goretti; Pérez-Lourido, Paulo; Valencia, Laura; Caneschi, Andrea; Sorace, Lorenzo","Sheets of Tetranuclear Ni(II) [2 ×2] Square Grids Structure with Infinite Orthogonal Two-Dimensional Water‒Chlorine Chains","Crystal Growth & Design","2013","13","10","4172","","10.1021/cg400885f","","","0.71073","MoKα","","0.2216","0.089","","","0.2379","0.338","","","","","","1.03","","","","has coordinates","179618","2020-10-21","18:00:00",""
"4508418","25.83","0.004","25.83","0.004","11.945","0.002","90","","90","","90","","7970","2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C12 H19 Gd2 N3 O14 -","- C12 H19 Gd2 N3 O14 -","- C192 H304 Gd32 N48 O224 -","16","1","","Jia, Ji-Min; Liu, Sui-Jun; Cui, Yu; Han, Song-De; Hu, Tong-Liang; Bu, Xian-He","3D GdIIIComplex Containing Gd16Macrocycles Exhibiting Large Magnetocaloric Effect","Crystal Growth & Design","2013","13","11","4631","","10.1021/cg4008735","","","0.71073","MoKα","","0.0874","0.0785","","","0.1793","0.1837","","","","","","1.236","","","","has coordinates","179620","2020-10-21","18:00:00",""
"4508673","15.76","0.02","15.76","0.02","10.39","0.02","90","","90","","90","","2581","7","208","2","208","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C6 H5 I O -","- C6 H5 I O -","- C96 H80 I16 O16 -","16","1","","Merz, Klaus","Substitution Effect on Crystal Packings of Iodobenzonitriles and Iodophenols","Crystal Growth & Design","2006","6","7","1615","","10.1021/cg060067j","","","0.71073","MoKα","","0.0392","0.0322","","","0.0824","0.0873","","","","","","1.178","","","","has coordinates","179622","2020-10-21","18:00:00",""
"4509300","30.1922","0.0009","30.1922","0.0009","8.6557","0.0003","90","","90","","90","","7890.3","0.4","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H14 F2 N6 O5 Zn -","- C16 H14 F2 N6 O5 Zn -","- C256 H224 F32 N96 O80 Zn16 -","16","1","","Ling, Yun; Zhang, Lei; Li, Jing; Hu, Ai Xi","Three-fold-Interpenetrated Diamondoid Coordination Frameworks with Torus Links Constructed by Tetranuclear Building Blocks","Crystal Growth & Design","2009","9","5","2043","","10.1021/cg801188r","","","0.71073","MoKα","","0.0538","0.0324","","","0.0742","0.0816","","","","","","1.033","","","","has coordinates","179629","2020-10-21","18:00:00",""
"4509301","30.0837","0.0016","30.0837","0.0016","8.667","0.0009","90","","90","","90","","7843.9","1","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H14 Cu F2 N6 O5 -","- C16 H14 Cu F2 N6 O5 -","- C256 H224 Cu16 F32 N96 O80 -","16","1","","Ling, Yun; Zhang, Lei; Li, Jing; Hu, Ai Xi","Three-fold-Interpenetrated Diamondoid Coordination Frameworks with Torus Links Constructed by Tetranuclear Building Blocks","Crystal Growth & Design","2009","9","5","2043","","10.1021/cg801188r","","","0.71073","MoKα","","0.0339","0.0274","","","0.0714","0.0743","","","","","","1.044","","","","has coordinates","179629","2020-10-21","18:00:00",""
"4509359","34.5676","0.0012","34.5676","0.0012","10.3008","0.0004","90","","90","","90","","12308.6","0.8","100","1","100","1","","","","","","","","5","I 41/a :2","-I 4ad","88","","catena-((μ~2~-3,3',5,5'-tetramethyl-4,4'-bipyrazole)-(3,3',5,5'- tetramethyl-4,4'-bipyrazole)-acetato-silver(i) hydrate)","","- C22 H36.925 Ag N8 O7.305 -","- C22 H36.926 Ag N8 O7.3035 -","- C352 H590.816 Ag16 N128 O116.856 -","16","1","","Hunger, Jens; Krautscheid, Harald; Sieler, Joachim","Hydrothermal Synthesis and Structure of Coordination Polymers by Combination of Bipyrazole and Aromatic Dicarboxylate Ligands","Crystal Growth & Design","2009","9","11","4613","","10.1021/cg801282r","","","0.71073","MoKα","","0.0651","0.0331","","","0.0628","0.0678","","","","","","0.813","","","","has coordinates","179629","2020-10-21","18:00:00",""
"4509746","15.782","0.002","15.782","0.002","13.624","0.003","90","","90","","90","","3393.4","1","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C10 H10 Cu3 I3 N2 S2 -","- C10 H10 Cu3 I3 N2 S2 -","- C80 H80 Cu24 I24 N16 S16 -","8","0.5","","Chen, Yang; Wang, Zi-Ou; Ren, Zhi-Gang; Li, Hong-Xi; Li, Duan-Xiu; Liu, Dong; Zhang, Yong; Lang, Jian-Ping","Solvothermal Stepwise Formation of Cu/I/S-Based Semiconductors from a Three-Dimensional Net to One-Dimensional Chains","Crystal Growth & Design","2009","9","11","4963","","10.1021/cg9007608","","","0.71073","MoKα","","0.041","0.0369","","","0.0759","0.0782","","","","","","1.072","","","","has coordinates,has disorder","179633","2020-10-21","18:00:00",""
"4509782","17.2695","0.001","17.2695","0.001","19.002","0.002","90","","90","","90","","5667.1","0.8","294","2","294","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H32 Cu8 I4 N12 O4 -","- C16 H24 Cu8 I4 N12 O4 -","- C64 H96 Cu32 I16 N48 O16 -","4","0.25","","Tzeng, Biing-Chiau; Chang, Tsung-Yi","Toward Copper(I)-Iodide-Based Coordination Architectures viaN,N′-Bis(pyridylcarbonyl)-4,4′-diaminodiphenyl Ether with Different Solvent Compositions","Crystal Growth & Design","2009","9","12","5343","","10.1021/cg900828v","","","0.71073","MoKα","","0.0442","0.0384","","","0.1099","0.1166","","","","","","1.1","","","","has coordinates","179633","2020-10-21","18:00:00",""
"4509783","17.4157","0.0003","17.4157","0.0003","18.5575","0.0003","90","","90","","90","","5628.61","0.16","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H32 Cu8 I4 N12 O4 -","- C16 H32 Cu8 I4 N12 O4 -","- C64 H128 Cu32 I16 N48 O16 -","4","0.25","","Tzeng, Biing-Chiau; Chang, Tsung-Yi","Toward Copper(I)-Iodide-Based Coordination Architectures viaN,N′-Bis(pyridylcarbonyl)-4,4′-diaminodiphenyl Ether with Different Solvent Compositions","Crystal Growth & Design","2009","9","12","5343","","10.1021/cg900828v","","","0.71073","MoKα","","0.0689","0.0487","","","0.1676","0.1834","","","","","","1.147","","","","has coordinates","179633","2020-10-21","18:00:00",""
"4509804","17.187","0.001","17.187","0.001","42.299","0.003","90","","90","","90","","12494.8","1.4","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C26 H34 Cl2 Co N4 O3 -","- C26 H28 Cl2 Co N4 O3 -","- C416 H448 Cl32 Co16 N64 O48 -","16","1","","Carlucci, Lucia; Ciani, Gianfranco; García-Ruiz, Juan Manuel; Moret, Massimo; Proserpio, Davide M.; Rizzato, Silvia","Crystallization Behavior of Coordination Polymers. 1. Kinetic and Thermodynamic Features of 1,3-Bis(4-pyridyl)propane/MCl2Systems","Crystal Growth & Design","2009","9","12","5024","","10.1021/cg900985w","","","0.71073","MoKα","","0.2449","0.13","","","0.3992","0.4657","","","","","","1.465","","","","has coordinates","179634","2020-10-21","18:00:00",""
"4509806","16.991","0.004","16.991","0.004","41.947","0.009","90","","90","","90","","12110","5","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C26 H34 Cl2 N4 Ni O3 -","- C26 H28 Cl2 N4 Ni O3 -","- C416 H448 Cl32 N64 Ni16 O48 -","16","1","","Carlucci, Lucia; Ciani, Gianfranco; García-Ruiz, Juan Manuel; Moret, Massimo; Proserpio, Davide M.; Rizzato, Silvia","Crystallization Behavior of Coordination Polymers. 1. Kinetic and Thermodynamic Features of 1,3-Bis(4-pyridyl)propane/MCl2Systems","Crystal Growth & Design","2009","9","12","5024","","10.1021/cg900985w","","","0.71073","MoKα","","0.2769","0.1355","","","0.4016","0.4697","","","","","","1.25","","","","has coordinates","179634","2020-10-21","18:00:00",""
"4509808","17.081","0.002","17.081","0.002","42.554","0.005","90","","90","","90","","12416","3","180","2","180","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C26 H33 Cl2 Fe N4 O2.5 -","- C26 H28 Cl2 Fe N4 O2.5 -","- C416 H448 Cl32 Fe16 N64 O40 -","16","1","","Carlucci, Lucia; Ciani, Gianfranco; García-Ruiz, Juan Manuel; Moret, Massimo; Proserpio, Davide M.; Rizzato, Silvia","Crystallization Behavior of Coordination Polymers. 1. Kinetic and Thermodynamic Features of 1,3-Bis(4-pyridyl)propane/MCl2Systems","Crystal Growth & Design","2009","9","12","5024","","10.1021/cg900985w","","","0.71073","MoKα","","0.1839","0.1316","","","0.3889","0.4229","","","","","","1.084","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4509809","17.201","0.002","17.201","0.002","42.697","0.004","90","","90","","90","","12633","2","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C27 H34 Cl2 Mn N4 O2 -","- C27 H31 Cl2 Mn N4 O2 -","- C432 H496 Cl32 Mn16 N64 O32 -","16","1","","Carlucci, Lucia; Ciani, Gianfranco; García-Ruiz, Juan Manuel; Moret, Massimo; Proserpio, Davide M.; Rizzato, Silvia","Crystallization Behavior of Coordination Polymers. 1. Kinetic and Thermodynamic Features of 1,3-Bis(4-pyridyl)propane/MCl2Systems","Crystal Growth & Design","2009","9","12","5024","","10.1021/cg900985w","","","0.71073","MoKα","","0.1476","0.1133","","","0.2932","0.3104","","","","","","1.147","","","","has coordinates","179634","2020-10-21","18:00:00",""
"4509810","17.536","0.001","17.536","0.001","42.966","0.003","90","","90","","90","","13212.5","1.4","219","2","219","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C27 H34 Cd Cl2 N4 O2 -","- C27 H31.5 Cd Cl2 N4 O2 -","- C432 H504 Cd16 Cl32 N64 O32 -","16","1","","Carlucci, Lucia; Ciani, Gianfranco; García-Ruiz, Juan Manuel; Moret, Massimo; Proserpio, Davide M.; Rizzato, Silvia","Crystallization Behavior of Coordination Polymers. 1. Kinetic and Thermodynamic Features of 1,3-Bis(4-pyridyl)propane/MCl2Systems","Crystal Growth & Design","2009","9","12","5024","","10.1021/cg900985w","","","0.71073","MoKα","","0.1878","0.1208","","","0.3743","0.4026","","","","","","1.056","","","","has coordinates","179634","2020-10-21","18:00:00",""
"4509816","12.0789","0.0007","12.0789","0.0007","76.793","0.006","90","","90","","90","","11204.1","1.3","294","2","298","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C50 H56 Cl2 N6 O8 Pt2 S4 -","- C50 H56 Cl2 N6 O8 Pt2 S4 -","- C400 H448 Cl16 N48 O64 Pt16 S32 -","8","0.5","","Tzeng, Biing-Chiau; Chiu, Tse-Hao; Lin, Sun-Yi; Yang, Chieh-Min; Chang, Tsung-Yi; Huang, Cyong-Huei; Chang, A. Hsiu-Hua; Lee, Gene-Hsiang","Structural Isomerism of Luminescent Dinuclear Pt(II)-Thiolate Diimines","Crystal Growth & Design","2009","9","12","5356","","10.1021/cg901100z","","","0.71073","MoKα","","0.1421","0.0799","","","0.157","0.1827","","","","","","1.131","","","","has coordinates","179634","2020-10-21","18:00:00",""
"4511057","15.269","0.012","15.269","0.012","21.613","0.018","90","","90","","90","","5039","7","90","","90","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24 H20 N4 O8 S4 -","- C24 H20 N4 O8 S4 -","- C192 H160 N32 O64 S32 -","8","0.5","","Katagiri, Kosuke; Kato, Takako; Masu, Hyuma; Tominaga, Masahide; Azumaya, Isao","Pseudopolymorph and Infinite Hydrogen Bonding Network of Cyclic Oligomers ofm-Aminobenzenesulfonic Acid","Crystal Growth & Design","2009","9","3","1519","","10.1021/cg801073k","","","0.71073","MoKα","","0.1524","0.1098","","","0.2342","0.2665","","","","","","1.044","","","","has coordinates","179657","2020-10-21","18:00:00",""
"4511671","5.349","","5.349","","11.628","","90","","90","","90","","332.698","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Sodium Lanthanum Bis(tungstate)","","- La Na O8 W2 -","- La Na O8 W2 -","- La2 Na2 O16 W4 -","2","0.125","","Wang, Zijun; Zhong, Jiuping; Jiang, Haoxing; Wang, Jing; Liang, Hongbin","Controllable Synthesis of NaLu(WO4)2:Eu3+Microcrystal and Luminescence Properties for LEDs","Crystal Growth & Design","2014","14","8","3767","","10.1021/cg5001182","","","","","","0.089","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4512003","28.762","0.001","28.762","0.001","13.444","0.0005","90","","90","","90","","11121.6","0.7","120","","120","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C29 H33 Br N4 O5 -","- C29 H33 Br N4 O5 -","- C464 H528 Br16 N64 O80 -","16","1","","Ravat, Prince; Borozdina, Yulia; Ito, Yoshikazu; Enkelmann, Volker; Baumgarten, Martin","Crystal Engineering of Tolane Bridged Nitronyl Nitroxide Biradicals: Candidates for Quantum Magnets","Crystal Growth & Design","2014","14","11","5840","","10.1021/cg5010787","","","0.71073","MoKα","","0.075","0.0587","","0.1872","0.0666","0.0666","","","","","","0.984","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4513861","20.7124","0.001","20.7124","0.001","36.593","0.003","90","","90","","90","","15698.5","1.7","100","2","100","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C23 H28 O4 -","- C23 H28 O4 -","- C736 H896 O128 -","32","2","","Chen, Li-Hsun; Chung, Tsai-Wen; Narhe, Bharat D.; Sun, Chung-Ming","A Novel Mechanistic Study on Ultrasound-Assisted, One-Pot Synthesis of Functionalized Benzimidazo[2,1-b]quinazolin-1(1H)-ones.","ACS combinatorial science","2016","18","3","162","169","10.1021/acscombsci.5b00186","","","0.71073","MoKα","","0.0602","0.0427","","","0.1043","0.116","","","","","","1.008","","","","has coordinates","190287","2020-10-21","18:00:00",""
"4516077","13.7647","0.0003","13.7647","0.0003","20.651","0.0009","90","","90","","90","","3912.7","0.2","100","2","100","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C10 H12 N4 -","- C10 H12 N4 -","- C160 H192 N64 -","16","1","","Yunusova, Sevilya N.; Bolotin, Dmitrii S.; Suslonov, Vitalii V.; Vovk, Mikhail A.; Tolstoy, Peter M.; Kukushkin, Vadim Yu","3-Dialkylamino-1,2,4-triazoles via Zn<sup>II</sup>-Catalyzed Acyl Hydrazide-Dialkylcyanamide Coupling.","ACS omega","2018","3","7","7224","7234","10.1021/acsomega.8b01047","","x-ray","1.54184","CuKα","","0.0495","0.0463","","","0.1272","0.132","","","","","","1.053","","","","has coordinates","226095","2020-10-21","18:00:00",""
"4516080","14.9349","0.0004","14.9349","0.0004","20.242","0.0006","90","","90","","90","","4515","0.2","200","2","200","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C11 H14 N4 O -","- C11 H14 N4 O -","- C176 H224 N64 O16 -","16","1","","Yunusova, Sevilya N.; Bolotin, Dmitrii S.; Suslonov, Vitalii V.; Vovk, Mikhail A.; Tolstoy, Peter M.; Kukushkin, Vadim Yu","3-Dialkylamino-1,2,4-triazoles via Zn<sup>II</sup>-Catalyzed Acyl Hydrazide-Dialkylcyanamide Coupling.","ACS omega","2018","3","7","7224","7234","10.1021/acsomega.8b01047","","x-ray","1.54184","CuKα","","0.0634","0.0481","","","0.132","0.1477","","","","","","1.03","","","","has coordinates","226095","2020-10-21","18:00:00",""
"4516082","14.81904","0.00015","14.81904","0.00015","20.4674","0.0004","90","","90","","90","","4494.72","0.11","100","2","100","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C12 H14 N4 -","- C12 H14 N4 -","- C192 H224 N64 -","16","1","","Yunusova, Sevilya N.; Bolotin, Dmitrii S.; Suslonov, Vitalii V.; Vovk, Mikhail A.; Tolstoy, Peter M.; Kukushkin, Vadim Yu","3-Dialkylamino-1,2,4-triazoles via Zn<sup>II</sup>-Catalyzed Acyl Hydrazide-Dialkylcyanamide Coupling.","ACS omega","2018","3","7","7224","7234","10.1021/acsomega.8b01047","","x-ray","0.71073","MoKα","","0.0437","0.0382","","","0.0926","0.0975","","","","","","1.034","","","","has coordinates","226095","2020-10-21","18:00:00",""
"4516114","12.8106","0.0004","12.8106","0.0004","30.5131","0.001","90","","90","","90","","5007.5","0.3","100","2","100","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C48 H40 Co F12 N8 O8 P2 -","- C48 H40 Co F12 N8 O8 P2 -","- C192 H160 Co4 F48 N32 O32 P8 -","4","0.25","","Emhoff, Kylin A.; Balaraman, Lakshmi; Simpson, Sydney R.; Stromyer, Michael L.; Kalil, Haitham F.; Beemiller, James R.; Sikatzki, Philipp; Eshelman, Teya S.; Salem, Ahmed M. H.; DeBord, Michael A.; Panzner, Matthew J.; Youngs, Wiley J.; Boyd, W. Christopher","Synthesis and Characterization of Cobalt(II) <i>N</i>,<i>N</i>'-Diphenylazodioxide Complexes.","ACS omega","2018","3","11","16021","16027","10.1021/acsomega.8b01200","","","0.71073","MoKα","","0.037","0.0295","","","0.0647","0.0688","","","","","","1.053","","","","has coordinates","226120","2020-10-21","18:00:00",""
"4516259","12.15","0.002","12.15","0.002","24.405","0.002","90","","90","","90","","3602.7","0.9","98","2","98","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C6 H13 N7 O -","- C6 H13 N7 O -","- C96 H208 N112 O16 -","16","1","","Li, Peng; Arman, Hadi D.; Wang, Hailong; Weng, Linhong; Alfooty, Khalid; Angawi, Rehab F.; Chen, Banglin","Solvent Dependent Structures of Melamine: Porous or Nonporous?","Crystal Growth & Design","2015","15","4","1871","","10.1021/acs.cgd.5b00039","","","0.71073","MoKα","","0.1","0.085","","","0.1756","0.1835","","","","","","1.016","","","","has coordinates","231213","2020-10-21","18:00:00",""
"4516820","15.5848","0.0007","15.5848","0.0007","9.895","0.0005","90","","90","","90","","2403.4","0.2","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","diiodidoacetamidedicopper(I)","","- C2 H5 Cu2 I2 N S -","- C2 Cu2 I2 N S -","- C24 Cu24 I24 N12 S12 -","12","0.75","","Moreno-Moreno, Miriam; Troyano, Javier; Ares, Pablo; Castillo, Oscar; Nijhuis, Christian A.; Yuan, Li; Amo-Ochoa, Pilar; Delgado, Salomé; Gómez-Herrero, Julio; Zamora, Félix; Gómez-Navarro, Cristina","One-Pot Preparation of Mechanically Robust, Transparent, Highly Conductive, and Memristive Metal-Organic Ultrathin Film.","ACS nano","2018","12","10","10171","10177","10.1021/acsnano.8b05056","","x-ray","0.71073","MoKα","","0.0438","0.0389","","","0.1065","0.1091","","","","","","1.077","","","","has coordinates,has disorder","239568","2020-10-21","18:00:00",""
"4516821","15.6261","0.0018","15.6261","0.0018","9.9155","0.0013","90","","90","","90","","2421.1","0.5","200","2","200","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","diiodidoacetamidedicopper(I)","","- C2 H5 Cu2 I2 N S -","- C2 Cu2 I2 N S -","- C24 Cu24 I24 N12 S12 -","12","0.75","","Moreno-Moreno, Miriam; Troyano, Javier; Ares, Pablo; Castillo, Oscar; Nijhuis, Christian A.; Yuan, Li; Amo-Ochoa, Pilar; Delgado, Salomé; Gómez-Herrero, Julio; Zamora, Félix; Gómez-Navarro, Cristina","One-Pot Preparation of Mechanically Robust, Transparent, Highly Conductive, and Memristive Metal-Organic Ultrathin Film.","ACS nano","2018","12","10","10171","10177","10.1021/acsnano.8b05056","","x-ray","0.71073","MoKα","","0.055","0.0488","","","0.1293","0.1341","","","","","","1.076","","","","has coordinates,has disorder","239568","2020-10-21","18:00:00",""
"4516822","15.6634","0.0003","15.6634","0.0003","9.9466","0.0002","90","","90","","90","","2440.32","0.08","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","diiodidoacetamidedicopper(I)","","- C2 H5 Cu2 I2 N S -","- C2 Cu2 I2 N S -","- C24 Cu24 I24 N12 S12 -","12","0.75","","Moreno-Moreno, Miriam; Troyano, Javier; Ares, Pablo; Castillo, Oscar; Nijhuis, Christian A.; Yuan, Li; Amo-Ochoa, Pilar; Delgado, Salomé; Gómez-Herrero, Julio; Zamora, Félix; Gómez-Navarro, Cristina","One-Pot Preparation of Mechanically Robust, Transparent, Highly Conductive, and Memristive Metal-Organic Ultrathin Film.","ACS nano","2018","12","10","10171","10177","10.1021/acsnano.8b05056","","x-ray","0.71073","MoKα","","0.0609","0.053","","","0.1427","0.1484","","","","","","1.065","","","","has coordinates,has disorder","239568","2020-10-21","18:00:00",""
"4516823","15.5789","0.0007","15.5789","0.0007","9.8848","0.0004","90","","90","","90","","2399.06","0.18","110","2","110","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","diiodidoacetamidedicopper(I)","","- C2 H5 Cu2 I2 N S -","- C2 Cu2 I2 N S -","- C24 Cu24 I24 N12 S12 -","12","0.75","","Moreno-Moreno, Miriam; Troyano, Javier; Ares, Pablo; Castillo, Oscar; Nijhuis, Christian A.; Yuan, Li; Amo-Ochoa, Pilar; Delgado, Salomé; Gómez-Herrero, Julio; Zamora, Félix; Gómez-Navarro, Cristina","One-Pot Preparation of Mechanically Robust, Transparent, Highly Conductive, and Memristive Metal-Organic Ultrathin Film.","ACS nano","2018","12","10","10171","10177","10.1021/acsnano.8b05056","","x-ray","0.71073","MoKα","","0.0526","0.0413","","","0.1104","0.1148","","","","","","1.014","","","","has coordinates,has disorder","239568","2020-10-21","18:00:00",""
"4516824","15.6719","0.0004","15.6719","0.0004","9.9574","0.0002","90","","90","","90","","2445.62","0.1","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","diiodidoacetamidedicopper(I)","","- C2 H5 Cu2 I2 N S -","- C2 Cu2 I2 N S -","- C24 Cu24 I24 N12 S12 -","12","0.75","","Moreno-Moreno, Miriam; Troyano, Javier; Ares, Pablo; Castillo, Oscar; Nijhuis, Christian A.; Yuan, Li; Amo-Ochoa, Pilar; Delgado, Salomé; Gómez-Herrero, Julio; Zamora, Félix; Gómez-Navarro, Cristina","One-Pot Preparation of Mechanically Robust, Transparent, Highly Conductive, and Memristive Metal-Organic Ultrathin Film.","ACS nano","2018","12","10","10171","10177","10.1021/acsnano.8b05056","","x-ray","0.71073","MoKα","","0.0717","0.0472","","","0.1261","0.1352","","","","","","0.985","","","","has coordinates,has disorder","239568","2020-10-21","18:00:00",""
"4517090","45.3447","0.0007","45.3447","0.0007","11.2994","0.0003","90","","90","","90","","23233.2","0.8","122.8","0.5","122.8","0.5","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C48 H38 Cu N8 Nd2 O25 -","- C48 H38 Cu N8 Nd2 O25 -","- C768 H608 Cu16 N128 Nd32 O400 -","16","1","","Liu, Ke; Zhou, Jing-Min; Li, Hui-Min; Xu, Na; Cheng, Peng","A Series of CuII‒LnIII Metal‒Organic Frameworks Based on 2,2′-Bipyridine-3,3′-dicarboxylic Acid: Syntheses, Structures, and Magnetic Properties","Crystal Growth & Design","2014","14","12","6409","","10.1021/cg5012617","","","0.71073","MoKα","","0.0621","0.0391","","","0.0825","0.0892","","","","","","1.025","","","","has coordinates","239737","2020-10-21","18:00:00",""
"4517540","20.8825","0.0005","20.8825","0.0005","10.11","0.0003","90","","90","","90","","4408.8","0.2","100","0.1","100","0.1","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C46 H26 Br8 F4 N4 O2 -","- C46 H26 Br8 F4 N4 O2 -","- C184 H104 Br32 F16 N16 O8 -","4","0.25","","Thomas, Kolle E.; Slebodnick, Carla; Ghosh, Abhik","Facile Supramolecular Engineering of Porphyrin cis Tautomers: The Case of β-Octabromo-<i>meso</i>-tetraarylporphyrins.","ACS omega","2020","5","15","8893","8901","10.1021/acsomega.0c00517","","x-ray","0.71073","MoKα","","0.099","0.0703","","","0.1878","0.2051","","","","","","1.071","","","","has coordinates,has disorder","251428","2020-10-21","18:00:00",""
"4517992","9.9709","0.0001","9.9709","0.0001","26.4892","0.0005","90","","90","","90","","2633.53","0.06","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24 H31 In N2 O16 -","- C24 H31 In N2 O16 -","- C96 H124 In4 N8 O64 -","4","0.25","","Gao, Hui; He, Yan-Bin; Hou, Juan-Juan; Zhai, Quan-Guo; Zhang, Xian-Ming","Enhanced Proton Conductivity by Aliovalent Substitution of Cadmium for Indium in Dimethylaminium-Templated Metal Anilicates.","ACS applied materials & interfaces","2020","","","","","10.1021/acsami.0c13125","","","1.54184","CuKα","","0.0508","0.0491","","","0.1324","0.1338","","","","","","1.106","","","","has coordinates,has disorder","255825","2020-10-21","18:00:00",""
"4517993","9.3492","0.0001","9.3492","0.0001","28.4254","0.0006","90","","90","","90","","2484.59","0.06","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24 H32 Cd N2 O16 -","- C24 H32 Cd N2 O16 -","- C96 H128 Cd4 N8 O64 -","4","0.25","","Gao, Hui; He, Yan-Bin; Hou, Juan-Juan; Zhai, Quan-Guo; Zhang, Xian-Ming","Enhanced Proton Conductivity by Aliovalent Substitution of Cadmium for Indium in Dimethylaminium-Templated Metal Anilicates.","ACS applied materials & interfaces","2020","","","","","10.1021/acsami.0c13125","","","1.54178","CuKα","","0.0383","0.0362","","","0.0917","0.0931","","","","","","1.166","","","","has coordinates,has disorder","255826","2020-10-21","18:00:00",""
"4518033","24.275","0.005","24.275","0.005","18.364","0.006","90","","90","","90","","10821","5","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C39.72 H58.29 Cl4 N4 Ni2 O3.43 -","- C39.716 H58.29 Cl4 N4 Ni2 O3.429 -","- C317.728 H466.32 Cl32 N32 Ni16 O27.432 -","8","0.5","","Talukder, Md Muktadir; Cue, John Michael O.; Miller, Justin T.; Gamage, Prabhath L.; Aslam, Amina; McCandless, Gregory T.; Biewer, Michael C.; Stefan, Mihaela C.","Ligand Steric Effects of α-Diimine Nickel(II) and Palladium(II) Complexes in the Suzuki-Miyaura Cross-Coupling Reaction.","ACS omega","2020","5","37","24018","24032","10.1021/acsomega.0c03415","","","0.71073","MoKα","","0.0793","0.053","","","0.1428","0.1747","","","","","","1.268","","","","has coordinates","257065","2020-10-21","18:00:00",""
"4518517","21.5743","0.0008","21.5743","0.0008","34.449","0.002","90","","90","","90","","16034.3","1.3","296","2","296.15","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H36 N12 Ni2 O12 S2 -","- C32 H36 N12 Ni2 O12 S2 -","- C512 H576 N192 Ni32 O192 S32 -","16","1","","Zhang, Shihui; Zhang, Shuyu; Yin, Nan; Huang, Zhenqi; Xu, Wenhua; Yue, Kefen; Li, Xiuyuan; Li, Dongsheng","Exploring Reversible Thermochromic Behavior in a Rare Ni(II)-MOF System.","ACS applied materials & interfaces","2021","13","5","6430","6441","10.1021/acsami.0c21116","","","0.71073","MoKα","","0.0605","0.0394","","","0.0957","0.1063","","","","","","1.01","","","","has coordinates,has disorder","262402","2021-03-03","19:45:25",""
"4519083","15.805","0.0006","15.805","0.0006","22.386","0.003","90","","90","","90","","5592","0.8","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C14 H12 Cu2 N10 O4 -","- C14 H12 Cu2 N10 O4 -","- C112 H96 Cu16 N80 O32 -","8","0.5","","Wang, Lu; Wang, Kecheng; An, Hao-Tian; Huang, Hongliang; Xie, Lin-Hua; Li, Jian-Rong","A Hydrolytically Stable Cu(II)-Based Metal-Organic Framework with Easily Accessible Ligands for Water Harvesting.","ACS applied materials & interfaces","2021","13","41","49509","49518","10.1021/acsami.1c15240","","","1.54178","CuKα","","0.1024","0.0585","","","0.152","0.1838","","","","","","1.034","","","","has coordinates","270224","2021-11-03","20:01:24",""
"4519084","15.7354","0.0003","15.7354","0.0003","22.597","0.0006","90","","90","","90","","5595.1","0.2","265.94","0.12","265.94","0.12","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C18 H21 Cu2 N11 O5 -","- C18 H21 Cu2 N11 O5 -","- C144 H168 Cu16 N88 O40 -","8","0.5","","Wang, Lu; Wang, Kecheng; An, Hao-Tian; Huang, Hongliang; Xie, Lin-Hua; Li, Jian-Rong","A Hydrolytically Stable Cu(II)-Based Metal-Organic Framework with Easily Accessible Ligands for Water Harvesting.","ACS applied materials & interfaces","2021","13","41","49509","49518","10.1021/acsami.1c15240","","x-ray","1.54184","CuKα","","0.0937","0.0665","","","0.1762","0.198","","","","","","1.084","","","","has coordinates,has disorder","270224","2021-11-03","20:01:25",""
"4519085","15.7418","0.0002","15.7418","0.0002","22.3494","0.0006","90","","90","","90","","5538.28","0.18","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C14 H12 Cu2 N10 O11 -","- C14 H12 Cu2 N10 O11 -","- C112 H96 Cu16 N80 O88 -","8","0.5","","Wang, Lu; Wang, Kecheng; An, Hao-Tian; Huang, Hongliang; Xie, Lin-Hua; Li, Jian-Rong","A Hydrolytically Stable Cu(II)-Based Metal-Organic Framework with Easily Accessible Ligands for Water Harvesting.","ACS applied materials & interfaces","2021","13","41","49509","49518","10.1021/acsami.1c15240","","","1.54178","CuKα","","0.1098","0.07","","","0.1671","0.1885","","","","","","1.083","","","","has coordinates,has disorder","270224","2021-11-03","20:01:25",""
"4519325","28.5283","0.0013","28.5283","0.0013","13.6804","0.0006","90","","90","","90","","11134","0.9","298","","298","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C28 H23 N3 O9 Sr -","- C28 H23 N3 O9 Sr -","- C448 H368 N48 O144 Sr16 -","16","1","","Wang, Zhonghe; Zeng, Le; He, Cheng; Duan, Chunying","Metal-Organic Framework-Encapsulated Anthraquinone for Efficient Photocatalytic Hydrogen Atom Transfer.","ACS applied materials & interfaces","2022","14","6","7980","7989","10.1021/acsami.1c22872","","","0.71073","MoKα","","0.0759","0.0479","","","0.1155","0.1245","","","","","","1.147","","","","has coordinates","273235","2022-03-03","19:55:18",""
"4519372","38.087","0.004","38.087","0.004","16.6075","0.0018","90","","90","","90","","24091","4","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C54 H45 N4 O15 P4 U -","- C54 H45 N4 O15 P4 U -","- C864 H720 N64 O240 P64 U16 -","16","1","","Zhao, Hongxia; Qi, Chao; Yan, Xuewu; Ji, Jinyan; Chai, Zhifang; Wang, Shuao; Zheng, Tao","A Multifunctional Porous Uranyl Phosphonate Framework for Cyclic Utilization: Salvages, Uranyl Leaking Prevention, and Fluorescent Sensing.","ACS applied materials & interfaces","2022","14","12","14380","14387","10.1021/acsami.2c01671","","","0.71073","MoKα","","0.0452","0.0352","","","0.0922","0.0982","","","","","","1.074","","","","has coordinates","274228","2022-04-03","18:54:45",""
"5000118","5.47","0.01","5.47","0.01","12.18","0.02","90","","90","","90","","364.4","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Lead molybdate","Wulfenite","?","- Mo O4 Pb -","- Mo4 O16 Pb4 -","4","0.25","","Araki, T.","","Memoirs of the College of Science, University of Kyoto, Series B","1957","24","","155","160","","","","","","","0.2","","","","","","","","","","","","","","","has coordinates","176451","2020-10-21","18:00:00",""
"5000357","41.153","0.0006","41.153","0.0006","14.3127","0.0003","90","","90","","90","","24239.5","0.7","112","","112","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C107.4 H110.8 Br4 Cl2.8 Mn12 N6 O32 -","- C109.884 H90.768 Br4 Cl2.768 Mn12 N6 O30 -","- C879.072 H726.144 Br32 Cl22.144 Mn96 N48 O240 -","8","0.5","","Colette Boskovic; Euan K. Brechin; William E. Streib; Kirsten Folting; John C. Bollinger; David N. Hendrickson; George Christou","Single-Molecule Magnets: A New Family of Mn12 Clusters of Formula [Mn12O8X4(O2CPh)8L6]","Journal of the American Chemical Society","2002","124","","3725","3736","10.1021/ja012403k","","","0.71073","MoKα","","0.0786","0.051","","","0.1286","0.1353","","","","","","1.294","","","","has coordinates","176451","2020-10-21","18:00:00",""
"5910025","5.368","","5.368","","12.013","","90","","90","","90","","346.16","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","AgIO4","","- Ag I O4 -","- Ag8 I8 O16 -","- Ag8 I8 O16 -","","","","Wyckoff, R. W. G.","Page 64 from the second edition supplement of The Structure of Crystals by Wyckoff R W G. published by Reinhold Publishing Corporation, INC,Camden,N. J. in 1935 and page 285 from the second edition of Structure of Crystals by Wyckoff R W G.published by The Chemical Catalog Company, INC, New York in 1931","The second edition supplement of The Structure of Crystals","1935","","","64","64","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910060","5.44","","5.44","","12.01","","90","","90","","90","","355.419","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Stolzite","","- O4 Pb W -","- O16 Pb8 W8 -","- O16 Pb8 W8 -","","","","Wyckoff, R. W. G.","Page 290 from the second edition of Structure of Crystals by Wyckoff. published by The Chemical Catalog Company, INC, New York in 1931 & http://database.iem.ac.ru/mincryst/","The second edition of Structure of Crystals","1931","","","290","290","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910071","5.64","","5.64","","12.7","","90","","90","","90","","403.982","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","BaWO4","","- Ba O4 W -","- Ba8 O16 W8 -","- Ba8 O16 W8 -","","","","Wyckoff, R. W. G.","Page 64 from the second edition supplement of The Structure of Crystals by Wyckoff R W G. published by Reinhold Publishing Corporation, INC,Camden,N. J. in 1935 and page 285 from the second edition of Structure of Crystals by Wyckoff R W G.published by The Chemical Catalog Company, INC, New York in 1931","The second edition supplement of The Structure of Crystals","1935","","","64","64","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910088","5.24","","5.24","","11.38","","90","","90","","90","","312.467","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Scheelite","","- Ca O4 W -","- Ca48 O64 W48 -","- Ca48 O64 W48 -","","","","Wyckoff, R. W. G.","Pages 285 & 289 from the second edition of Structure of Crystals by Wyckoff. published by The Chemical Catalog Company, INC, New York in 1931","The second edition of Structure of Crystals","1931","","","285","289","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910093","5.56","","5.56","","12.76","","90","","90","","90","","394.458","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","BaMoO4","","- Ba Mo O4 -","- Ba8 Mo8 O16 -","- Ba8 Mo8 O16 -","","","","Wyckoff, R. W. G.","Page 289 from the second edition of Structure of Crystals by Wyckoff. published by The Chemical Catalog Company, INC, New York in 1931 & http://database.iem.ac.ru/mincryst/","The second edition of Structure of Crystals","1931","","","289","289","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910131","5.36","","5.36","","11.94","","90","","90","","90","","343.031","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","SrMoO4","","- Mo O4 Sr -","- Mo8 O16 Sr8 -","- Mo8 O16 Sr8 -","","","","Wyckoff, R. W. G.","Pages 285 & 290 from the second edition of Structure of Crystals by Wyckoff. published by The Chemical Catalog Company, INC, New York in 1931","The second edition of Structure of Crystals","1931","","","285","290","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910132","5.61","","5.61","","12.5","","90","","90","","90","","393.401","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","KReO4","","- K O4 Re -","- K48 O64 Re48 -","- K48 O64 Re48 -","","","","Wyckoff, R. W. G.","Pages 285 & 289 from the second edition of Structure of Crystals by Wyckoff. published by The Chemical Catalog Company, INC, New York in 1931","The second edition of Structure of Crystals","1931","","","285","289","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910163","5.362","","5.362","","11.718","","90","","90","","90","","336.905","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Na O4 Re -","- Na24 O128 Re24 -","- Na24 O128 Re24 -","","","","Wyckoff, R. W. G.","Pages 19-21 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","3","","19","19","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910182","5.08","","5.08","","11.7","","90","","90","","90","","301.935","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- As Bi O4 -","- As24 Bi24 O128 -","- As24 Bi24 O128 -","","","","Wyckoff, R. W. G.","Pages 19-21 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","3","","19","19","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910187","5.654","","5.654","","13.03","","90","","90","","90","","416.539","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- K O4 Tc -","- K24 O128 Tc24 -","- K24 O128 Tc24 -","","","","Wyckoff, R. W. G.","Pages 19-21 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","3","","19","19","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910190","5.16","","5.16","","10.91","","90","","90","","90","","290.485","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Nb O4 Y -","- Nb24 O128 Y24 -","- Nb24 O128 Y24 -","","","","Wyckoff, R. W. G.","Pages 19, 20 & 21 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","3","","19","21","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910194","5.374","","5.374","","12.094","","90","","90","","90","","349.273","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Ag I O4 -","- Ag24 I24 O128 -","- Ag24 I24 O128 -","","","","Wyckoff, R. W. G.","Pages 19 & 21 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","3","","19","21","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910262","5.64","","5.64","","12.7","","90","","90","","90","","403.982","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Ba O4 W -","- Ba24 O128 W24 -","- Ba24 O128 W24 -","","","","Wyckoff, R. W. G.","Pages 19-21 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","3","","19","19","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910263","5.4","","5.4","","11.9","","90","","90","","90","","347.004","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- O4 Sr W -","- O128 Sr24 W24 -","- O128 Sr24 W24 -","","","","Wyckoff, R. W. G.","Pages 19, 20 & 22 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","3","","19","22","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910315","5.339","","5.339","","11.869","","90","","90","","90","","338.325","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Na O4 Te -","- Na24 O128 Te24 -","- Na24 O128 Te24 -","","","","Wyckoff, R. W. G.","Pages 19-21 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","3","","19","19","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910328","5.921","","5.921","","13.052","","90","","90","","90","","457.58","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- I O4 Rb -","- I24 O128 Rb24 -","- I24 O128 Rb24 -","","","","Wyckoff, R. W. G.","Pages 19, 20 & 22 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","3","","19","22","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910331","5.36","","5.36","","11.94","","90","","90","","90","","343.031","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Mo O4 Sr -","- Mo24 O128 Sr24 -","- Mo24 O128 Sr24 -","","","","Wyckoff, R. W. G.","Pages 19, 20 & 22 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","3","","19","22","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910354","4.871","","4.871","","10.57","","90","","90","","90","","250.791","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Ge O4 Zr -","- Ge24 O128 Zr24 -","- Ge24 O128 Zr24 -","","","","Wyckoff, R. W. G.","Pages 19, 20 & 21 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","3","","19","21","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"6000288","11.4612","0.0008","11.4612","0.0008","8.904","0.0008","90","","90","","90","","1169.62","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C4 H8 K O12 Y -","- C4 H8 K O12 Y -","- C16 H32 K4 O48 Y4 -","4","0.25","","Bataille, T.; Auffredic, J. P.; Louer, D.","Ab initio structure determination and dehydration dynamics of YK(C2O4)(2).4H(2)O studied by X-ray powder diffraction","Chemistry of Materials","1999","11","","1559","1567","10.1021/cm981155x","","","1.5406","","","","","","","","","","","","","","","","","","has coordinates","277869","2022-09-15","09:05:59",""
"7000152","30.943","0.004","30.943","0.004","11.522","0.002","90","","90","","90","","11032","3","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C25 H35 F4 N Ni P2 -","- C24.998 H35 F4 N0.998 Ni P2 -","- C399.968 H560 F64 N15.968 Ni16 P32 -","16","1","","Burling, Suzanne; Elliott, Paul I. P.; Jasim, Naser A.; Lindup, Richard J.; McKenna, Jennifer; Perutz, Robin N.; Archibald, Stephen J.; Whitwood, Adrian C.","C-F Bond activation at Ni(0) and simple reactions of square planar Ni(II) fluoride complexes.","Dalton transactions (Cambridge, England : 2003)","2005","","22","3686","3695","10.1039/b510052f","","","0.71073","MoKα","","0.3019","0.0617","","","0.1354","0.2219","","","","","","0.955","","","","has coordinates,has disorder","179679","2020-10-21","18:00:00",""
"7000240","20.2381","0.0006","20.2381","0.0006","14.2483","0.0006","90","","90","","90","","5835.8","0.3","115","2","115","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C36 H76 Hf O16 Si8 -","- C36 H76 Hf O16 Si8 -","- C144 H304 Hf4 O64 Si32 -","4","0.25","","Pothiraja, Ramasamy; Milanov, Andrian; Parala, Harish; Winter, Manuela; Fischer, Roland A.; Devi, Anjana","Monomeric malonate precursors for the MOCVD of HfO2 and ZrO2 thin films","Dalton Transactions","2009","","4","654","","10.1039/b810528f","","","0.71073","MoKα","","0.0361","0.0265","","","0.0586","0.0622","","","","","","1.024","","","","has coordinates","179680","2020-10-21","18:00:00",""
"7000410","19.9018","0.0001","19.9018","0.0001","10.0627","0.0001","90","","90","","90","","3985.65","0.05","273","2","273","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C12 H14 Fe2 N8 O4 S2 -","- C12 H14 Fe2 N8 O4 S2 -","- C96 H112 Fe16 N64 O32 S16 -","8","0.5","","Wang, Rongming; Camacho-Fernandez, Miguel A.; Xu, Wei; Zhang, Jian; Li, Lijuan","Neutral and reduced Roussin's red salt ester [Fe2(μ-RS)2(NO)4] (R = n-Pr, t-Bu, 6-methyl-2-pyridyl and 4,6-dimethyl-2-pyrimidyl): synthesis, X-ray crystal structures, spectroscopic, electrochemical and density functional theoretical investigations","Dalton Transactions","2009","","5","777","786","10.1039/b810230a","","","0.71073","MoKα","","0.051","0.0339","","","0.077","0.0823","","","","","","0.917","","","","has coordinates","179682","2020-10-21","18:00:00",""
"7000483","15.2603","0.0001","15.2603","0.0001","16.395","0.0002","90","","90","","90","","3818.01","0.06","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C40 H10 F24 N8 -","- C40 H10 F24 N8 -","- C160 H40 F96 N32 -","4","0.25","","Gorun, Sergiu M.; Rathke, Jerome W.; Chen, Michael J.","Long-range solid-state ordering and high geometric distortions induced in phthalocyanines by small fluoroalkyl groups","Dalton Transactions","2009","","7","1095","1097","10.1039/b821000b","","","1.54178","CuKα","","0.0294","0.0275","","","0.072","0.0735","","","","","","1.037","","","","has coordinates","179682","2020-10-21","18:00:00",""
"7000603","22.5782","0.0006","22.5782","0.0006","29.4126","0.0014","90","","90","","90","","14993.8","0.9","298","2","298","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C124 H96 Cu8 Fe16 N8 O56 -","- C124 H96 Cu8 Fe16 N8 O56 -","- C496 H384 Cu32 Fe64 N32 O224 -","4","0.25","","Femoni, Cristina; Della Pergola, Roberto; Iapalucci, Maria Carmela; Kaswalder, Francesco; Riccò, Mauro; Zacchini, Stefano","Copolymerization of Fe4Cu2C(CO)12 moieties with bidentate N-ligands: synthesis and crystal structure of the [Fe4Cu2(μ6-C)(CO)12(μ-bipy)]4·8THF square tetramer and the infinite [Fe4Cu2(μ6-C)(CO)12(μ-L‒L)]∞zigzag chains","Dalton Transactions","2009","","9","1509","1511","10.1039/b821639h","","","0.71073","MoKα","","0.116","0.0489","","","0.1023","0.1344","","","","","","1.01","","","","has coordinates","179684","2020-10-21","18:00:00",""
"7000660","23.334","0.003","23.334","0.003","37.854","0.008","90","","90","","90","","20611","6","396","2","396","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C48 H75 N12 O81.5 P2 W18 -","- C48 H54 N12 O81.5 P2 W18 -","- C384 H432 N96 O652 P16 W144 -","8","0.5","","Yao, Shuang; Zhang, Zhiming; Li, Yangguang; Wang, Enbo","An extended architecture built upon the double-Dawson-type polyoxoanion","Dalton Transactions","2009","","10","1786","1791","10.1039/b813184h","","","0.71073","MoKα","","0.0928","0.0588","","","0.1308","0.1452","","","","","","0.982","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7000809","19.7575","0.0006","19.7575","0.0006","65.511","0.003","90","","90","","90","","25572.8","1.6","184","2","184","2","","","","","","","","6","I 41/a :2","-I 4ad","88","Gd4Mn2(C40H44O8S4)4(H2O)2","","","- C160 H176 Gd4 Mn2 O34 S16 -","- C160 H176 Gd4 Mn2 O34 S16 -","- C640 H704 Gd16 Mn8 O136 S64 -","4","0.25","","Bi, Yanfeng; Wang, Xiu-Teng; Wang, Bing-Wu; Liao, Wuping; Wang, Xiaofei; Zhang, Hongjie; Gao, Song; Li, Deqian","Two MnII2LnIII4 (Ln = Gd, Eu) hexanuclear compounds of p-tert-butylsulfinylcalix[4]arene","Dalton Transactions","2009","","12","2250","2254","10.1039/b817515b","","","0.71073","MoKα","","0.0499","0.0413","","","0.1147","0.1195","","","","","","1.075","","","","has coordinates","179686","2020-10-21","18:00:00",""
"7000810","19.6997","0.0008","19.6997","0.0008","65.255","0.004","90","","90","","90","","25324","2","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","(Eu4Mn2(C40H44O8S4)4(H2O)2)","","","- C160 H176 Eu4 Mn2 O34 S16 -","- C160 H176 Eu4 Mn2 O34 S16 -","- C640 H704 Eu16 Mn8 O136 S64 -","4","0.25","","Bi, Yanfeng; Wang, Xiu-Teng; Wang, Bing-Wu; Liao, Wuping; Wang, Xiaofei; Zhang, Hongjie; Gao, Song; Li, Deqian","Two MnII2LnIII4 (Ln = Gd, Eu) hexanuclear compounds of p-tert-butylsulfinylcalix[4]arene","Dalton Transactions","2009","","12","2250","2254","10.1039/b817515b","","","0.71073","MoKα","","0.056","0.043","","","0.1139","0.1204","","","","","","1.028","","","","has coordinates","179686","2020-10-21","18:00:00",""
"7000811","19.7575","0.0006","19.7575","0.0006","65.511","0.003","90","","90","","90","","25572.8","1.6","184","2","184","2","","","","","","","","7","I 41/a :2","-I 4ad","88","[Gd4 Mn2 (C40H44O8S4)4 (H2O)2] (H2O)6.28 (CHCl3)7.72","","","- C167.72 H200.28 Cl23.16 Gd4 Mn2 O40.28 S16 -","- C167.72 H183.72 Cl23.16 Gd4 Mn2 O40.28 S16 -","- C670.88 H734.88 Cl92.64 Gd16 Mn8 O161.12 S64 -","4","0.25","","Bi, Yanfeng; Wang, Xiu-Teng; Wang, Bing-Wu; Liao, Wuping; Wang, Xiaofei; Zhang, Hongjie; Gao, Song; Li, Deqian","Two MnII2LnIII4 (Ln = Gd, Eu) hexanuclear compounds of p-tert-butylsulfinylcalix[4]arene","Dalton Transactions","2009","","12","2250","2254","10.1039/b817515b","","","0.71073","MoKα","","0.1031","0.0852","","","0.251","0.2676","","","","","","1.057","","","","has coordinates","179686","2020-10-21","18:00:00",""
"7000812","19.6997","0.0008","19.6997","0.0008","65.255","0.004","90","","90","","90","","25324","2","150","2","150","2","","","","","","","","7","I 41/a :2","-I 4ad","88","[Eu4Mn2(C40H44O8S4)4(H2O)2](H2O)5.32(CHCl3)7.55","","","- C167.55 H198.19 Cl22.65 Eu4 Mn2 O39.35 S16 -","- C167.552 H183.552 Cl22.656 Eu4 Mn2 O39.32 S16 -","- C670.208 H734.208 Cl90.624 Eu16 Mn8 O157.28 S64 -","4","0.25","","Bi, Yanfeng; Wang, Xiu-Teng; Wang, Bing-Wu; Liao, Wuping; Wang, Xiaofei; Zhang, Hongjie; Gao, Song; Li, Deqian","Two MnII2LnIII4 (Ln = Gd, Eu) hexanuclear compounds of p-tert-butylsulfinylcalix[4]arene","Dalton Transactions","2009","","12","2250","2254","10.1039/b817515b","","","0.71073","MoKα","","0.108","0.0882","","","0.2715","0.2913","","","","","","1.082","","","","has coordinates","179686","2020-10-21","18:00:00",""
"7001043","20.2796","0.0016","20.2796","0.0016","11.3604","0.0005","90","","90","","90","","4672.1","0.6","100","2","100","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C56 H64 O4 -","- C56 H64 O4 -","- C224 H256 O16 -","4","0.25","","Chetcuti, Michael J.; Devoille, Aline M. J.; Othman, Amel Ben; Souane, Rachid; Thuéry, Pierre; Vicens, Jacques","Synthesis of mono-, di- and tetra-alkyne functionalized calix[4]arenes: Reactions of these multipodal ligands with dicobalt octacarbonyl to give complexes which contain up to eight cobalt atoms","Dalton Transactions","2009","","16","2999","3008","10.1039/b821144b","","","0.71073","MoKα","","0.0897","0.064","","","0.1772","0.1924","","","","","","1.067","","","","has coordinates","179688","2020-10-21","18:00:00",""
"7001569","29.948","0.004","29.948","0.004","31.765","0.008","90","","90","","90","","28489","9","223","2","223","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C62 H87 O9.5 S3.5 Sb2 -","- C59 H78 O8 S2 Sb2 -","- C944 H1248 O128 S32 Sb32 -","16","1","","Mendoza-Espinosa, Daniel; Hanna, Tracy A.","Synthesis, X-ray structures and reactivity of calix[5]arene bismuth(iii) and antimony(iii) complexes","Dalton Transactions","2009","","26","5211","5225","10.1039/b903943k","","","0.71073","MoKα","","0.1921","0.1081","","","0.2801","0.3185","","","","","","0.938","","","","has coordinates,has disorder","179713","2020-10-21","18:00:00",""
"7001589","21.671","0.0004","21.671","0.0004","19.131","0.0004","90","","90","","90","","8984.5","0.3","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C18 H14 Mn2 O6 P4 -","- C18 H14 Mn2 O6 P4 -","- C288 H224 Mn32 O96 P64 -","16","1","","Edwards, Peter G.; Hahn, F. Ekkehardt; Limon, Matthieu; Newman, Paul D.; Kariuki, Benson M.; Stasch, Andreas","Manganese complexes of phosphino-μ-phosphido ligands","Dalton Transactions","2009","","26","5115","5119","10.1039/b822870a","","","0.71073","MoKα","","0.0567","0.0401","","","0.0897","0.0968","","","","","","1.025","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7001929","31.316","0.003","31.316","0.003","14.834","0.002","90","","90","","90","","14548","3","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C70 H96 Cl4 N4 O4 Ru2 -","- C70 H96 Cl4 N4 O4 Ru2 -","- C560 H768 Cl32 N32 O32 Ru16 -","8","0.5","","Fawcett, John; Harding, Duncan A. J.; Hope, Eric G.; Singh, Kuldip; Solan, Gregory A.","N-Heterocyclic carbene-containing ruthenium difluoro complexes and their reactivity towards BF3","Dalton Transactions","2009","","34","6861","6870","10.1039/b906321h","","","0.71073","MoKα","","0.1159","0.085","","","0.1909","0.2085","","","","","","1.153","","","","has coordinates,has disorder","179717","2020-10-21","18:00:00",""
"7002216","38.557","0.006","38.557","0.006","13.363","0.003","90","","90","","90","","19866","6","291","2","291","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C96 H72 Cl6 Eu2 N18 Na2 O16 -","- C96 H72 Cl6 Eu2 N18 Na2 O16 -","- C768 H576 Cl48 Eu16 N144 Na16 O128 -","8","0.5","","Zhang, Fuli; Hou, Yanhui; Du, Chenxia; Wu, Yangjie","Synthesis, structures, photo- and electro-luminescent properties of novel oxadiazole-functionlized europium(iii) benzamide complexes","Dalton Transactions","2009","","36","7359","7367","10.1039/b906470b","","","0.71073","MoKα","","0.1355","0.0719","","","0.1433","0.1623","","","","","","1.147","","","","has coordinates","179720","2020-10-21","18:00:00",""
"7002392","13.8982","0.0006","13.8982","0.0006","22.2966","0.0011","90","","90","","90","","4306.8","0.3","293","2","","","","","","","","","synthesis as described","4","I 41/a :2","-I 4ad","88","","","","- C9 H12 N4 S -","- C9 H12 N4 S -","- C144 H192 N64 S16 -","16","1","","Pedrido, Rosa; Romero, María J.; Bermejo, Manuel R.; Martínez-Calvo, Miguel; González-Noya, Ana M.; Zaragoza, Guillermo","Coordinative trends of a tridentate thiosemicarbazone ligand: synthesis, characterization, luminescence studies and desulfurization processes","Dalton Transactions","2009","","39","8329","8340","10.1039/b908782f","","","1.5418","CuKα","","0.0492","0.0417","","","0.1123","0.1187","","","","","","1.031","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7002650","22.51","0.03","22.51","0.03","17.9","0.03","90","","90","","90","","9070","2","110","2","110","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C28 H31 B F N S -","- C28 H31 B F N S -","- C448 H496 B16 F16 N16 S16 -","16","1","","Wade, Casey R.; Gabbaï, François P.","Colorimetric turn-on sensing of fluoride ions in H2O/CHCl3 mixtures by pyridinium boranes","Dalton Transactions","2009","","42","9169","","10.1039/b913030f","","","0.71073","MoKα","","0.0839","0.0515","","","0.1126","0.129","","","","","","1","","","","has coordinates","179730","2020-10-21","18:00:00",""
"7002668","13.2184","0.0007","13.2184","","34.169","0.002","90","","90","","90","","5970.2","0.5","296","","296","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C54 H78 Cu4 N4 O11 -","- C51 H72 Cu4 N4 O9.25 -","- C204 H288 Cu16 N16 O37 -","4","0.25","","Roy, Partha; Nandi, Mahasweta; Manassero, Mario; Riccó, Mauro; Mazzani, Marcello; Bhaumik, Asim; Banerjee, Pradyot","Four μ4-oxo-bridged copper(ii) complexes: magnetic properties and catalytic applications in liquid phase partial oxidation reactions","Dalton Transactions","2009","","43","9543","9554","10.1039/b913556a","","","0.71073","Mo-Kα","","0.064","0.064","","","0.093","","","","0.979","0.979","0.979","","","","","has coordinates","179730","2020-10-21","18:00:00",""
"7003025","17.4724","0.0004","17.4724","0.0004","26.4145","0.001","90","","90","","90","","8063.9","0.4","130","","130","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C32 H66 N8 O4 Pd -","- C32 H66 N8 O4 Pd -","- C256 H528 N64 O32 Pd8 -","8","0.5","","Yuksel, Fatma; Gümüş, Gülay; Gürol, İlke; Ahsen, Vefa; Chumakov, Yurii; Jeanneau, Erwann; Luneau, Dominique","Channel architecture via self assembly of oxamide oximes complexes","Dalton Transactions","2008","","2","241","252","10.1039/b707930c","","","0.71073","MoKα","","0.0967","0.0471","","0.0725","0.0465","0.0465","","","","","","1.1258","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7003026","18.0572","0.0004","18.0572","0.0004","26.8507","0.0008","90","","90","","90","","8755","0.4","293","","293","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C18 H37 N4 O2 Pd0.5 -","- C18 H37 N4 O2 Pd0.5 -","- C288 H592 N64 O32 Pd8 -","16","1","","Yuksel, Fatma; Gümüş, Gülay; Gürol, İlke; Ahsen, Vefa; Chumakov, Yurii; Jeanneau, Erwann; Luneau, Dominique","Channel architecture via self assembly of oxamide oximes complexes","Dalton Transactions","2008","","2","241","252","10.1039/b707930c","","","0.71073","MoKα","","0.1173","0.0642","","0.0879","0.0688","0.0688","","","","","","1.1553","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7003111","42.871","0.0006","42.871","0.0006","12.3339","0.0002","90","","90","","90","","22668.8","0.6","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C43 H103 N12 O6 Ti2 -","- C43 H103 N12 O6 Ti2 -","- C688 H1648 N192 O96 Ti32 -","16","1","","Hollingsworth, Nathan; Kanna, Miki; Kociok-Köhn, Gabriele; Molloy, Kieran C.; Wongnawa, Sumpun","Synthesis and characterisation of new titanium amino-alkoxides: precursors for the formation of TiO2 materials","Dalton Transactions","2008","","5","631","641","10.1039/b712375b","","","0.71073","MoKα","","0.1065","0.0535","","","0.1152","0.14","","","","","","1.021","","","","has coordinates","179735","2020-10-21","18:00:00",""
"7003128","19.109","0.002","19.109","0.002","35.2","0.004","90","","90","","90","","12853","2","120","2","120","2","","","","","","","","4","I 41/a :2","-I 4ad","88","racemic-mer-tris(kappa$2!C3,C2'-2-phenyl-pyrido(1,2-c) imidazo-3-ylidene)iridium(iii)","racemic-mer-tris(κ^2^C3,C2'-2-phenyl-pyrido[1,2-c] imidazo-3-ylidene)iridium(III)","","- C39 H27 Ir N6 -","- C39 H27 Ir N6 -","- C624 H432 Ir16 N96 -","16","1","","Chien, Chih-Hsien; Fujita, Singo; Yamoto, Suguru; Hara, Takeshi; Yamagata, Tsuneaki; Watanabe, Masami; Mashima, Kazushi","Stepwise and one-pot syntheses of Ir(iii) complexes with imidazolium-based carbene ligands","Dalton Transactions","2008","","7","916","923","10.1039/b712901g","","","0.71075","MoKα","","0.1394","0.1137","","","0.2202","0.2301","","","","","","1.142","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7003177","11.93","0.0003","11.93","0.0003","22.554","0.0006","90","","90","","90","","3210","0.14","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C30 H22 Cl2 Cu N6 O12 -","- C30 H22 Cl2 Cu N6 O12 -","- C120 H88 Cl8 Cu4 N24 O48 -","4","0.25","","Amoroso, Angelo J.; Burrows, Miles W.; Coles, Simon J.; Haigh, Robert; Farley, Robert D.; Hursthouse, Michael B.; Jones, Mark; Malik, K. M. Abdul; Murphy, Damien M.","The synthesis and structure of terpyridine-N-oxide complexes of copper(ii) perchlorate","Dalton Transactions","2008","","4","506","513","10.1039/b713444d","","","0.71073","MoKα","","0.0492","0.0347","","","0.082","0.0891","","","","","","1.076","","","","has coordinates","179735","2020-10-21","18:00:00",""
"7003259","8.7704","0.0002","8.7704","0.0002","56.5252","0.0014","90","","90","","90","","4347.91","0.18","173","","173","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C44 H34 F12 Fe N10 P2 -","- C44 H34 F12 Fe N10 P2 -","- C176 H136 F48 Fe4 N40 P8 -","4","0.25","","Beves, Jonathon E.; Dunphy, Emma L.; Constable, Edwin C.; Housecroft, Catherine E.; Kepert, Cameron J.; Neuburger, Markus; Price, David J.; Schaffner, Silvia","Vectorial property dependence in bis{4′-(n-pyridyl)-2,2′:6′,2″-terpyridine}iron(ii) and ruthenium(ii) complexes with n = 2, 3 and 4","Dalton Transactions","2008","","3","386","","10.1039/b714970k","","","0.71073","MoKα","","0.116","0.0998","","0.059","0.0578","0.0578","","","","","","0.9421","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7003673","18.9905","0.0009","18.9905","0.0009","30.5264","0.001","90","","90","","90","","11009","0.8","180","2","180","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C60 H108 Li4 N20 Sb4 -","- C60 H108 Li4 N20 Sb4 -","- C240 H432 Li16 N80 Sb16 -","4","0.25","","García, Felipe; Less, Robert J.; Naseri, Vesal; McPartlin, Mary; Rawson, Jeremy M.; Wright, Dominic S.","π-Bonding versus oligomerisation in the aromatic anions [C6H4N2E]−: formation of the cyclic tetrameric tetraanion [C6H4N2Sb]44−","Dalton Transactions","2008","","8","997","999","10.1039/b718512j","","","0.71069","MoKα","","0.0723","0.0543","","","0.1705","0.1939","","","","","","1.256","","","","has coordinates","179740","2020-10-21","18:00:00",""
"7003782","15.2748","0.001","15.2748","0.001","24.129","0.003","90","","90","","90","","5629.8","0.9","100","2","100","2","","","","","","","synthesized","4","I 41/a :2","-I 4ad","88","Lithium 2,4,6-trimethylphenoxide dioxane","","","- C15 H23 Li O4 -","- C11 H15 Li O2 -","- C176 H240 Li16 O32 -","16","1","","Morris, J. Jacob; MacDougall, Dugald J.; Noll, Bruce C.; Henderson, Kenneth W.","Manipulation of molecular aggregation and supramolecular structure using self-assembled lithium mixed-anion complexes","Dalton Transactions","2008","","26","3429","3437","10.1039/b719565f","","x-ray","0.71073","MoKα","","0.0866","0.0709","","","0.2077","0.2159","","","","","","0.989","","","","has coordinates","179741","2020-10-21","18:00:00",""
"7003848","18.9374","0.0011","18.9374","0.0011","18.2748","0.0011","90","","90","","90","","6553.8","0.7","153","2","153","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C52 H56 Cu4 N32 O16 -","- C52 H56 Cu4 N32 O16 -","- C208 H224 Cu16 N128 O64 -","4","0.25","","Dawe, Louise N.; Thompson, Laurence K.","Complete and ‘incomplete’ [2 ×2] grids by self-assembly with a sterically hindered ditopic imidazole hydrazone ligand—structural and magnetic studies","Dalton Transactions","2008","","27","3610","3618","10.1039/b800529j","","","0.7107","MoKα","","0.0409","0.0403","","","0.1065","0.107","","","","","","1.107","","","","has coordinates","179742","2020-10-21","18:00:00",""
"7004338","20.1451","0.0004","20.1451","0.0004","12.7796","0.0005","90","","90","","90","","5186.3","0.2","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C36 H60 Co4 N8 O12 P4 -","- C36 H60 Co4 N8 O12 P4 -","- C144 H240 Co16 N32 O48 P16 -","4","0.25","","Murugavel, Ramaswamy; Shanmugan, Swaminathan","Assembling metal phosphonates in the presence of monodentate-terminal and bidentate-bridging pyridine ligands. Use of non-covalent and covalent-coordinate interactions to build polymeric metal‒phosphonate architectures","Dalton Transactions","2008","","39","5358","5367","10.1039/b805848b","","","0.71073","MoKα","","0.0853","0.0471","","","0.1028","0.1188","","","","","","1.056","","","","has coordinates","179747","2020-10-21","18:00:00",""
"7004462","12.2907","0.0003","12.2907","0.0003","28.703","0.0014","90","","90","","90","","4335.9","0.3","100","","100","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C24 H61 Cl4 N8 Ni4 O12.5 -","- C24 H52 Cl4 N8 Ni4 O8 -","- C96 H208 Cl16 N32 Ni16 O32 -","4","0.25","","Ferguson, Alan; Lawrence, Jon; Parkin, Andrew; Sanchez-Benitez, Javier; Kamenev, Konstantin V.; Brechin, Euan K.; Wernsdorfer, Wolfgang; Hill, Stephen; Murrie, Mark","Synthesis and characterisation of a Ni4 single-molecule magnet with S4 symmetry","Dalton Transactions","2008","","45","6409","6414","10.1039/b807447j","","","0.71073","MoKα","","0.0478","0.0434","","0.1331","0.1299","0.1331","","","","","","1.0037","","","","has coordinates","179748","2020-10-21","18:00:00",""
"7005405","22.8617","0.0011","22.8617","0.0011","13.8078","0.0006","90","","90","","90","","7216.7","0.6","133","2","133","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C68 H72 Cu4 N24 O16 -","- C68 H72 Cu4 N24 O16 -","- C272 H288 Cu16 N96 O64 -","4","0.25","","Klingele, Julia; Prikhod'ko, Alexander I.; Leibeling, Guido; Demeshko, Serhiy; Dechert, Sebastian; Meyer, Franc","Pyrazolate-based copper(II) and nickel(II) [2 x 2] grid complexes: protonation-dependent self-assembly, structures and properties.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2003","2013","10.1039/b701981e","","","0.71073","MoKα","","0.0421","0.0319","","","0.0731","0.0772","","","","","","1.025","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005406","22.7567","0.0009","22.7567","0.0009","13.7394","0.0007","90","","90","","90","","7115.2","0.5","133","2","133","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C68 H72 N24 Ni4 O16 -","- C68 H72 N24 Ni4 O16 -","- C272 H288 N96 Ni16 O64 -","4","0.25","","Klingele, Julia; Prikhod'ko, Alexander I.; Leibeling, Guido; Demeshko, Serhiy; Dechert, Sebastian; Meyer, Franc","Pyrazolate-based copper(II) and nickel(II) [2 x 2] grid complexes: protonation-dependent self-assembly, structures and properties.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2003","2013","10.1039/b701981e","","","0.71073","MoKα","","0.0422","0.0288","","","0.0647","0.0673","","","","","","1.006","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005407","22.8396","0.001","22.8396","0.001","13.7885","0.0007","90","","90","","90","","7192.7","0.6","133","2","133","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C68 H72 Cu2 N24 Ni2 O16 -","- C68 H72 Cu2 N24 Ni2 O16 -","- C272 H288 Cu8 N96 Ni8 O64 -","4","0.25","","Klingele, Julia; Prikhod'ko, Alexander I.; Leibeling, Guido; Demeshko, Serhiy; Dechert, Sebastian; Meyer, Franc","Pyrazolate-based copper(II) and nickel(II) [2 x 2] grid complexes: protonation-dependent self-assembly, structures and properties.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2003","2013","10.1039/b701981e","","","0.71073","MoKα","","0.045","0.0281","","","0.0574","0.0602","","","","","","1.003","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005740","13.4748","0.0009","13.4748","0.0009","53.133","0.003","90","","90","","90","","9647.4","1.1","150","2","100","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C44 H50 Au Cl N8 O5 P4 -","- C44 H50 Au Cl N8 O5 P4 -","- C352 H400 Au8 Cl8 N64 O40 P32 -","8","0.5","","Humphreys, Anthony S.; Filipovska, Aleksandra; Berners-Price, Susan J; Koutsantonis, George A.; Skelton, Brian W.; White, Allan H.","Gold(I) chloride adducts of 1,3-bis(di-2-pyridylphosphino)propane: synthesis, structural studies and antitumour activity.","Dalton transactions (Cambridge, England : 2003)","2007","","43","4943","4950","10.1039/b705008a","","","0.71073","MoKα","","0.0456","0.0287","","","0.0848","0.0921","","","","","","1.118","","","","has coordinates","188980","2020-10-21","18:00:00",""
"7006451","20.798","0.003","20.798","0.003","4.4144","0.0014","90","","90","","90","","1909.5","0.7","298","2","298","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C8 H20 Cd O4 P2 Se4 -","- C8 Cd O4 P2 Se4 -","- C32 Cd4 O16 P8 Se16 -","4","0.25","","Liu, C. W.; Lobana, Tarlok S.; Santra, Bidyut K.; Hung, Chiu-Mine; Liu, Hong-Yuan; Liaw, Ben-Jie; Wang, Ju-Chun","Coordination chemistry of Group 12 metals with phosphorodiselenoates: syntheses, structures and VT 31P NMR study of monomer-dimer exchange equilibrium.","Dalton transactions (Cambridge, England : 2003)","2006","","4","560","570","10.1039/b510728h","","","0.71073","MoKα","","0.0739","0.0509","","","0.1226","0.1317","","","","","","1.072","","","","has coordinates","179768","2020-10-21","18:00:00",""
"7006880","17.0224","0.0004","17.0224","0.0004","15.5545","0.0004","90","","90","","90","","4507.1","0.19","123","2","123","2","","","","","","","","5","I 41/a :2","-I 4ad","88","lithium 4-methoxyphenoxide pyridine","","","- C48 H48 Li4 N4 O8 -","- C48 H48 Li4 N4 O8 -","- C192 H192 Li16 N16 O32 -","4","0.25","","MacDougall, Dugald J.; Noll, Bruce C.; Kennedy, Alan R.; Henderson, Kenneth W.","4-Methoxy- and 4-cyano-substituted lithium aryloxides: electronic effects of substituents on aggregation.","Dalton transactions (Cambridge, England : 2003)","2006","","15","1875","1884","10.1039/b515011f","","","0.71073","MoKα","","0.0955","0.0452","","","0.086","0.1008","","","","","","1.019","","","","has coordinates","179772","2020-10-21","18:00:00",""
"7007063","46.8568","0.0004","46.8568","0.0004","21.7997","0.0001","90","","90","","90","","47862.5","0.6","200","2","200","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C100 H90 Ag5 B4 F16 N20 O10 -","- C100 H90 Ag5 B4 F16 N20 O10 -","- C1600 H1440 Ag80 B64 F256 N320 O160 -","16","1","","Price, Jason R.; Lan, Yanhua; Jameson, Geoffrey B.; Brooker, Sally","Control of molecular architecture by steric and electronic factors: dinuclear side-by-side vs. tetranuclear [2 x 2] grid-type silver(I) complexes.","Dalton transactions (Cambridge, England : 2003)","2006","","12","1491","1494","10.1039/b516997f","","","0.71073","MoKα","","0.1066","0.0671","","","0.1926","0.2125","","","","","","1.099","","","","has coordinates,has disorder","179774","2020-10-21","18:00:00",""
"7007341","26.4622","0.0016","26.4622","0.0016","11.2432","0.0006","90","","90","","90","","7873","0.8","110","2","110","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C15 H24 K O2 P S3 -","- C15 H24 K O2 P S3 -","- C240 H384 K16 O32 P16 S48 -","16","1","","Shi, Weifeng; Shafaei-Fallah, Maryam; Anson, Christopher E.; Rothenberger, Alexander","Metal thiophosphonates and related compounds: an emerging area of supramolecular coordination chemistry.","Dalton transactions (Cambridge, England : 2003)","2006","","26","3257","3262","10.1039/b603764j","","","0.71073","MoKα","","0.1233","0.0917","","","0.2527","0.2778","","","","","","1.057","","","","has coordinates","212870","2020-10-21","18:00:00",""
"7007406","37.98","0.005","37.98","0.005","13.689","0.003","90","","90","","90","","19746","6","150","2","150","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C40 H59 Ga K Mn N4 O2 -","- C40 H59 Ga K Mn N4 O2 -","- C640 H944 Ga16 K16 Mn16 N64 O32 -","16","1","","Aldridge, Simon; Baker, Robert J.; Coombs, Natalie D.; Jones, Cameron; Rose, Richard P.; Rossin, Andrea; Willock, David J.","Complexes of a gallium heterocycle with transition metal dicyclopentadienyl and cyclopentadienylcarbonyl fragments, and with a dialkylmanganese compound.","Dalton transactions (Cambridge, England : 2003)","2006","","27","3313","3320","10.1039/b604640a","","","0.71073","MoKα","","0.113","0.0709","","","0.1606","0.1758","","","","","","1.102","","","","has coordinates","179778","2020-10-21","18:00:00",""
"7007620","23.5091","0.0009","23.5091","0.0009","28.5786","0.0006","90","","90","","90","","15794.8","0.9","173","2","173","2","","","","","","","synthesis as described","7","I 41/a :2","-I 4ad","88","","","","- C22 H56 Cl6 In2 N4 O3.5 Sn2 -","- C22 H56 Cl6 In2 N4 O3.5 Sn2 -","- C352 H896 Cl96 In32 N64 O56 Sn32 -","16","1","","Cheng, Yanxiang; Doyle, David J.; Hitchcock, Peter B.; Lappert, Michael F.","The beta-dialdiminato ligand [{N(C6H3Pri(2)-2,6)C(H)}2CPh]-: the conjugate acid and Li, Al, Ga and In derivatives.","Dalton transactions (Cambridge, England : 2003)","2006","","37","4449","4460","10.1039/b607782j","","x-ray","0.71073","MoKα","","0.0959","0.0504","","","0.0785","0.0905","","","","","","1.028","","","","has coordinates","179780","2020-10-21","18:00:00",""
"7007634","19.714","0.0008","19.714","0.0008","30.131","0.0017","90","","90","","90","","11710.2","0.9","243","2","243","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C42 H68 B2 Cd N12 S6 -","- C42 H68 B2 Cd N12 S6 -","- C336 H544 B16 Cd8 N96 S48 -","8","0.5","","Melnick, Jonathan G.; Parkin, Gerard","Methyl and arylchalcogenolate complexes of cadmium in a sulfur rich coordination environment: syntheses and structural characterization of the tris(2-mercapto-1-tert-butylimidazolyl)hydroborato cadmium complexes [Tm(Bu(t))]CdMe, and [Tm(Bu(t))]CdEAr (E = O, S, Se, Te) and analysis of the bonding in chalcogenolate compounds.","Dalton transactions (Cambridge, England : 2003)","2006","","35","4207","4210","10.1039/b607916d","","","0.71073","MoKα","","0.0887","0.0566","","","0.1937","0.2122","","","","","","1.065","","","","has coordinates","179780","2020-10-21","18:00:00",""
"7007838","10.9223","","10.9223","","34.2519","0.0039","90","","90","","90","","4086.1","0.5","130","2","130","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C12 H22 Cl4 N4 O2 Pt -","- C12 H22 Cl4 N4 O2 Pt -","- C96 H176 Cl32 N32 O16 Pt8 -","8","0.5","","Jamal Lasri; M. Adília Januário Charmier; M. Fátima C. Guedes da Silva; Armando J. L. Pombeiro","Direct synthesis of (imine)platinum(ii) complexes by iminoacylation of ketoximes with activated organonitrile ligands","Dalton Transactions","2006","","42","5062","","10.1039/b611341a","","","0.71069","MoKα","","0.0681","0.0342","","","0.0819","0.0934","","","","","","1.061","","","","has coordinates","179782","2020-10-21","18:00:00",""
"7007944","41.2744","0.0013","41.2744","0.0013","13.2831","0.0006","90","","90","","90","","22628.8","1.4","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C54 H72 N6 O13 Zn2 -","- C54 H71 N6 O13 Zn2 -","- C864 H1136 N96 O208 Zn32 -","16","1","","Fontecha, Julia Barreira; Goetz, Sandrine; McKee, Vickie","Dinuclear complexes of a pseudocalixarene macrocycle: structural consequences of intramolecular hydrogen bonding.","Dalton transactions (Cambridge, England : 2003)","2005","","5","923","929","10.1039/b413639j","","","0.71073","MoKα","","0.0686","0.051","","","0.143","0.1521","","","","","","1.231","","","","has coordinates,has disorder","179783","2020-10-21","18:00:00",""
"7008176","19.8716","0.0008","19.8716","0.0008","29.6313","0.0017","90","","90","","90","","11700.8","0.9","190","2","190","2","","","","","","","","7","I 41/a :2","-I 4ad","88","(tris(2-aminoethyl)amine)-cobalt(iii)(N,N'-bis(2- Hydroxyiminopropionyl) propane-1,3-diamine)-copper(ii) nitrate lithium nitrate pentahydrate methanol solvate","(tris(2-aminoethyl)amine)-cobalt(III)(N,N'-bis(2-Hydroxyiminopropionyl) propane-1,3-diamine)-copper(II) nitrate lithium nitrate pentahydrate methanol solvate","","- C15 H42.5 Co Cu Li0.25 N9.25 O14 -","- C15 H35 Co Cu Li0.25 N9 O14.25 -","- C240 H560 Co16 Cu16 Li4 N144 O228 -","16","1","","Kanderal, Olga M.; Kozlowski, Henryk; Dobosz, Agnieszka; Swiatek-Kozlowska, Jolanta; Meyer, Franc; Fritsky, Igor O.","Effect of metal ionic radius and chelate ring alternation motif on stabilization of trivalent nickel and copper in binuclear complexes with double cis-oximato bridges.","Dalton transactions (Cambridge, England : 2003)","2005","","8","1428","1437","10.1039/b418598f","","","0.71073","MoKα","","0.07","0.0454","","","0.1118","0.1268","","","","","","1.13","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008644","13.855","0.001","13.855","0.001","29.57","0.009","90","","90","","90","","5676.3","1.8","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24 H16 Cl8 Co3 O4 -","- C24 H16 Cl8 Co3 O4 -","- C192 H128 Cl64 Co24 O32 -","8","0.5","","Braga, Dario; Polito, Marco; Giaffreda, Stefano L.; Grepioni, Fabrizia","Novel organometallic building blocks for molecular crystal engineering. Part 4. Synthesis and characterization of mono- and bis-amido derivatives of [Co(III)(eta5-C5H4COOH)2]+ and their utilization as ligands.","Dalton transactions (Cambridge, England : 2003)","2005","","16","2766","2773","10.1039/b505521k","","","0.71073","MoKα","","0.049","0.0442","","","0.1229","0.1273","","","","","","1.043","","","","has coordinates,has disorder","179790","2020-10-21","18:00:00",""
"7008777","17.752","0.001","17.752","0.001","29.372","0.001","90","","90","","90","","9256.1","0.8","198","2","198","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C28 H32 Eu2 N15 Na O21 -","- C28 H32 Eu2 N15 Na O21 -","- C224 H256 Eu16 N120 Na8 O168 -","8","0.5","","Albrecht, Markus; Osetska, Olga; Fröhlich, Roland","2-[(8-Hydroxyquinolinyl)methylene]hydrazinecarboxamide: expanding the coordination sphere of 8-hydroxyquinoline for coordination of rare-earth metal(iii) ions","Dalton Transactions","2005","","23","3757","","10.1039/b507621h","","","0.71073","MoKα","","0.0769","0.0483","","","0.1226","0.1354","","","","","","1.057","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7008818","10.661","0.0011","10.661","0.0011","23.5","0.002","90","","90","","90","","2670.9","0.5","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","Cadmium (ii) bis-nitrate-bis-pyrazine","Cadmium (II) bis-nitrate-bis-pyrazine","","- C8 H8 Cd N6 O6 -","- C8 H8 Cd N6 O6 -","- C64 H64 Cd8 N48 O48 -","8","0.5","","Barnett, Sarah A.; Blake, Alexander J.; Champness, Neil R.; Wilson, Claire","Structural diversity in two-dimensional coordination polymers constructed from simple building-blocks; a rare example of coordination polymer polymorphs structurally characterised from multiple crystals.","Dalton transactions (Cambridge, England : 2003)","2005","","24","3852","3861","10.1039/b509294a","","","0.71073","MoKα","","0.0317","0.029","","","0.0707","0.0724","","","","","","1.105","","","","has coordinates","179792","2020-10-21","18:00:00",""
"7009134","13.737","0.002","13.737","0.002","16.131","0.003","90","","90","","90","","3044","0.8","295","","295","","","","","","","","chemical synthesis","6","I 41/a :2","-I 4ad","88","","","","- C20 H28 Cl2 Co N12 O12 -","- C20 H28 Cl2 Co N12 O12 -","- C80 H112 Cl8 Co4 N48 O48 -","4","0.25","","De Munno, Giovanni; Medaglia, Marcella; Armentano, Donatella; Anastassopoulou, Jane; Theophanides, Theophilos","New supramolecular complexes of manganese(II) and cobalt(II) with nucleic bases. Crystal structures of [M(H2O)6(1-Mecyt)6][ClO4]2·H2O, [Co(1-Mecyt)4][ClO4]2 and [M(H2O)4(cyt)2][ClO4]2·2cyt·2H2O [M = CoII or MnII; cyt = cytosine; 1-Mecyt = 1-methylcytosine]","Journal of the Chemical Society, Dalton Transactions","2000","","10","1625","","10.1039/a908901b","","","0.71073","MoKα","","5.98","4.69","","7.96","6.8","","","","","1.29","1.29","","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7009603","19.347","0.001","19.347","0.001","17.7404","0.0007","90","","90","","90","","6640.3","0.6","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C32 H40 Cd N6 O6 -","- C32 H40 Cd N6 O6 -","- C256 H320 Cd8 N48 O48 -","8","0.5","","Plater, M. John; Foreman, Mark R. St. J.; Gelbrich, Thomas; Coles, Simon J.; Hursthouse, Michael B.","Synthesis and characterisation of infinite co-ordination networks from flexible dipyridyl ligands and cadmium salts †","Journal of the Chemical Society, Dalton Transactions","2000","","18","3065","","10.1039/b002251i","","","0.71073","MoKα","","0.1707","0.0543","","","0.1197","0.1399","","","","","","0.969","","","","has coordinates,has disorder","179800","2020-10-21","18:00:00",""
"7009988","10.626","0.003","10.626","0.003","25.718","0.003","90","","90","","90","","2903.9","1.2","296.2","","","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C28 H16 B Cu F4 N4 -","- C28 H16 B Cu F4 N4 -","- C112 H64 B4 Cu4 F16 N16 -","4","0.25","","Maekawa, Masahiko; Konaka, Hisashi; Suenaga, Yusaku; Kuroda-Sowa, Takayoshi; Munakata, Megumu","A variety of one-, two- and three-dimensional copper(I) and silver(I) co-ordination polymers assembled by 1,4-bis(4-pyridyl)butadiyne and 1,4-bis(2-pyridyl)butadiyne","Journal of the Chemical Society, Dalton Transactions","2000","","22","4160","4166","10.1039/b005006g","","","0.7107","MoKa","","","0.093","","","","0.2968","","","","","","0.957","","","","has coordinates","275130","2022-05-06","18:53:41",""
"7010095","33.134","0.0016","33.134","0.0016","14.415","0.0004","90","","90","","90","","15825.7","1.2","180","2","180","2","","","","","","","","6","I 41/a :2","-I 4ad","88","rs9944","","","- C38 H50 Al2 Li2 N2 O2 -","- C38 H50 Al2 Li2 N2 O2 -","- C608 H800 Al32 Li32 N32 O32 -","16","1","","Armstrong, David R.; Davies, Robert P.; Linton, David J.; Schooler, Paul; Shields, Gregory P.; Snaith, Ronald; Wheatley, Andrew E. H.","Selective oxygen capture by lithium aluminates: a solid state and theoretical structural study †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4304","","10.1039/b005897l","","","0.7107","MoKα","","0.1574","0.0926","","","0.2474","0.2922","","","","","","1.042","","","","has coordinates,has disorder","179804","2020-10-21","18:00:00",""
"7010153","17.327","0.003","17.327","0.003","7.7288","0.0016","90","","90","","90","","2320.4","0.7","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","{[Cu(4-apy)2]BF4}n","Copper(I) trans-4,4-azobis(pyridine) tetrafluoroborate complex","","- C20 H16 B Cu F4 N8 -","- C20 H16 B Cu F4 N8 -","- C80 H64 B4 Cu4 F16 N32 -","4","0.25","","Withersby, Matthew A.; Blake, Alexander J.; Champness, Neil R.; Cooke, Paul A.; Hubberstey, Peter; Realf, Annabel L.; Teat, Simon J.; Schröder, Martin","Engineering of co-ordination polymers of trans-4,4'-azobis(pyridine) and trans-1,2-bis(pyridin-4-yl)ethene: a range of interpenetrated network motifs","Journal of the Chemical Society, Dalton Transactions","2000","","19","3261","","10.1039/b006543i","","","0.71073","MoKα","","0.0576","0.0453","","","0.1162","0.126","","","","","","1.105","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7010229","22.3175","0.0007","22.3175","0.0007","21.0429","0.001","90","","90","","90","","10480.9","0.7","213","2","213","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Cobalt(II) Benzoate bis(3,3',5,5'-Tetramethyl-4,4'-bipyrazolyl), bis(Bromobenzene) clathrate","","- C46 H48 Br2 Co N8 O4 -","- C46 H38 Br2 Co N8 O4 -","- C368 H304 Br16 Co8 N64 O32 -","8","0.5","","Boldog, Ishtvan; Rusanov, Eduard B.; Chernega, Alexander N.; Sieler, Joachim; Domasevitch, Konstantin V.","Coordination polymers of CoII and 3,3',5,5'-tetramethyl-4,4'-bipyrazolyl: a novel metal‒organic three-dimensional network with four-coordinated planar vertices","Journal of the Chemical Society, Dalton Transactions","2001","","6","893","","10.1039/b007183h","","","0.71073","MoKα","","0.1215","0.0689","","0.2973","0.1848","","","","1.159","1.274","1.274","","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010270","34.337","0.005","34.337","0.005","11.335","0.002","90","","90","","90","","13364","4","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C35 H38 Cl Fe N Pd -","- C35 H34 Cl Fe N Pd -","- C560 H544 Cl16 Fe16 N16 Pd16 -","16","1","","Benito, Mónica; López, Concepción; Morvan, Xavier; Solans, Xavier; Font-Bardía, Mercè","A comparative study of the reactivity of the σ(Pd‒Csp2, ferrocene) and σ(Pd‒Csp2, biphenyl) bonds in cyclopalladated complexes derived from [Fe(η5-C5H5)(η5-C5H4CHNC6H4C6H5-2)]","Journal of the Chemical Society, Dalton Transactions","2000","","23","4470","","10.1039/b007537j","","","0.71069","MoKα","","0.1134","0.0365","","0.1397","0.078","","","","0.958","1.044","1.044","","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010615","20.698","0.002","20.698","0.002","33.803","0.003","90","","90","","90","","14481","2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C34.5 H32 Cl5 Co N5 -","- C34.5 H32 Cl5 Co N5 -","- C552 H512 Cl80 Co16 N80 -","16","1","","Britovsek, George J. P.; Gibson, Vernon C.; Kimberley, Brian S.; Mastroianni, Sergio; Redshaw, Carl; Solan, Gregory A.; White, Andrew J. P.; Williams, David J.","Bis(imino)pyridyl iron and cobalt complexes: the effect of nitrogen substituents on ethylene oligomerisation and polymerisation","Journal of the Chemical Society, Dalton Transactions","2001","","10","1639","","10.1039/b101173l","","","0.71073","MoKα","","0.1141","0.0581","","0.1461","0.1177","","","","0.994","1.085","1.085","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7010665","21.3363","0.0005","21.3363","0.0005","15.5207","0.0006","90","","90","","90","","7065.6","0.4","200","1","200","1","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C34 H28 Br4 N8 O14 Re4 -","- C34 H28 Br4 N8 O14 Re4 -","- C136 H112 Br16 N32 O56 Re16 -","4","0.25","","T. Rajendran; Bala Manimaran; Fang-Yuan Lee; Po-Jui Chen; Su-Ching Lin; Gene-Hsiang Lee; Shie-Ming Peng; Yu-Ju Chen; Kuang-Lieh Lu","Self-assembly of tetrametallic square [Re4(CO)12Br4(μ-pz)4] (pz = pyrazine) from [Re(CO)4Br(pz)]. A mechanistic approach","J. Chem. Soc., Dalton Trans.","2001","","22","3346","3351","10.1039/b101992i","","","0.71073","MoKα","","0.0713","0.0483","","","0.1404","0.1674","","","","","","1.088","","","","has coordinates,has disorder","179810","2020-10-21","18:00:00",""
"7010875","32.088","0.007","32.088","0.007","13.126","0.003","90","","90","","90","","13515","5","203","2","203","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C34 H42 N S4 Ta -","- C34 H42 N S4 Ta -","- C544 H672 N16 S64 Ta16 -","16","1","","Carmalt, Claire J.; Dinnage, Christopher W.; Parkin, Ivan P.; White, Andrew J. P.; Williams, David J.","Thiolate derivatives of titanium(iv) and tantalum(v) as precursors to metal sulfides","Journal of the Chemical Society, Dalton Transactions","2001","","18","2554","","10.1039/b104888k","","","0.71073","MoKα","","0.0605","0.0373","","0.08","0.0694","","","","1.013","1.064","1.064","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7010918","26.647","0.004","26.647","0.004","12.85","0.003","90","","90","","90","","9124","3","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","dodecakis(μ^3^-Oxo)-hexadecakis(μ^2^-bromoacetato)-tetra-aqua- tetra-manganese(iv)-octa-manganese(iii) tetra-dichloromethane solvate","","- C36 H48 Br16 Cl8 Mn12 O48 -","- C36 H40 Br16 Cl8 Mn12 O48 -","- C144 H160 Br64 Cl32 Mn48 O192 -","4","0.25","","An, Jin; Chen, Zhi-Da; Zhang, Xi-Xiang; Raubenheimer, Helgard G.; Esterhuysen, Catharine; Gao, Song; Xu, Guang-Xian","Synthesis, X-ray characterization and single molecule magnetic behaviour of [Mn12O12(O2CCH2X)16(H2O)4]·mCH2Cl2·nH2O (1: X = Cl, m = 2, n = 6; 2: X = Br, m = 4, n = 0)","Journal of the Chemical Society, Dalton Transactions","2001","","22","3352","","10.1039/b105258f","","","0.71073","MoKα","","0.1101","0.074","","","0.1992","0.2241","","","","","","1.039","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7011205","17.4276","0.0015","17.4276","0.0015","21.3445","0.0019","90","","90","","90","","6482.8","1","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C68 H56 Cu2 Mo N4 P4 S4 -","- C68 H56 Cu2 Mo N4 P4 S4 -","- C272 H224 Cu8 Mo4 N16 P16 S16 -","4","0.25","","Niu, Yun-Yin; Chen, Tian-Niu; Liu, Shi-Xiong; Song, Ying-Lin; Wang, Yu-Xiao; Xue, Zi-Ling; Xin, Xin-Quan","Reactivity of the [MoS4Cu6Br8]4‒ anion toward polyarylphosphorus ligands: synthesis, characterization and nonlinear optical properties of [MoS4(Cudppf)2]·2DMF·CH3CN and [MoS4Cu2(Ph2PPy)4]","Journal of the Chemical Society, Dalton Transactions","2002","","9","1980","","10.1039/b109103d","","","0.71073","MoKα","","0.0716","0.0329","","","0.0833","0.1025","","","","","","0.482","","","","has coordinates","179816","2020-10-21","18:00:00",""
"7011348","26.174","0.0009","26.174","0.0009","9.5139","0.0005","90","","90","","90","","6517.8","0.5","183.2","","183.2","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C34 H34 Br2 N6 Pd -","- C34 H34 Br2 N6 Pd0.5 -","- C272 H272 Br16 N48 Pd4 -","8","0.5","","Gründemann, Stephan; Albrecht, Martin; Kovacevic, Anes; Faller, Jack W.; Crabtree, Robert H.","Bis-carbene complexes from oxidative addition of imidazolium C‒H bonds to palladium(0)","Journal of the Chemical Society, Dalton Transactions","2002","","10","2163","","10.1039/b110964b","","","0.7107","MoKα","","0.0744","0.0297","","0.048","","0.033","","","0.832","","","0.78","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7011437","10.797","0.003","10.797","0.003","30.419","0.012","90","","90","","90","","3546","2","163","2","163","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C24 H40 Cl4 Co2 N8 O8 Zn -","- C24 H40 Cl4 Co2 N8 O8 Zn -","- C96 H160 Cl16 Co8 N32 O32 Zn4 -","4","0.25","","Browne, Julian M. W.; Wikaira, Jan; Fitchett, Christopher M.; Hartshorn, Richard M.","Polydentate ligand construction: intramolecular condensation reactions in the synthesis of imine-containing ligands","Journal of the Chemical Society, Dalton Transactions","2002","","10","2227","","10.1039/b111556a","","","0.71073","MoKα","","0.0264","0.0211","","","0.0567","0.0579","","","","","","1.109","","","","has coordinates","179818","2020-10-21","18:00:00",""
"7011509","22.375","0.003","22.375","0.003","27.148","0.003","90","","90","","90","","13591","3","296.2","","296.2","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C33 H48 Ir2 O2 S3 -","- C32 H40 Ir2 O2.76 S3 -","- C512 H640 Ir32 O44.16 S48 -","16","1","","Takagi, Fusao; Seino, Hidetake; Hidai, Masanobu; Mizobe, Yasushi","Nucleophilic addition and substitution reactions on the sulfur atoms bound to two Ir atoms. Conversion of a hydrosulfido complex [(??5-C5Me5)2Ir2(??-SH)3]Cl into a series of diiridium complexes with bridging thiolato ligands","Journal of the Chemical Society, Dalton Transactions","2002","","18","3603","","10.1039/b200689h","","","0.7107","MoKα","","0.0389","0.0389","","","0.0389","0.0389","","","","","","1.319","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7011556","8.0693","0.0006","8.0693","0.0006","24.7868","0.0013","90","","90","","90","","1613.96","0.19","133","2","133","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Tetrakis(isopropoxy)germane","","- C12 H28 Ge O4 -","- C12 H28 Ge O4 -","- C48 H112 Ge4 O16 -","4","0.25","","Mitzel, Norbert W.; Vojinović, Krunoslav","(4+4)-Coordinate germanium atoms in tetrakis(dialkylaminoxy)germanes","Journal of the Chemical Society, Dalton Transactions","2002","","11","2341","","10.1039/b201472f","","","0.71073","MoKα","","0.0382","0.0355","","","0.0838","0.086","","","","","","1.065","","","","has coordinates","179819","2020-10-21","18:00:00",""
"7012942","18.8111","0.0001","18.8111","0.0001","38.354","0.0004","90","","90","","90","","13571.8","0.17","143","2","143","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C42 H60 Br2 Ga4 N12 S5 -","- C42 H60 Br2 Ga4 N12 S5 -","- C336 H480 Br16 Ga32 N96 S40 -","8","0.5","","Nogai, Stefan D.; Schmidbaur, Hubert","Preparation and structure of soluble complexes of the ternary compounds GaSBr and GaSeBr","Dalton Transactions","2003","","12","2488","","10.1039/b302815a","","","0.71073","MoKα","","0.0532","0.0503","","","0.1447","0.148","","","","","","1.091","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7013037","24.3007","0.0012","24.3007","0.0012","20.5467","0.0011","90","","90","","90","","12133.3","1.1","180","2","180","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C110 H128 Mn8 N24 O16 -","- C104 H99.92 Mn8 N24 O16 -","- C416 H399.68 Mn32 N96 O64 -","4","0.25","","Carmen Soria Alvarez; Alan Bashall; Andrew D. Bond; Dale Cave; Eilís A. Harron; Richard A. Layfield; Marta E. G. Mosquera; Mary McPartlin; Jeremy M. Rawson; Paul T. Wood; Dominic S. Wright","Applications of manganocene in the synthesis of Mn(II) amide and imide cages","Dalton Trans.","2003","","15","3002","3008","10.1039/b303727b","","","0.71069","MoKα","","0.1067","0.0592","","0.2008","0.1402","","","","1.027","1.11","1.11","","","","","has coordinates","179834","2020-10-21","18:00:00",""
"7013038","23.6528","0.0008","23.6528","0.0008","20.707","0.0006","90","","90","","90","","11584.6","0.6","180","2","180","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C110 H128 Mn8 N24 O8 -","- C104 H99.92 Mn8 N24 O8 -","- C416 H399.68 Mn32 N96 O32 -","4","0.25","","Carmen Soria Alvarez; Alan Bashall; Andrew D. Bond; Dale Cave; Eilís A. Harron; Richard A. Layfield; Marta E. G. Mosquera; Mary McPartlin; Jeremy M. Rawson; Paul T. Wood; Dominic S. Wright","Applications of manganocene in the synthesis of Mn(II) amide and imide cages","Dalton Trans.","2003","","15","3002","3008","10.1039/b303727b","","","0.71069","","","0.099","0.0571","","0.1993","0.149","","","","1.036","1.122","1.122","","","","","has coordinates","179834","2020-10-21","18:00:00",""
"7013228","38.638","0.003","38.638","0.003","13.102","0.004","90","","90","","90","","19560","6","183","2","183","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","dppcbS4","","- C55.5 H48 P4 S4 -","- C55.5 H44 P4 S4 -","- C888 H704 P64 S64 -","16","1","","Thomas Stampfl; Rene Gutmann; Georg Czermak; Christoph Langes; Alexander Dumfort; Holger Kopacka; Karl-Hans Ongania; Peter Brüggeller","Regioselective versus complete chalcogen transfer reactions of the bis(bidentate) phosphine cis,trans,cis-1,2,3,4-tetrakis(diphenylphosphino)cyclobutane: full characterization of new, hemilabile ligands and their complexes with palladium(II) and platinum(II)","Dalton Trans.","2003","","17","3425","3435","10.1039/b305775e","","","0.71073","MoKα","","0.1298","0.0436","","","0.0993","0.1267","","","","","","0.996","","","","has coordinates","179836","2020-10-21","18:00:00",""
"7013229","38.73","0.003","38.73","0.003","13.281","0.002","90","","90","","90","","19922","4","183","2","183","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","dppcbSe4","","- C55.5 H48 P4 Se4 -","- C56.25 H44 P4 Se4 -","- C900 H704 P64 Se64 -","16","1","","Thomas Stampfl; Rene Gutmann; Georg Czermak; Christoph Langes; Alexander Dumfort; Holger Kopacka; Karl-Hans Ongania; Peter Brüggeller","Regioselective versus complete chalcogen transfer reactions of the bis(bidentate) phosphine cis,trans,cis-1,2,3,4-tetrakis(diphenylphosphino)cyclobutane: full characterization of new, hemilabile ligands and their complexes with palladium(II) and platinum(II)","Dalton Trans.","2003","","17","3425","3435","10.1039/b305775e","","","0.71073","MoKα","","0.0591","0.0474","","","0.06","0.0848","","","","","","1.058","","","","has coordinates","179836","2020-10-21","18:00:00",""
"7013230","38.688","0.001","38.688","0.001","13.1777","0.0003","90","","90","","90","","19723.9","0.8","213","2","213","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","trans-dppcbSe2S2","","- C55.5 H48 P4 S2 Se2 -","- C55.5 H44 P4 S2 Se2 -","- C888 H704 P64 S32 Se32 -","16","1","","Thomas Stampfl; Rene Gutmann; Georg Czermak; Christoph Langes; Alexander Dumfort; Holger Kopacka; Karl-Hans Ongania; Peter Brüggeller","Regioselective versus complete chalcogen transfer reactions of the bis(bidentate) phosphine cis,trans,cis-1,2,3,4-tetrakis(diphenylphosphino)cyclobutane: full characterization of new, hemilabile ligands and their complexes with palladium(II) and platinum(II)","Dalton Trans.","2003","","17","3425","3435","10.1039/b305775e","","","0.71073","MoKα","","0.0689","0.0425","","","0.0879","0.0953","","","","","","1.026","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7013500","22.068","0.004","22.068","0.004","14.406","0.005","90","","90","","90","","7016","3","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C15 H15 Ag Cl N3 O5 S -","- C15 H15 Ag Cl N3 O5 S -","- C240 H240 Ag16 Cl16 N48 O80 S16 -","16","1","","Song, Rui-Feng; Xie, Ya-Bo; Li, Jian-Rong; Bu, Xian-He","Formation of novel discrete silver(i) coordination architectures with quinoline-based monothioethers: adjusting the intramolecular Ag?Ag distances and complex structures by ligands modifications and variations of counter anions","Dalton Transactions","2003","","24","4742","","10.1039/b309176g","","","0.71073","MoKα","","0.0767","0.0396","","","0.0823","0.0953","","","","","","1.046","","","","has coordinates,has disorder","179839","2020-10-21","18:00:00",""
"7014094","19.4434","0.0012","19.4434","0.0012","29.922","0.004","90","","90","","90","","11311.9","1.8","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C48 H74 B2 Co N12 S6 -","- C42 H68 B2 Co N12 S6 -","- C336 H544 B16 Co8 N96 S48 -","8","0.5","","Mihalcik, David J.; White, Jennifer L.; Tanski, Joseph M.; Zakharov, Lev N.; Yap, Glenn P. A.; Incarvito, Christopher D.; Rheingold, Arnold L.; Rabinovich, Daniel","Cobalt tris(mercaptoimidazolyl)borate complexes: synthetic studies and the structure of the first cobaltaboratrane.","Dalton transactions (Cambridge, England : 2003)","2004","","10","1626","1634","10.1039/b401056f","","","0.71073","MoKα","","0.0579","0.0407","","","0.0992","0.1059","","","","","","0.977","","","","has coordinates","179844","2020-10-21","18:00:00",""
"7014695","15.6452","0.0005","15.6452","0.0005","15.9953","0.0006","90","","90","","90","","3915.2","0.2","100.1","","100.1","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C21 H33 Br4 Cl3 Cu6 N4 S8 -","- C21 H32 Br4 Cl3 Cu6 N4 S8 -","- C84 H128 Br16 Cl12 Cu24 N16 S32 -","4","0.25","","Okubo, Takashi; Tanaka, Naoya; Kim, Kyung Ho; Anma, Haruho; Seki, Shu; Saeki, Akinori; Maekawa, Masahiko; Kuroda-Sowa, Takayoshi","Crystal structure and carrier transport properties of a new 3D mixed-valence Cu(i)-Cu(ii) coordination polymer including pyrrolidine dithiocarbamate ligand.","Dalton transactions (Cambridge, England : 2003)","2011","40","10","2218","2224","10.1039/c0dt01065k","","","0.71075","MoKα","","","0.0365","","","","0.0872","","","","","","1.045","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7014782","19.443","0.002","19.443","0.002","25.426","0.004","90","","90","","90","","9612","2","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","{[C,N]Pd(mu-OH)}2 (12)","","","- C53 H74 N6 O2 Pd2 -","- C48 H62 N6 O2 Pd2 -","- C384 H496 N48 O16 Pd16 -","8","0.5","","Cross, Warren B.; Daly, Christopher G.; Ackerman, Rachel L.; George, Ian R.; Singh, Kuldip","N-heterocyclic carbene tethered amido complexes of palladium and platinum.","Dalton transactions (Cambridge, England : 2003)","2011","40","2","495","505","10.1039/c0dt01149e","","","0.71073","MoKα","","0.0497","0.0378","","","0.0914","0.096","","","","","","1.029","","","","has coordinates","179851","2020-10-21","18:00:00",""
"7015300","43.964","0.006","43.964","0.006","11.235","0.002","90","","90","","90","","21715","6","100","2","100","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C35 H44 Ca Cl Mn3 N12 Na O16 -","- C34.5 H41 Ca Cl Mn3 N12 Na O16 -","- C552 H656 Ca16 Cl16 Mn48 N192 Na16 O256 -","16","1","","Nayak, Sanjit; Nayek, Hari Pada; Dehnen, Stefanie; Powell, Annie K.; Reedijk, Jan","Trigonal propeller-shaped [Mn(III)3M(II)Na] complexes (M = Mn, Ca): structural and functional models for the dioxygen evolving centre of PSII.","Dalton transactions (Cambridge, England : 2003)","2011","40","12","2699","2702","10.1039/c0dt01463j","","","0.71073","MoKα","","0.1043","0.08","","","0.213","0.2306","","","","","","1.018","","","","has coordinates,has disorder","179857","2020-10-21","18:00:00",""
"7015590","14.937","0.003","14.937","0.003","12.059","0.003","90","","90","","90","","2690.5","1","220","2","220","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C12 H12 Cl4 N18 Zn5 -","- C12 H12 Cl4 N18 Zn5 -","- C48 H48 Cl16 N72 Zn20 -","4","0.25","","Liu, Ying-Ya; Grzywa, Maciej; Tonigold, Markus; Sastre, German; Schüttrigkeit, Tanja; Leeson, Nicholas S.; Volkmer, Dirk","Photophysical properties of Kuratowski-type coordination compounds [M(II)Zn(4)Cl(4)(Me(2)bta)(6)] (M(II) = Zn or Ru) featuring long-lived excited electronic states.","Dalton transactions (Cambridge, England : 2003)","2011","40","22","5926","5938","10.1039/c0dt01750g","","x-ray","0.71073","mokα","","0.0291","0.0225","","","0.0477","0.0495","","","","","","1.048","","","","has coordinates","179859","2020-10-21","18:00:00",""
"7015744","14.7586","0.0016","14.7586","0.0016","27.279","0.003","90","","90","","90","","5941.8","1.1","153","2","153","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C36 H40 Cl4 Cu4 N28 O24 -","- C36 H32 Cl4 Cu4 N28 O24 -","- C144 H128 Cl16 Cu16 N112 O96 -","4","0.25","","Anwar, Muhammad U.; Elliott, Andrew S.; Thompson, Laurence K.; Dawe, Louise N.","Complexes of functionally modified hydrazone ligands‒square, rectangular (M4), trigonal bipyramidal (M5) and pin-wheel (M6) motifs.","Dalton transactions (Cambridge, England : 2003)","2011","40","17","4623","4635","10.1039/c1dt10047e","","","0.71075","MoKα","","0.083","0.0813","","","0.2364","0.239","","","","","","1.113","","","","has coordinates","179861","2020-10-21","18:00:00",""
"7015912","18.202","0.003","18.202","0.003","45.641","0.008","90","","90","","90","","15121","4","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C104 H136 Ir4 N8 O30 -","- C104 H136 Ir4 N6 O24 -","- C416 H544 Ir16 N24 O96 -","4","0.25","","Wang, Guo-Liang; Lin, Yue-Jian; Jin, Guo-Xin","Self-assembly of 1D mixed-metal tubular network with coordination bonds through the interconnection of organometallic metallamacrocycles by Ag(i) centers.","Dalton transactions (Cambridge, England : 2003)","2011","40","19","5166","5169","10.1039/c1dt10245a","","","0.71073","MoKα","","0.1031","0.066","","","0.178","0.1986","","","","","","1.055","","","","has coordinates","179863","2020-10-21","18:00:00",""
"7016044","22.092","0.003","22.092","0.003","10.887","0.002","90","","90","","90","","5313.5","1.4","150","2","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C12 H10 Fe Se2 -","- C12 H10 Fe Se2 -","- C192 H160 Fe16 Se32 -","16","1","","Eichhöfer, Andreas; Buth, Gernot; Dolci, Francesco; Fink, Karin; Mole, Richard A.; Wood, Paul T.","Homoleptic 1-D iron selenolate complexes-synthesis, structure, magnetic and thermal behaviour of [Fe(SeR)(2)] (R = Ph, Mes).","Dalton transactions (Cambridge, England : 2003)","2011","40","26","7022","7032","10.1039/c1dt10089k","","","0.8","synchrotron","","0.0675","0.0383","","","0.0621","0.0689","","","","","","1.009","","","","has coordinates","179864","2020-10-21","18:00:00",""
"7016186","22.1973","0.0005","22.1973","0.0005","20.2578","0.001","90","","90","","90","","9981.4","0.6","173","2","273","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C23 H34 N3 Si1.5 Sm -","- C23 H34 N3 Si1.5 Sm -","- C368 H544 N48 Si24 Sm16 -","16","1","","Pan, Cheng-Ling; Chen, Wan; Su, Shengqun; Pan, Yu-Song; Wang, Jing","Cubic and doubly-fused cubic samarium clusters from Sm(ii)-mediated reduction of organic azides and azobenzenes.","Dalton transactions (Cambridge, England : 2003)","2011","40","31","7941","7945","10.1039/c1dt10395d","","","0.71073","MoKα","","0.0659","0.0366","","","0.0838","0.1058","","","","","","1.061","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7016355","23.064","0.005","23.064","0.005","7.5597","0.0016","90","","90","","90","","4021.4","1.5","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","(OC-6-43)-Dichlorido(N,N-dimethyl-ethane-1,2-diamine)dihydro- xidoplatinum(IV)","(OC-6-43)-Dichlorido(N,N-dimethyl-ethane-1,2-diamine)dihydro- xidoplatinum(IV)","","- C4 H14 Cl2 N2 O2 Pt -","- C4 H14 Cl2 N2 O2 Pt -","- C64 H224 Cl32 N32 O32 Pt16 -","16","1","","Pichler, Verena; Valiahdi, Seied M.; Jakupec, Michael A.; Arion, Vladimir B.; Galanski, Markus; Keppler, Bernhard K.","Mono-carboxylated diaminedichloridoplatinum(iv) complexes - selective synthesis, characterization, and cytotoxicity.","Dalton transactions (Cambridge, England : 2003)","2011","40","32","8187","8192","10.1039/c1dt10301f","","","0.71073","MoKα","","0.1099","0.0643","","","0.1463","0.1766","","","","","","1.059","","","","has coordinates","179867","2020-10-21","18:00:00",""
"7016752","42.764","0.002","42.764","0.002","17.317","0.0016","90","","90","","90","","31669","4","100","2","100","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C278 H304 F48 Fe4 N24 O36.5 P8 -","- C236 H220 F48 Fe4 N24 O26 P8 -","- C944 H880 F192 Fe16 N96 O104 P32 -","4","0.25","","Glasson, Christopher R. K.; Meehan, George V.; Motti, Cherie A.; Clegg, Jack K.; Turner, Peter; Jensen, Paul; Lindoy, Leonard F.","New nickel(ii) and iron(ii) helicates and tetrahedra derived from expanded quaterpyridines.","Dalton transactions (Cambridge, England : 2003)","2011","40","40","10481","10490","10.1039/c1dt10667h","","","0.49594","synchrotron","","0.1844","0.1623","","","0.3742","0.3879","","","","","","1.691","","","","has coordinates,has disorder","192777","2020-10-21","18:00:00",""
"7016998","17.4477","0.0008","17.4477","0.0008","17.2562","0.0016","90","","90","","90","","5253.2","0.6","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C44 H60 Cl4 Co4 N8 O8 -","- C44 H60 Cl4 Co4 N8 O8 -","- C176 H240 Cl16 Co16 N32 O32 -","4","0.25","","Zhang, Shu-Hua; Ma, Lu-Fang; Zou, Hua-Hong; Wang, Yin Guang; Liang, Hong; Zeng, Ming Hua","Anion induced diversification from heptanuclear to tetranuclear clusters: Syntheses, structures and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2011","40","43","11402","11409","10.1039/c1dt10517e","","","0.71073","MoKα","","0.0436","0.037","","","0.1021","0.109","","","","","","1.063","","","","has coordinates","179873","2020-10-21","18:00:00",""
"7017062","23.979","0.003","23.979","0.003","13.13","0.002","90","","90","","90","","7549.7","1.8","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C38 H36 Cl2 Co2 N2 O8 -","- C38 H36 Cl2 Co2 N2 O8 -","- C304 H288 Cl16 Co16 N16 O64 -","8","0.5","","Jie, Suyun; Ai, Pengfei; Li, Bo-Geng","Highly active and stereospecific polymerization of 1,3-butadiene catalyzed by dinuclear cobalt(ii) complexes bearing 3-aryliminomethyl-2-hydroxybenzaldehydes.","Dalton transactions (Cambridge, England : 2003)","2011","40","41","10975","10982","10.1039/c1dt11073j","","","0.71073","MoKα","","","0.0616","","","0.1342","0.1857","","","","","","0.908","","","","has coordinates","179874","2020-10-21","18:00:00",""
"7017096","22.306","0.004","22.306","0.004","12.824","0.002","90","","90","","90","","6380.7","1.9","100","2","100","2","","","","","","","synthesis as described","5","I 41/a :2","-I 4ad","88","Tetrakisdibenzylphosphinato-octaoxo- tetravanadium(V).tetrahydrate","Tetrakisdibenzylphosphinato-octaoxo-tetravanadium(V).tetrahydrate","","- C56 H64 O20 P4 V4 -","- C56 H56 O20 P4 V4 -","- C224 H224 O80 P16 V16 -","4","0.25","","Maass, John S.; Chen, Zhichao; Zeller, Matthias; Luck, Rudy L.","Expanding molecular transition metal cubane clusters of the form [M(4)(μ(3)-O)(4)](12+): syntheses, spectroscopic and structural characterizations of molecules M(4)(μ(3)-O)(4)(O(2)P(Bn)(2))(4)(O(4)), M = V(V) and W(V).","Dalton transactions (Cambridge, England : 2003)","2011","40","43","11356","11358","10.1039/c1dt11375e","","x-ray","0.71073","MoKα","","0.0691","0.0397","","","0.0899","0.102","","","","","","1.035","","","","has coordinates","179874","2020-10-21","18:00:00",""
"7017097","22.771","0.004","22.771","0.004","13.107","0.002","90","","90","","90","","6796","2","100","2","100","2","","","","","","","synthesis as described","5","I 41/a :2","-I 4ad","88","Tetrakisdibenzylphosphinato-octaoxo- tetratungsten(V).tristetrahydrofuran","Tetrakisdibenzylphosphinato-octaoxo-tetratungsten(V).tristetrahydrofuran","","- C68 H80 O19 P4 W4 -","- C68 H80 O19 P4 W4 -","- C272 H320 O76 P16 W16 -","4","0.25","","Maass, John S.; Chen, Zhichao; Zeller, Matthias; Luck, Rudy L.","Expanding molecular transition metal cubane clusters of the form [M(4)(μ(3)-O)(4)](12+): syntheses, spectroscopic and structural characterizations of molecules M(4)(μ(3)-O)(4)(O(2)P(Bn)(2))(4)(O(4)), M = V(V) and W(V).","Dalton transactions (Cambridge, England : 2003)","2011","40","43","11356","11358","10.1039/c1dt11375e","","x-ray","0.71069","MoKα","","0.0241","0.0189","","","0.0425","0.0457","","","","","","1.094","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7017230","14.105","0.009","14.105","0.009","38.379","0.004","90","","90","","90","","7636","7","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C68 H75 N34 Ni4 O24 -","- C68 H64 N34 Ni4 O24 -","- C272 H256 N136 Ni16 O96 -","4","0.25","","Mandal, Tarak Nath; Roy, Somnath; Konar, Saugata; Jana, Atanu; Ray, Sangita; Das, Kinsuk; Saha, Rajat; El Fallah, Mohamed Salah; Butcher, Ray J.; Chatterjee, Sudipta; Kar, Susanta Kumar","Self assembled tetranuclear Cu(4)(ii), Ni(4)(ii) [2 ×2] square grids and a dicopper(ii) complex of heterocycle based polytopic ligands - Magnetic studies.","Dalton transactions (Cambridge, England : 2003)","2011","40","44","11866","11875","10.1039/c1dt10813a","","","0.71073","MoKα","","0.0572","0.0535","","","0.1256","0.1284","","","","","","1.086","","","","has coordinates","179876","2020-10-21","18:00:00",""
"7017452","34.9199","0.0004","34.9199","0.0004","11.2791","0.0002","90","","90","","90","","13753.7","0.3","150","","150","1","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C29 H39 Cl3 N3 O Ti -","- C29 H39 Cl3 N3 O Ti -","- C464 H624 Cl48 N48 O16 Ti16 -","16","1","","Larocque, Timothy G.; Badaj, Anna C.; Dastgir, Sarim; Lavoie, Gino G.","New stable aryl-substituted acyclic imino-N-heterocyclic carbene: synthesis, characterisation and coordination to early transition metals.","Dalton transactions (Cambridge, England : 2003)","2011","40","47","12705","12712","10.1039/c1dt11565k","","","0.71073","MoKα","","0.0899","0.0615","","","0.1605","0.1788","","","","","","1.115","","","","has coordinates","179878","2020-10-21","18:00:00",""
"7017453","34.553","0.006","34.553","","11.316","0.002","90","","90","","90","","13510","3","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C30 H41 Cl5 Cr N3 O -","- C30 H41 Cl5 Cr N3 O -","- C480 H656 Cl80 Cr16 N48 O16 -","16","1","","Larocque, Timothy G.; Badaj, Anna C.; Dastgir, Sarim; Lavoie, Gino G.","New stable aryl-substituted acyclic imino-N-heterocyclic carbene: synthesis, characterisation and coordination to early transition metals.","Dalton transactions (Cambridge, England : 2003)","2011","40","47","12705","12712","10.1039/c1dt11565k","","","0.71073","MoKα","","0.0942","0.0595","","","0.1178","0.1291","","","","","","1.372","","","","has coordinates,has disorder","179878","2020-10-21","18:00:00",""
"7017614","9.8323","0.0003","9.8323","0.0003","28.27","0.0013","90","","90","","90","","2732.98","0.17","298","2","298","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C16 H5 Bi O16 -","- C16 Bi O16 -","- C64 Bi4 O64 -","4","0.25","","Gao, Hui; Zhang, Xian-Ming","Three novel Bi(iii) complexes with in situ generated anilate ligands: unusual oxidation of cyclohexanedione to dihydroxy benzoquinone.","Dalton transactions (Cambridge, England : 2003)","2012","41","5","1562","1567","10.1039/c1dt11258a","","","0.71073","MoKα","","0.061","0.0535","","","0.1628","0.1702","","","","","","1.186","","","","has coordinates,has disorder","179880","2020-10-21","18:00:00",""
"7017911","19.36","0.001","19.36","0.001","10.173","0.0005","90","","90","","90","","3812.9","0.3","153","2","153","2","","","","","","","","5","I 41/a :2","-I 4ad","88","Dirhodium(ii) tetrakis(3-(trifluoromethyl), 5-(tert- butyl)pyrazolate))","","","- C32 H40 F12 N8 Rh2 -","- C32 H40 F12 N8 Rh2 -","- C128 H160 F48 N32 Rh8 -","4","0.25","","McCarty, W. Jeffrey; Yang, Xiaoping; DePue Anderson, Lauren J; Jones, Richard A.","Dinuclear Rh(II) pyrazolates as CVD precursors for rhodium thin films.","Dalton transactions (Cambridge, England : 2003)","2012","41","1","173","179","10.1039/c1dt11649e","","","0.71073","MoKα","","0.1327","0.059","","","0.1153","0.1435","","","","","","1.107","","","","has coordinates,has disorder","179883","2020-10-21","18:00:00",""
"7018014","28.6622","0.0002","28.6622","0.0002","14.9089","0.0001","90","","90","","90","","12248","0.15","150","2","150","2","","","","","","","synthesis as described","5","I 41/a :2","-I 4ad","88","Chisholm 1755","","","- C58 H84 Mo2 O12 Se2 -","- C58 H84 Mo2 O12 Se2 -","- C464 H672 Mo16 O96 Se16 -","8","0.5","","Brown-Xu, Samantha E; Chisholm, Malcolm H.; Gallucci, Judith C.; Ghosh, Yagnaseni; Gustafson, Terry L.; Reed, Carly R.","Furan- and selenophene-2-carboxylato derivatives of dimolybdenum and ditungsten (M[quadruple bond, length as m-dash]M): a comparison of their chemical and photophysical properties.","Dalton transactions (Cambridge, England : 2003)","2012","41","8","2257","2263","10.1039/c1dt11889g","","x-ray","0.71073","MoKα","","0.0505","0.0332","","","0.0796","0.0861","","","","","","1.042","","","","has coordinates,has disorder","179884","2020-10-21","18:00:00",""
"7018155","27.419","0.004","27.419","0.004","14.0279","0.0019","90","","90","","90","","10546","3","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C31 H34 N2 Pt -","- C31 H34 N2 Pt -","- C496 H544 N32 Pt16 -","16","1","","Robinson, Robert; Karikachery, Alice Raphael; Sharp, Paul R.","Photophysical properties of 4,4'-di-tert-butyl-2,2'-bipyridine supported 6-membered 2,2'-diphenyl-X platinacycles (X = CH(2), NMe, O).","Dalton transactions (Cambridge, England : 2003)","2012","41","9","2601","2611","10.1039/c2dt11594h","","","0.71073","MoKα","","0.0213","0.0182","","","0.043","0.0443","","","","","","1.035","","","","has coordinates","179885","2020-10-21","18:00:00",""
"7018156","26.979","0.003","26.979","0.003","14.0248","0.0014","90","","90","","90","","10208.2","1.9","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C30 H32 N2 O Pt -","- C30 H32 N2 O Pt -","- C480 H512 N32 O16 Pt16 -","16","1","","Robinson, Robert; Karikachery, Alice Raphael; Sharp, Paul R.","Photophysical properties of 4,4'-di-tert-butyl-2,2'-bipyridine supported 6-membered 2,2'-diphenyl-X platinacycles (X = CH(2), NMe, O).","Dalton transactions (Cambridge, England : 2003)","2012","41","9","2601","2611","10.1039/c2dt11594h","","","0.71073","MoKα","","0.0173","0.0156","","","0.0388","0.0395","","","","","","1.071","","","","has coordinates","179885","2020-10-21","18:00:00",""
"7018281","18.261","0.002","18.261","0.002","11.857","0.003","90","","90","","90","","3953.9","1.2","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","tetrakis(miu3-6-isoquinolinoxo)-tetrakis (methanol)-tetra- lithium","tetrakis(miu3-6-isoquinolinoxo)-tetrakis (methanol)-tetra-lithium","","- C40 H40 Li4 N4 O8 -","- C40 H40 Li4 N4 O8 -","- C160 H160 Li16 N16 O32 -","4","0.25","","Zhao, Xiang; Wu, Tao; Bu, Xianhui; Feng, Pingyun","Lithium cubane clusters as tetrahedral, square planar, and linear nodes for supramolecular assemblies.","Dalton transactions (Cambridge, England : 2003)","2012","41","14","3902","3905","10.1039/c1dt11975c","","","0.71073","MoKα","","0.1054","0.0842","","","0.2207","0.2391","","","","","","1.071","","","","has coordinates","179886","2020-10-21","18:00:00",""
"7018288","16.813","0.007","16.813","0.007","16.561","0.019","90","","90","","90","","4681","6","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","tetrakis(miu3-4-(4-pyridyl)phenoxo)-tetrakis(methanol)-tetra- lithium","tetrakis(miu3-4-(4-pyridyl)phenoxo)- tetrakis(methanol)-tetra-lithium","","- C48 H48 Li4 N4 O8 -","- C48 H48 Li4 N4 O8 -","- C192 H192 Li16 N16 O32 -","4","0.25","","Zhao, Xiang; Wu, Tao; Bu, Xianhui; Feng, Pingyun","Lithium cubane clusters as tetrahedral, square planar, and linear nodes for supramolecular assemblies.","Dalton transactions (Cambridge, England : 2003)","2012","41","14","3902","3905","10.1039/c1dt11975c","","","0.71073","MoKα","","0.1663","0.0972","","","0.2486","0.2927","","","","","","0.971","","","","has coordinates","179886","2020-10-21","18:00:00",""
"7018330","20.309","0.003","20.309","0.003","33.411","0.006","90","","90","","90","","13781","4","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C72 H96 Mo8 N8 O24 -","- C72 H96 Mo8 N8 O24 -","- C288 H384 Mo32 N32 O96 -","4","0.25","","Gamelas, Carla A.; Gomes, Ana C.; Bruno, Sofia M.; Almeida Paz, Filipe A.; Valente, Anabela A.; Pillinger, Martyn; Romão, Carlos C; Gonçalves, Isabel S","Molybdenum(vi) catalysts obtained from η(3)-allyl dicarbonyl precursors: Synthesis, characterization and catalytic performance in cyclooctene epoxidation.","Dalton transactions (Cambridge, England : 2003)","2012","41","12","3474","3484","10.1039/c2dt11751g","","","0.71073","MoKα","","0.0918","0.0574","","","0.1583","0.1745","","","","","","1.112","","","","has coordinates","179887","2020-10-21","18:00:00",""
"7018375","25.8768","0.0003","25.8768","0.0003","18.5465","0.0002","90","","90","","90","","12418.9","0.2","123","2","123","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C25 H8 Ag F10 N Pt -","- C25 H8 Ag F10 N Pt -","- C400 H128 Ag16 F160 N16 Pt16 -","16","1","","Forniés, Juan; Ibáñez, Susana; Lalinde, Elena; Martín, Antonio; Moreno, M. Teresa; Tsipis, Athanassios C.","Benzoquinolateplatinum(ii) complexes as building blocks in the synthesis of Pt-Ag extended structures.","Dalton transactions (Cambridge, England : 2003)","2012","41","12","3439","3451","10.1039/c2dt11885h","","","0.71073","MoKα","","0.0871","0.0556","","","0.1481","0.1546","","","","","","1.006","","","","has coordinates","179887","2020-10-21","18:00:00",""
"7018706","25.2401","0.001","25.2401","0.001","7.4556","0.0003","90","","90","","90","","4749.7","0.3","130","2","130","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C40 H42 Cu5 N9 O20 S4 -","- C40 H40 Cu5 N9 O20 S4 -","- C160 H160 Cu20 N36 O80 S16 -","4","0.25","","Abrahams, Brendan F.; Abrahams, Carmel T.; Haywood, Marissa G.; Hudson, Timothy A.; Moubaraki, Boujemaa; Murray, Keith S.; Robson, Richard","3d-Metal derivatives of the [Cu(I)(SO(3))(4)](7-) ion: structure and magnetism.","Dalton transactions (Cambridge, England : 2003)","2012","41","14","4091","4099","10.1039/c2dt12337a","","","1.54184","CuKα","","0.0744","0.057","","","0.1462","0.1571","","","","","","1.156","","","","has coordinates,has disorder","179891","2020-10-21","18:00:00",""
"7018816","9.5513","0.0014","9.5513","0.0014","29.315","0.006","90","","90","","90","","2674.3","0.8","180","2","180","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C26 H18 B2 F8 Fe N10 -","- C26 H18 B2 F8 Fe N10 -","- C104 H72 B8 F32 Fe4 N40 -","4","0.25","","Salitroš, Ivan; Fuhr, Olaf; Eichhöfer, Andreas; Kruk, Robert; Pavlik, Ján; Dlháň, Lubor; Boča, Roman; Ruben, Mario","The interplay of iron(ii) spin transition and polymorphism.","Dalton transactions (Cambridge, England : 2003)","2012","41","17","5163","5171","10.1039/c2dt11906d","","","0.71073","MoKα","","0.0298","0.0289","","","0.0749","0.0756","","","","","","1.046","","","","has coordinates","179892","2020-10-21","18:00:00",""
"7020200","24.9274","0.0002","24.9274","0.0002","9.6837","0.0001","90","","90","","90","","6017.21","0.09","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C40 H96 N12 O14 W4 -","- C40 H96 N12 O14 W4 -","- C160 H384 N48 O56 W16 -","4","0.25","","Choujaa, Hamid; Johnson, Andrew L.; Kociok-Köhn, Gabriele; Molloy, Kieran C.","The synthesis of W-O-W μ-oxo clusters by hydrolysis of tungsten aminoalkoxides and their structural characterisation.","Dalton transactions (Cambridge, England : 2003)","2012","41","37","11393","11401","10.1039/c2dt30966a","","","0.71073","MoKα","","0.0284","0.0248","","","0.0596","0.0613","","","","","","1.132","","","","has coordinates","179906","2020-10-21","18:00:00",""
"7020201","24.924","0.0005","24.924","0.0005","9.772","0.0002","90","","90","","90","","6070.4","0.2","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C40 H104 N12 O18 W4 -","- C40 H104 N12 O18 W4 -","- C160 H416 N48 O72 W16 -","4","0.25","","Choujaa, Hamid; Johnson, Andrew L.; Kociok-Köhn, Gabriele; Molloy, Kieran C.","The synthesis of W-O-W μ-oxo clusters by hydrolysis of tungsten aminoalkoxides and their structural characterisation.","Dalton transactions (Cambridge, England : 2003)","2012","41","37","11393","11401","10.1039/c2dt30966a","","","0.71073","MoKα","","0.0646","0.0405","","","0.0766","0.0877","","","","","","1.107","","","","has coordinates","179906","2020-10-21","18:00:00",""
"7020403","30.713","0.009","30.713","0.009","17.092","0.004","90","","90","","90","","16123","8","200","2","200","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C60 H94 Cl2 Mn6 N12 O25 -","- C60 H76 Cl2 Mn6 N12 O25 -","- C480 H608 Cl16 Mn48 N96 O200 -","8","0.5","","Martínez-Lillo, José; Tomsa, Adrian-Raul; Li, Yanling; Chamoreau, Lise-Marie; Cremades, Eduard; Ruiz, Eliseo; Barra, Anne-Laure; Proust, Anna; Verdaguer, Michel; Gouzerh, Pierre","Synthesis, crystal structure and magnetism of new salicylamidoxime-based hexanuclear manganese(iii) single-molecule magnets.","Dalton transactions (Cambridge, England : 2003)","2012","41","44","13668","13681","10.1039/c2dt31443f","","","0.71073","MoKα","","0.1412","0.0536","","","0.121","0.1526","","","","","","1.004","","","","has coordinates","179908","2020-10-21","18:00:00",""
"7020476","29.122","0.0015","29.122","0.0015","8.7975","0.0009","90","","90","","90","","7461.1","0.9","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C19 H17 Co N2 O4 -","- C19 H17 Co N2 O4 -","- C304 H272 Co16 N32 O64 -","16","1","","Li, Zong-Ze; Du, Lin; Zhou, Jie; Zhu, Ming-Rong; Qian, Fen-Hua; Liu, Jing; Chen, Peng; Zhao, Qi-Hua","Rational design of two bpy-bridged 3D and 2D Co(II) open frameworks with similar amino-acid-based Schiff bases.","Dalton transactions (Cambridge, England : 2003)","2012","41","47","14397","14403","10.1039/c2dt31670f","","","0.71073","MoKα","","0.1047","0.0718","","","0.2166","0.2434","","","","","","1.052","","","","has coordinates,has disorder","179908","2020-10-21","18:00:00",""
"7020569","37.979","0.005","37.979","0.005","16.959","0.003","90","","90","","90","","24462","6","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C160 H160 Cu9 N80 O0 P16 -","- C160 H160 Cu9 N80 P16 -","- C640 H640 Cu36 N320 P64 -","4","0.25","","Li, Xingjun; Jiang, Feilong; Chen, Lian; Wu, Mingyan; Chen, Qihui; Bu, Yang; Hong, Maochun","Three novel 3D coordination polymers based on a flexible multisite cyclotetraphosphazene ligand.","Dalton transactions (Cambridge, England : 2003)","2012","41","46","14038","14041","10.1039/c2dt31852k","","","0.71073","MoKα","","0.0701","0.0606","","","0.176","0.1835","","","","","","1.038","","","","has coordinates","179909","2020-10-21","18:00:00",""
"7020770","24.9162","0.0016","24.9162","0.0016","14.2676","0.001","90","","90","","90","","8857.6","1","150","2","150","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C77 H90 B4 Cu4 F16 N28 O11 -","- C76 H86 B Cu4 F4 N28 O10 -","- C304 H344 B4 Cu16 F16 N112 O40 -","4","0.25","","Shuvaev, Konstantin V.; Sproules, Stephen; Rautiainen, J. Mikko; McInnes, Eric J. L.; Collison, David; Anson, Christopher E.; Powell, Annie K.","A self-assembled Cu(ii)(4) [2 ×2] grid with organic radicals.","Dalton transactions (Cambridge, England : 2003)","2013","42","7","2371","2381","10.1039/c2dt31946b","","","0.71073","MoKα","","0.0876","0.0622","","","0.1548","0.169","","","","","","1.088","","","","has coordinates,has disorder","179912","2020-10-21","18:00:00",""
"7020771","24.891","0.004","24.891","0.004","14.388","0.003","90","","90","","90","","8914","3","150","2","150","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C77 H91.5 B4 Cu4 F16 N28 O9.5 -","- C76 H87.52 B Cu4 F4 N28 O8.52 -","- C304 H350.08 B4 Cu16 F16 N112 O34.08 -","4","0.25","","Shuvaev, Konstantin V.; Sproules, Stephen; Rautiainen, J. Mikko; McInnes, Eric J. L.; Collison, David; Anson, Christopher E.; Powell, Annie K.","A self-assembled Cu(ii)(4) [2 ×2] grid with organic radicals.","Dalton transactions (Cambridge, England : 2003)","2013","42","7","2371","2381","10.1039/c2dt31946b","","","0.71073","MoKα","","0.0941","0.0604","","","0.1491","0.1612","","","","","","0.993","","","","has coordinates,has disorder","179912","2020-10-21","18:00:00",""
"7020814","25.8002","0.0014","25.8002","0.0014","35.4669","0.0018","90","","90","","90","","23609","2","180","2","180","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C51 H42 Cl4 P4 Ru -","- C51 H42 Cl4 P4 Ru -","- C816 H672 Cl64 P64 Ru16 -","16","1","","Nguyen, Duc Hanh; Daran, Jean-Claude; Mallet-Ladeira, Sonia; Davin, Thomas; Maron, Laurent; Urrutigoïty, Martine; Kalck, Philippe; Gouygou, Maryse","Novel phospholyl(diphenylphosphino)methane-ruthenium complexes: unexpected non-assisted cis to trans isomerization of [RuCl2(κ(2)-P-P')2].","Dalton transactions (Cambridge, England : 2003)","2013","42","1","75","81","10.1039/c2dt32032k","","","0.71073","MoKα","","0.1086","0.0585","","","0.1351","0.1492","","","","","","0.984","","","","has coordinates,has disorder","179913","2020-10-21","18:00:00",""
"7021315","43.939","0.01","43.939","0.01","8.5387","0.0019","90","","90","","90","","16485","6","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C31 H25 Co2 N4 O6 -","- C31 H25 Co2 N4 O6 -","- C496 H400 Co32 N64 O96 -","16","1","","Hou, Lei; Jia, Li-Na; Shi, Wen-Juan; Du, Li-Yun; Li, Jiang; Wang, Yao-Yu; Shi, Qi-Zhen","A 3D porous metal-organic framework containing nanotubes based on multiple helices.","Dalton transactions (Cambridge, England : 2003)","2013","42","18","6306","6309","10.1039/c3dt50506e","","","0.71073","MoKα","","0.0492","0.0345","","","0.093","0.0977","","","","","","1.002","","","","has coordinates","179918","2020-10-21","18:00:00",""
"7021480","20.7387","0.0005","20.7387","0.0005","8.4495","0.0004","90","","90","","90","","3634.1","0.2","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C10 H14 Co3 N8 O8 -","- C10 H10 Co3 N8 O8 -","- C80 H80 Co24 N64 O64 -","8","0.5","","Zhang, Guangju; Li, Hao; Zhao, Fangfang; Hu, Hailiang; Huang, Hui; Li, Haitao; Han, Xiao; Liu, Ruihua; Dong, Huan; Liu, Yang; Kang, Zhenhui","A cobalt-based 3D porous framework with excellent catalytic ability for the selective oxidation of cis-cyclooctene.","Dalton transactions (Cambridge, England : 2003)","2013","42","26","9423","9427","10.1039/c3dt50747e","","","0.71073","MoKα","","0.0427","0.0371","","","0.151","0.1592","","","","","","1.011","","","","has coordinates","179919","2020-10-21","18:00:00",""
"7021965","17.095","0.006","17.095","0.006","16.563","0.006","90","","90","","90","","4840","3","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24 H18 N4 O8 Pb -","- C24 H18 N4 O8 Pb -","- C192 H144 N32 O64 Pb8 -","8","0.5","","Zhang, Yu; Yuan, Pengfei; Zhu, Yanyan; Li, Gang","Syntheses, crystal structures and thermal properties of six coordination polymers based on 2-(p-methylphenyl)-imidazole dicarboxylate.","Dalton transactions (Cambridge, England : 2003)","2013","42","41","14776","14785","10.1039/c3dt51747k","","","0.71073","MoKα","","0.0245","0.0174","","","0.0453","0.049","","","","","","1.068","","","","has coordinates","179924","2020-10-21","18:00:00",""
"7021967","22.29","0.003","22.29","0.003","15.123","0.003","90","","90","","90","","7514","2","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C48 H40 Cd4 N8 O21 -","- C48 H40 Cd4 N8 O21 -","- C192 H160 Cd16 N32 O84 -","4","0.25","","Zhang, Yu; Yuan, Pengfei; Zhu, Yanyan; Li, Gang","Syntheses, crystal structures and thermal properties of six coordination polymers based on 2-(p-methylphenyl)-imidazole dicarboxylate.","Dalton transactions (Cambridge, England : 2003)","2013","42","41","14776","14785","10.1039/c3dt51747k","","","0.71073","MoKα","","0.1787","0.0892","","","0.2526","0.2929","","","","","","0.936","","","","has coordinates","179924","2020-10-21","18:00:00",""
"7021968","22.143","0.004","22.143","0.004","16.282","0.006","90","","90","","90","","7983","4","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C17 H12 Cd N3 O4 -","- C17 H12 Cd N3 O4 -","- C272 H192 Cd16 N48 O64 -","16","1","","Zhang, Yu; Yuan, Pengfei; Zhu, Yanyan; Li, Gang","Syntheses, crystal structures and thermal properties of six coordination polymers based on 2-(p-methylphenyl)-imidazole dicarboxylate.","Dalton transactions (Cambridge, England : 2003)","2013","42","41","14776","14785","10.1039/c3dt51747k","","","0.71073","MoKα","","0.0253","0.0236","","","0.0675","0.0688","","","","","","1.046","","","","has coordinates","179924","2020-10-21","18:00:00",""
"7022480","16.7894","0.0012","16.7894","0.0012","17.349","0.003","90","","90","","90","","4890.4","1","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24 H18 N4 O10 Sr -","- C24 H18 N4 O10 Sr -","- C192 H144 N32 O80 Sr8 -","8","0.5","","Xiong, Zhi-Fang; Gao, Rui-Min; Xie, Zheng-Kun; Guo, Bei-Bei; Li, Li; Zhu, Yan-Yan; Li, Gang","Assembly of a series of MOFs based on the 2-(m-methoxyphenyl)imidazole dicarboxylate ligand.","Dalton transactions (Cambridge, England : 2003)","2013","42","13","4613","4624","10.1039/c2dt32727a","","","0.71073","MoKα","","0.0861","0.0468","","","0.1074","0.1217","","","","","","1.051","","","","has coordinates","179929","2020-10-21","18:00:00",""
"7022589","22.4649","0.0017","22.4649","0.0017","9.7584","0.0015","90","","90","","90","","4924.8","0.9","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C40 H56 Co4 O20 -","- C40 H56 Co4 O20 -","- C160 H224 Co16 O80 -","4","0.25","","Zhang, Kun; Dai, Jun; Wang, Yun-Hong; Zeng, Ming-Hua; Kurmoo, Mohamedally","Microwave and traditional solvothermal syntheses, crystal structures, mass spectrometry and magnetic properties of Co(II)4O4 cubes.","Dalton transactions (Cambridge, England : 2003)","2013","42","15","5439","5446","10.1039/c3dt00121k","","","0.71073","MoKα","","0.068","0.0391","","","0.0865","0.0987","","","","","","1.029","","","","has coordinates","179930","2020-10-21","18:00:00",""
"7022862","20.075","0.008","20.075","0.008","28.842","0.017","90","","90","","90","","11623","9","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C39 H49 Cl2 N2 O3 Pd -","- C29 H26 N2 O3 Pd -","- C464 H416 N32 O48 Pd16 -","16","1","","Adeyi, Okoh; Cross, Warren B.; Forrest, Gregory; Godfrey, Luke; Hope, Eric G.; McLeod, Andrew; Singh, Amandeep; Singh, Kuldip; Solan, Gregory A.; Wang, Yining; Wright, Luka A.","From discrete monomeric complexes to hydrogen-bonded dimeric assemblies based on sterically encumbered square planar palladium(II) ONN-pincers.","Dalton transactions (Cambridge, England : 2003)","2013","42","21","7710","7723","10.1039/c3dt50176k","","","0.71073","MoKα","","0.1453","0.0753","","","0.1631","0.1854","","","","","","0.966","","","","has coordinates","179933","2020-10-21","18:00:00",""
"7023278","22.187","0.003","22.187","0.003","9.5524","0.0019","90","","90","","90","","4702.3","1.3","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","[Ni4(OMe)4(L2)4(MeOH)4]","","","- C40 H60 N4 Ni4 O16 -","- C40 H60 N4 Ni4 O16 -","- C160 H240 N16 Ni16 O64 -","4","0.25","","Meally, Seán T; Taylor, Stephanie M.; Brechin, Euan K.; Piligkos, Stergios; Jones, Leigh F.","Homo- and heterometallic planes, chains and cubanes.","Dalton transactions (Cambridge, England : 2003)","2013","42","28","10315","10325","10.1039/c3dt51131f","","","0.7107","MoKα","","0.089","0.0572","","","0.1018","0.1184","","","","","","0.811","","","","has coordinates","179937","2020-10-21","18:00:00",""
"7023343","17.262","0.008","17.262","0.008","21.956","0.01","90","","90","","90","","6542","5","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C10 H4 N3 O5 Pb -","- C10 H4 N3 O5 Pb -","- C160 H64 N48 O80 Pb16 -","16","1","","Li, Jiang; Yang, Guoping; Hou, Lei; Cui, Lin; Li, Yuanpu; Wang, Yao-Yu; Shi, Qi-Zhen","Three new solvent-directed 3D lead(II)-MOFs displaying the unique properties of luminescence and selective CO2 sorption.","Dalton transactions (Cambridge, England : 2003)","2013","42","37","13590","13598","10.1039/c3dt51203g","","","0.71073","MoKα","","0.0579","0.0331","","","0.1328","0.1593","","","","","","1.15","","","","has coordinates","179938","2020-10-21","18:00:00",""
"7023429","23.9923","0.0012","23.9923","0.0012","25.274","0.0016","90","","90","","90","","14548.5","1.4","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C60 H40 Cl8 Mn4 N24 O8 -","- C60 H40 Cl8 Mn4 N24 O8 -","- C480 H320 Cl64 Mn32 N192 O64 -","8","0.5","","Alcazar, Laura; Cordero, Beatriz; Esteban, Jordi; Tangoulis, Vassilis; Font-Bardia, Mercè; Calvet, Teresa; Escuer, Albert","Manganese clusters derived from 2-pyridylcyanoxime: new topologies and a large spin ground state in pyridyloximate chemistry.","Dalton transactions (Cambridge, England : 2003)","2013","42","34","12334","12345","10.1039/c3dt51329g","","","0.71073","MoKα","","0.0679","0.0317","","","0.0515","0.0612","","","","","","0.883","","","","has coordinates","179939","2020-10-21","18:00:00",""
"7023755","15.5074","0.001","15.5074","0.001","19.892","0.0012","90","","90","","90","","4783.6","0.5","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C64 H90 Cu8 N16 O49 -","- C64 H64 Cu8 N16 O49 -","- C128 H128 Cu16 N32 O98 -","2","0.125","","Wang, Ling; Guo, Bin; Li, Hong-Xi; Li, Qi; Li, Hai-Yan; Lang, Jian-Ping","Polynuclear copper(ii) pyrazolate complexes: temperature-dependent protonolysis reactions, crystal structures and high catalytic activity toward the condensation of nitriles with 2-aminoalcohol.","Dalton transactions (Cambridge, England : 2003)","2013","42","44","15570","15580","10.1039/c3dt51970h","","","0.71073","MoKα","","0.0823","0.059","","","0.178","0.1991","","","","","","1.068","","","","has coordinates,has disorder","179942","2020-10-21","18:00:00",""
"7023771","30.853","0.0012","30.853","0.0012","9.6827","0.0005","90","","90","","90","","9217","0.7","100","2","100","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C9 H13 B Bi Cl2 N9 S3 -","- C9 H13 B Bi Cl2 N9 S3 -","- C144 H208 B16 Bi16 Cl32 N144 S48 -","16","1","","Imran, Muhammad; Neumann, Beate; Stammler, Hans-Georg; Monkowius, Uwe; Ertl, Martin; Mitzel, Norbert W.","The versatile behaviour of a novel Janus scorpionate ligand towards sodium, potassium and bismuth(iii) ions.","Dalton transactions (Cambridge, England : 2003)","2013","42","44","15785","15795","10.1039/c3dt52030g","","","0.71073","MoKα","","0.0395","0.0251","","","0.0565","0.0591","","","","","","1.014","","","","has coordinates","179942","2020-10-21","18:00:00",""
"7023846","17.4746","0.0011","17.4746","0.0011","19.6937","0.0016","90","","90","","90","","6013.7","0.7","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C36 H52 Cl8 N4 Ni4 O4 -","- C36 H52 Cl8 N4 Ni4 O4 -","- C144 H208 Cl32 N16 Ni16 O16 -","4","0.25","","Hameury, Sophie; Kayser, Laure; Pattacini, Roberto; Rogez, Guillaume; Wernsdorfer, Wolfgang; Braunstein, Pierre","Synthesis of cubane-type Ni(II) complexes from pyridyl-alcohol ligands; their single-molecule magnet behaviour.","Dalton transactions (Cambridge, England : 2003)","2013","42","14","5013","5024","10.1039/c3dt32869d","","","0.71073","MoKα","","0.1021","0.0555","","","0.1402","0.1534","","","","","","0.961","","","","has coordinates","179943","2020-10-21","18:00:00",""
"7023847","15.037","0.004","15.037","0.004","40.887","0.014","90","","90","","90","","9245","5","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C30 H38 Cl14 N4 Ni4 O4 -","- C30 H38 Cl14 N4 Ni4 O4 -","- C240 H304 Cl112 N32 Ni32 O32 -","8","0.5","","Hameury, Sophie; Kayser, Laure; Pattacini, Roberto; Rogez, Guillaume; Wernsdorfer, Wolfgang; Braunstein, Pierre","Synthesis of cubane-type Ni(II) complexes from pyridyl-alcohol ligands; their single-molecule magnet behaviour.","Dalton transactions (Cambridge, England : 2003)","2013","42","14","5013","5024","10.1039/c3dt32869d","","x-ray","0.71073","MoKα","","0.1354","0.0528","","","0.1287","0.1796","","","","","","0.979","","","","has coordinates,has disorder","179943","2020-10-21","18:00:00",""
"7024004","21.5717","","21.5717","","13.1003","0.0003","90","","90","","90","","6096.07","0.14","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C64 H64 Cu4 N8 O20 -","- C64 H64 Cu4 N8 O20 -","- C256 H256 Cu16 N32 O80 -","4","0.25","","Sutradhar, Manas; Kirillova, Marina V.; Guedes da Silva, M Fátima C; Liu, Cai-Ming; Pombeiro, Armando J. L.","Tautomeric effect of hydrazone Schiff bases in tetranuclear Cu(ii) complexes: magnetism and catalytic activity towards mild hydrocarboxylation of alkanes.","Dalton transactions (Cambridge, England : 2003)","2013","42","47","16578","16587","10.1039/c3dt52453a","","","0.71069","MoKα","","0.0304","0.0244","","","0.0708","0.0875","","","","","","1.225","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7024270","12.3084","0.0006","12.3084","","33.3164","0.0017","90","","90","","90","","5047.3","0.4","150","","150","","","","","","","","","6","I 41/a :2","-I 4ad","88","(Cu4(O)(L2)2(CH3COO)4)","","","- C36 H45 Cl4 Cu4 N5 O11 -","- C32.5 H36 Cl4 Cu4 N5 O9.25 -","- C130 H144 Cl16 Cu16 N20 O37 -","4","0.25","","Roy, Partha; Manassero, Mario","Tetranuclear copper(ii)-Schiff-base complexes as active catalysts for oxidation of cyclohexane and toluene.","Dalton transactions (Cambridge, England : 2003)","2010","39","6","1539","1545","10.1039/b914017d","","","0.71073","Mo-Kα","","0.072","0.072","","","0.117","","","","1.064","1.064","1.064","","","","","has coordinates","179947","2020-10-21","18:00:00",""
"7024665","8.6768","0.0006","8.6768","0.0006","17.3688","0.0016","90","","90","","90","","1307.64","0.18","298","2","298","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C8 H14 Co3 O10 -","- C8 H12 Co3 O10 -","- C32 H48 Co12 O40 -","4","0.25","","Wu, Guo-Xing; Wu, Hai-Shun; Zhang, Xian-Ming","A hybrid cobalt hydroxyacetate magnet: ionothermal synthesis, 3-D Co-O-Co connectivity and spin glass behavior.","Dalton transactions (Cambridge, England : 2003)","2010","39","5","1179","1181","10.1039/b919966g","","","0.71073","MoKα","","0.0359","0.0329","","","0.0836","0.0857","","","","","","1.178","","","","has coordinates","179951","2020-10-21","18:00:00",""
"7025304","30.711","0.004","30.711","0.004","13.202","0.003","90","","90","","90","","12452","4","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C74 H144 Cl4 Mn20 N12 O54 -","- C74 H136 Cl4 Mn20 N12 O54 -","- C296 H544 Cl16 Mn80 N48 O216 -","4","0.25","","Langley, Stuart K.; Moubaraki, Boujemaa; Berry, Kevin J.; Murray, Keith S.","Supertetrahedral icosanuclear and ring-like decanuclear mixed valent manganese(ii/iii) triethanolamine clusters","Dalton Transactions","2010","39","20","4848","","10.1039/b926795f","","","0.77506","synchrotron","","0.0841","0.073","","","0.2049","0.2137","","","","","","1.076","","","","has coordinates,has disorder","179959","2020-10-21","18:00:00",""
"7025936","26.1371","0.0013","26.1371","0.0013","23.7475","0.0016","90","","90","","90","","16223.1","1.6","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C43 H50 Cl2 N2 Pd -","- C43 H50 Cl2 N2 Pd -","- C688 H800 Cl32 N32 Pd16 -","16","1","","Qi, Ming-Hui; Shao, Li-Xiong; Shi, Min","PdCl(2)-promoted reactions of diaryl-substituted methylenecyclopropanes.","Dalton transactions (Cambridge, England : 2003)","2010","39","37","8829","8834","10.1039/c0dt00059k","","","0.71073","MoKα","","0.1328","0.0607","","","0.1348","0.1647","","","","","","0.847","","","","has coordinates","179965","2020-10-21","18:00:00",""
"7026028","30.2","0.018","30.2","0.018","10.016","0.009","90","","90","","90","","9135","11","202","2","202","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C21 H27 Mn N4 O5 -","- C21 H27 Mn N4 O5 -","- C336 H432 Mn16 N64 O80 -","16","1","","Lin, Po-Heng; Gorelsky, Serge; Savard, Didier; Burchell, Tara J.; Wernsdorfer, Wolfgang; Clérac, Rodolphe; Murugesu, Muralee","Synthesis, characterisation and computational studies on a novel one-dimensional arrangement of Schiff-base Mn3 single-molecule magnet.","Dalton transactions (Cambridge, England : 2003)","2010","39","33","7650","7658","10.1039/c0dt00143k","","","0.71073","MoKα","","0.0795","0.0515","","","0.1327","0.1517","","","","","","1.081","","","","has coordinates,has disorder","179966","2020-10-21","18:00:00",""
"7026960","13.7474","0.0006","13.7474","0.0006","20.6961","0.0019","90","","90","","90","","3911.4","0.4","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C32 H52 N4 O4 Te4 -","- C32 H52 N4 O4 Te4 -","- C128 H208 N16 O16 Te16 -","4","0.25","","Kübel, Joachim; Elder, Philip J. W.; Jenkins, Hilary A.; Vargas-Baca, Ignacio","Structure and formation of the first (-O-Te-N-)4 ring.","Dalton transactions (Cambridge, England : 2003)","2010","39","46","11126","11128","10.1039/c0dt01102a","","","0.71073","MoKα","","0.0312","0.0245","","","0.06","0.0629","","","","","","1.055","","","","has coordinates","179975","2020-10-21","18:00:00",""
"7027959","20.2726","0.0005","20.2726","0.0005","30.435","0.003","90","","90","","90","","12508.1","1.3","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C29 H50 N3 O4 Rh -","- C29 H50 N3 O4 Rh -","- C464 H800 N48 O64 Rh16 -","16","1","","James, Stuart L.; Mingos, D. Michael P.; Xu, Xingling; White, Andrew J. P.; Williams, David J.","Orotate complexes of rhodium(I) and iridium(I): effect of coligand, counter ion, and solvent of crystallisation on association via complementary hydrogen bonding","Journal of the Chemical Society, Dalton Transactions","1998","","8","1335","","10.1039/a708205c","","","1.54178","CuKα","","0.1086","0.0615","","0.1609","0.1296","","","","1.08","1.116","1.116","","","","","has coordinates,has disorder","179985","2020-10-21","18:00:00",""
"7028350","14.476","0.006","14.476","0.006","28.023","0.009","90","","90","","90","","5872","4","113","2","113","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H68.5 N20 O16.25 Pt4 S4 -","- C32 H36 N20 O16.29 Pt4 S4 -","- C128 H144 N80 O65.16 Pt16 S16 -","4","0.25","","Shao, Jia; Bao, Wei-Guo; Tian, He; Li, Bing; Zhao, Xiao-Fei; Qiao, Xin; Xu, Jing-Yuan","Nuclease activity and protein-binding properties of a novel tetranuclear thiosemicarbazide Pt(II) complex.","Dalton transactions (Cambridge, England : 2003)","2014","43","4","1663","1671","10.1039/c3dt52044g","","","0.71073","MoKα","","0.0571","0.049","","","0.1371","0.1434","","","","","","1.135","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7028592","21.06","0.002","21.06","0.002","17.7326","0.0019","90","","90","","90","","7864.8","1.4","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C43 H40 Mo N O8 P2 -","- C43 H40 Mo N O8 P2 -","- C344 H320 Mo8 N8 O64 P16 -","8","0.5","","Naik, Susmita; Kumaravel, Maruthai; Mague, Joel T.; Balakrishna, Maravanji S.","Bisamino(diphosphonite) with dangling olefin functionalities: synthesis, metal chemistry and catalytic utility of Rh(I) and Pd(II) complexes in hydroformylation and Suzuki-Miyaura reactions.","Dalton transactions (Cambridge, England : 2003)","2014","43","3","1082","1095","10.1039/c3dt52400k","","","0.71073","MoKα","","0.0755","0.0476","","","0.1101","0.1265","","","","","","1.712","","","","has coordinates,has disorder","179991","2020-10-21","18:00:00",""
"7028593","21.0377","0.0017","21.0377","0.0017","17.7433","0.0015","90","","90","","90","","7852.9","1.1","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C43 H38 N O8 P2 W -","- C43 H38 N O8 P2 W -","- C344 H304 N8 O64 P16 W8 -","8","0.5","","Naik, Susmita; Kumaravel, Maruthai; Mague, Joel T.; Balakrishna, Maravanji S.","Bisamino(diphosphonite) with dangling olefin functionalities: synthesis, metal chemistry and catalytic utility of Rh(I) and Pd(II) complexes in hydroformylation and Suzuki-Miyaura reactions.","Dalton transactions (Cambridge, England : 2003)","2014","43","3","1082","1095","10.1039/c3dt52400k","","","0.71073","MoKα","","0.0361","0.027","","","0.0595","0.0645","","","","","","1.029","","","","has coordinates,has disorder","179991","2020-10-21","18:00:00",""
"7028916","15.3175","0.0007","15.3175","0.0007","23.0865","0.0012","90","","90","","90","","5416.7","0.4","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C15.31 H9 F3 N4 O0.31 -","- C15.32 H9 F3 N4 O0.33 -","- C245.12 H144 F48 N64 O5.28 -","16","1","","Hohloch, Stephan; Schweinfurth, David; Sommer, Michael G.; Weisser, Fritz; Deibel, Naina; Ehret, Fabian; Sarkar, Biprajit","The redox series [Ru(bpy)2(L)](n), n = +3, +2, +1, 0, with L = bipyridine, ""click"" derived pyridyl-triazole or bis-triazole: a combined structural, electrochemical, spectroelectrochemical and DFT investigation.","Dalton transactions (Cambridge, England : 2003)","2014","43","11","4437","4450","10.1039/c3dt52898g","","","0.71073","MoKα","","0.0669","0.0459","","","0.1072","0.1184","","","","","","1.058","","","","has coordinates","179995","2020-10-21","18:00:00",""
"7029194","22.0941","0.001","22.0941","0.001","14.5099","0.0014","90","","90","","90","","7083","0.8","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C15 H18 Cd N4 O4 -","- C15 H18 Cd N4 O4 -","- C240 H288 Cd16 N64 O64 -","16","1","","Jia, Hongliang; Li, Yanlin; Xiong, Zhifang; Wang, Chengjie; Li, Gang","Five metal-organic frameworks from 3,4-dimethylphenyl substituted imidazole dicarboxylate: syntheses, structures and properties.","Dalton transactions (Cambridge, England : 2003)","2014","43","9","3704","3715","10.1039/c3dt52910j","","","0.71073","MoKα","","0.103","0.0824","","","0.1996","0.2071","","","","","","1.239","","","","has coordinates,has disorder","179997","2020-10-21","18:00:00",""
"7029496","23.4346","0.0012","23.4346","0.0012","14.915","0.0015","90","","90","","90","","8191","1","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C15 H20 N6 O5 Zn -","- C15 H10 N6 Zn -","- C240 H160 N96 Zn16 -","16","1","","Chen, Shui-Sheng; Wang, Peng; Takamizawa, Satoshi; Okamura, Taka-Aki; Chen, Min; Sun, Wei-Yin","Zinc(ii) and cadmium(ii) metal-organic frameworks with 4-imidazole containing tripodal ligand: sorption and anion exchange properties.","Dalton transactions (Cambridge, England : 2003)","2014","43","16","6012","6020","10.1039/c3dt53388c","","","0.71073","MoKα","","0.0537","0.0416","","","0.0917","0.0956","","","","","","0.998","","","","has coordinates","180000","2020-10-21","18:00:00",""
"7029633","19.2769","0.0008","19.2769","0.0008","18.5886","0.0008","90","","90","","90","","6907.5","0.5","173","2","173","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C44 H60 Cl8 Co4 N4 O4 S4 -","- C44 H60 Cl8 Co4 N4 O4 S4 -","- C176 H240 Cl32 Co16 N16 O16 S16 -","4","0.25","","Ghisolfi, Alessio; Monakhov, Kirill Yu; Pattacini, Roberto; Braunstein, Pierre; López, Xavier; de Graaf, Coen; Speldrich, Manfred; van Leusen, Jan; Schilder, Helmut; Kögerler, Paul","A comparative synthetic, magnetic and theoretical study of functional M4Cl4 cubane-type Co(ii) and Ni(ii) complexes.","Dalton transactions (Cambridge, England : 2003)","2014","43","21","7847","7859","10.1039/c4dt00306c","","","0.71073","MoKα","","0.0613","0.0451","","","0.1184","0.1284","","","","","","1.083","","","","has coordinates","180002","2020-10-21","18:00:00",""
"7029634","19.091","0.001","19.091","0.001","18.729","0.001","90","","90","","90","","6826.1","0.6","173","2","173","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C44 H60 Cl8 N4 Ni4 O4 S4 -","- C44 H60 Cl8 N4 Ni4 O4 S4 -","- C176 H240 Cl32 N16 Ni16 O16 S16 -","4","0.25","","Ghisolfi, Alessio; Monakhov, Kirill Yu; Pattacini, Roberto; Braunstein, Pierre; López, Xavier; de Graaf, Coen; Speldrich, Manfred; van Leusen, Jan; Schilder, Helmut; Kögerler, Paul","A comparative synthetic, magnetic and theoretical study of functional M4Cl4 cubane-type Co(ii) and Ni(ii) complexes.","Dalton transactions (Cambridge, England : 2003)","2014","43","21","7847","7859","10.1039/c4dt00306c","","","0.71073","MoKα","","0.0623","0.0546","","","0.1257","0.1314","","","","","","1.167","","","","has coordinates","180002","2020-10-21","18:00:00",""
"7029842","36.102","0.006","36.102","0.006","9.93","0.003","90","","90","","90","","12942","5","296","2","296","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C44 H59 B2 Cl2 Cu Mn2 N22 O20.5 -","- C44 H42 B2 Cl2 Cu Mn2 N22 O20.5 -","- C352 H336 B16 Cl16 Cu8 Mn16 N176 O164 -","8","0.5","","Ryu, Dae Won; Shin, Jin Ho; Lim, Kwang Soo; Lee, Woo Ram; Phang, Won Ju; Yoon, Sung Won; Suh, Byoung Jin; Koh, Eui Kwan; Hong, Chang Seop","Dehydration-triggered magnetic phase conversion in the porous Cu(ii)Mn(iii) metal-organic framework.","Dalton transactions (Cambridge, England : 2003)","2014","43","19","6994","6997","10.1039/c4dt00222a","","","0.71073","MoKα","","0.1788","0.0716","","","0.1849","0.238","","","","","","1.024","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7029843","35.9978","0.0006","35.9978","0.0006","9.9081","0.0003","90","","90","","90","","12839.3","0.5","296","2","296","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C44 H42 B2 Cl2 Cu Mn2 N22 O12 -","- C44 H42 B2 Cl2 Cu Mn2 N22 O12 -","- C352 H336 B16 Cl16 Cu8 Mn16 N176 O96 -","8","0.5","","Ryu, Dae Won; Shin, Jin Ho; Lim, Kwang Soo; Lee, Woo Ram; Phang, Won Ju; Yoon, Sung Won; Suh, Byoung Jin; Koh, Eui Kwan; Hong, Chang Seop","Dehydration-triggered magnetic phase conversion in the porous Cu(ii)Mn(iii) metal-organic framework.","Dalton transactions (Cambridge, England : 2003)","2014","43","19","6994","6997","10.1039/c4dt00222a","","","0.71073","MoKα","","0.1919","0.0613","","","0.1607","0.2398","","","","","","0.995","","","","has coordinates","180004","2020-10-21","18:00:00",""
"7030198","21.0064","0.0015","21.0064","0.0015","42.006","0.004","90","","90","","90","","18536","3","150","2","150","2","","","","","","","synthesis as described","6","I 41/a :2","-I 4ad","88","","","","- C112 H84 Cl16 Mn12 N12 O48 -","- C112 H84 Cl16 Mn12 N12 O48 -","- C448 H336 Cl64 Mn48 N48 O192 -","4","0.25","","Kushch, L. A.; Sasnovskaya, V. D.; Dmitriev, A. I.; Yagubskii, E. B.; Koplak, O. V.; Zorina, L. V.; Boukhvalov, D. W.","New single-molecule magnet based on Mn12 oxocarboxylate clusters with mixed carboxylate ligands, [Mn12O12(CN-o-C6H4CO2)12(CH3CO2)4(H2O)4]·8CH2Cl2: Synthesis, crystal and electronic structure, magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2012","41","44","13747","13754","10.1039/c2dt31173a","","","0.71073","MoKα","","0.1913","0.1125","","","0.2607","0.2939","","","","","","1.016","","","","has coordinates,has disorder","180007","2020-10-21","18:00:00",""
"7030321","19.4622","0.001","19.4622","0.001","20.882","0.002","90","","90","","90","","7909.6","1","373","2","373","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C88 H72 Cl4 N4 O10 Sb4 -","- C88 H72 Cl4 N4 O10 Sb4 -","- C352 H288 Cl16 N16 O40 Sb16 -","4","0.25","","Jami, Ananda Kumar; Baskar, Viswanathan","Tetranuclear stiboxanes (RSb)4O6, exhibiting an adamantane-type structure.","Dalton transactions (Cambridge, England : 2003)","2012","41","40","12524","12529","10.1039/c2dt30587a","","","0.71073","MoKα","","0.0306","0.0283","","","0.0749","0.0767","","","","","","1.068","","","","has coordinates","180009","2020-10-21","18:00:00",""
"7030322","19.226","0.009","19.226","0.009","21.37","0.019","90","","90","","90","","7899","9","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C88 H72 Br4 N4 O10 Sb4 -","- C88 H72 Br4 N4 O10 Sb4 -","- C352 H288 Br16 N16 O40 Sb16 -","4","0.25","","Jami, Ananda Kumar; Baskar, Viswanathan","Tetranuclear stiboxanes (RSb)4O6, exhibiting an adamantane-type structure.","Dalton transactions (Cambridge, England : 2003)","2012","41","40","12524","12529","10.1039/c2dt30587a","","","0.71073","MoKα","","0.0605","0.0506","","","0.135","0.1443","","","","","","1.07","","","","has coordinates","180009","2020-10-21","18:00:00",""
"7030876","17.6446","0.0009","17.6446","0.0009","22.742","0.003","90","","90","","90","","7080.3","1.1","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C16 H10 N6 O9 Zn2 -","- C16 H10 N6 O9 Zn2 -","- C256 H160 N96 O144 Zn32 -","16","1","","Wang, Yan-Ning; Yang, Qing-Feng; Li, Guang-Hua; Zhang, Ping; Yu, Jie-Hui; Xu, Ji-Qing","Construction of acylhydrazidate-extended metal-organic frameworks.","Dalton transactions (Cambridge, England : 2003)","2014","43","30","11646","11657","10.1039/c4dt00780h","","","0.71073","MoKα","","0.0503","0.0418","","","0.1082","0.118","","","","","","1.119","","","","has coordinates","189181","2020-10-21","18:00:00",""
"7030930","33.8887","0.0017","33.8887","","15.8396","0.001","90","","90","","90","","18190.9","1.5","90","2","90","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C40 H42 N16 O2 -","- C40 H42 N16 O2 -","- C640 H672 N256 O32 -","16","1","","Hutchinson, Daniel J.; Hanton, Lyall R.; Moratti, Stephen C.","Tetratopic pyrimidine-hydrazone ligands modified with terminal hydroxymethyl and acryloyl arms and their Pb(ii), Zn(ii), Cu(ii) and Ag(i) complexes.","Dalton transactions (Cambridge, England : 2003)","2014","43","22","8205","8218","10.1039/c3dt53559b","","","0.71069","MoKα","","0.0698","0.0649","","","0.1621","0.1648","","","","","","1.154","","","","has coordinates","180015","2020-10-21","18:00:00",""
"7031121","28.0757","0.0012","28.0757","0.0012","10.9479","0.001","90","","90","","90","","8629.6","0.9","296","2","296","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C32 H104 Cl4 Ho4 N20 O8 Se10 Sn4 -","- C32 H96 Cl4 Ho4 N20 O6 Se10 Sn4 -","- C128 H384 Cl16 Ho16 N80 O24 Se40 Sn16 -","4","0.25","","Xiao, Hong-Ping; Zhou, Jian; Wang, Xiao-Li; Zou, Hua-Hong; Zhao, Rong-Qing; Xiao, Hong","Solvothermal syntheses and characterizations of three new holmium selenidostannates(iv): a rare example of adamantane-like [Sn4Se10](4-) selenidostannate(iv) with lanthanide complexes.","Dalton transactions (Cambridge, England : 2003)","2014","43","32","12306","12312","10.1039/c4dt00972j","","","0.71073","MoKα","","0.0348","0.0273","","","0.0704","0.0741","","","","","","1.056","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7031145","21.6628","0.0017","21.6628","0.0017","28.045","0.003","90","","90","","90","","13161","2","295","2","295","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C124 H176 O4 P8 Pt4 S4 -","- C122 H172 O4 P8 Pt4 S4 -","- C488 H688 O16 P32 Pt16 S16 -","4","0.25","","Desroches, Cedric; Lopes, Cesar; Kessler, Vadim; Parola, Stephane","Design and synthesis of multifunctional thiacalixarenes and related metal derivatives for the preparation of sol‒gel hybrid materials with non-linear optical properties","Dalton Transactions","2003","","10","2085","2092","10.1039/b210252h","","","0.71073","MoKα","","0.1083","0.0589","","","0.1561","0.1836","","","","","","1.078","","","","has coordinates","180017","2020-10-21","18:00:00",""
"7031385","26.451","0.004","26.451","0.004","13.425","0.003","90","","90","","90","","9393","3","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C80 H156 N4 O16 Sr4 -","- C80 H156 N4 O16 Sr4 -","- C320 H624 N16 O64 Sr16 -","4","0.25","","George, Sheby Mary; Kim, Hyo-Suk; Lah, Myoung Soo; Park, Bo Keun; Kim, Chang Gyoun; Chung, Taek-Mo","Synthesis of new heteroleptic strontium complexes.","Dalton transactions (Cambridge, England : 2003)","2014","43","38","14461","14469","10.1039/c4dt00689e","","","0.71073","MoKα","","0.0904","0.0508","","","0.1035","0.1205","","","","","","1.07","","","","has coordinates","180019","2020-10-21","18:00:00",""
"7031425","10.9355","0.0008","10.9355","0.0008","34.918","0.003","90","","90","","90","","4175.7","0.6","223","2","223","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C24 H40 Ge4 N4 O6 S10 -","- C24 H28 Ge4 N4 O6 S10 -","- C96 H112 Ge16 N16 O24 S40 -","4","0.25","","Sun, Xiao-Lu; Zhu, Qin-Yu; Mu, Wen-Qin; Qian, Li-Wen; Yu, Lan; Wu, Jing; Bian, Guo-Qing; Dai, Jie","Ion pair charge-transfer thiogermanate salts [MV]2Ge4S10·xSol: solvent induced crystal transformation and photocurrent responsive properties.","Dalton transactions (Cambridge, England : 2003)","2014","43","33","12582","12589","10.1039/c4dt01289e","","","0.71075","MoKα","","0.0511","0.0397","","","0.0909","0.0961","","","","","","1.127","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7031517","19.1147","0.0018","19.1147","0.0018","41.28","0.004","90","","90","","90","","15083","2","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C40 H42 N6 O2 Zn2 -","- C40 H42 N6 O2 Zn2 -","- C640 H672 N96 O32 Zn32 -","16","1","","Kong, Wei-Li; Chai, Zuo-Yun; Wang, Zhong-Xia","Synthesis of N,N,O-chelate zinc and aluminum complexes and their catalysis in the ring-opening polymerization of ε-caprolactone and rac-lactide.","Dalton transactions (Cambridge, England : 2003)","2014","43","38","14470","14480","10.1039/c4dt01364f","","","0.71073","MoKα","","0.2436","0.0666","","","0.1454","0.1764","","","","","","1.052","","","","has coordinates,has disorder","180021","2020-10-21","18:00:00",""
"7031765","22.927","0.005","22.927","0.005","15.43","0.003","90","","90","","90","","8111","3","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C56 H56 N16 Ni O42 V3 W12 -","- C56 H56 N16 Ni O42 V3 W12 -","- C224 H224 N64 Ni4 O168 V12 W48 -","4","0.25","","Lan, Qing; Zhang, Zhi-Ming; Li, Yang-Guang; Lu, Ying; Wang, En-Bo","Synthesis of a poly-pendant 1-D chain based on 'trans-vanadium' bicapped, Keggin-type vanadtungstate and its photocatalytic properties.","Dalton transactions (Cambridge, England : 2003)","2014","43","43","16265","16269","10.1039/c4dt01575d","","","0.71073","MoKα","","0.0684","0.0604","","","0.182","0.1869","","","","","","1.104","","","","has coordinates","180023","2020-10-21","18:00:00",""
"7032743","20.903","0.009","20.903","0.009","31.72","0.03","90","","90","","90","","13860","16","90","2","90","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C44 H42 Hg -","- C44 H42 Hg -","- C704 H672 Hg16 -","16","1","","Blundell, Toby J.; Hastings, Fiona R.; Gridley, Benjamin M.; Moxey, Graeme J.; Lewis, William; Blake, Alexander J.; Kays, Deborah L.","Ligand influences on homoleptic Group 12 m-terphenyl complexes.","Dalton transactions (Cambridge, England : 2003)","2014","43","38","14257","14264","10.1039/c4dt00647j","","","0.71073","MoKα","","0.0734","0.0427","","","0.0775","0.0865","","","","","","1.06","","","","has coordinates","180033","2020-10-21","18:00:00",""
"7033097","28.236","0.011","28.236","0.011","10.94","0.005","90","","90","","90","","8722","6","296","2","296","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C32 H104 Cl4 N20 O8 Se10 Sn4 Y4 -","- C32 H96 Cl4 N20 O4 Se10 Sn4 Y4 -","- C128 H384 Cl16 N80 O16 Se40 Sn16 Y16 -","4","0.25","","Zhou, Jian; Xiao, Hong; Xiao, Hong-Ping; Yang, Tao; Zou, Hua-Hong; Liu, Xing; Zhao, Rong-Qing; Tang, Qiuling","Two types of lanthanide selenidostannates(IV) first prepared under the same solvothermal conditions.","Dalton transactions (Cambridge, England : 2003)","2015","44","3","1350","1357","10.1039/c4dt03099k","","","0.71073","MoKα","","0.0565","0.047","","","0.1336","0.1392","","","","","","1.096","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7033098","28.239","0.0002","28.239","0.0002","11.038","0.0002","90","","90","","90","","8802.16","0.18","296","2","296","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C32 H104 Cl4 Dy4 N20 O8 Se10 Sn4 -","- C32 H96 Cl4 Dy4 N20 O4 Se10 Sn4 -","- C128 H384 Cl16 Dy16 N80 O16 Se40 Sn16 -","4","0.25","","Zhou, Jian; Xiao, Hong; Xiao, Hong-Ping; Yang, Tao; Zou, Hua-Hong; Liu, Xing; Zhao, Rong-Qing; Tang, Qiuling","Two types of lanthanide selenidostannates(IV) first prepared under the same solvothermal conditions.","Dalton transactions (Cambridge, England : 2003)","2015","44","3","1350","1357","10.1039/c4dt03099k","","","0.71073","MoKα","","0.0405","0.0295","","","0.0641","0.0676","","","","","","1.085","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7033099","28.1622","0.0003","28.1622","0.0003","11.0089","0.0003","90","","90","","90","","8731.3","0.3","296","2","296","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C32 H104 Cl4 Er4 N20 O8 Se10 Sn4 -","- C32 H96 Cl4 Er4 N20 O4 Se10 Sn4 -","- C128 H384 Cl16 Er16 N80 O16 Se40 Sn16 -","4","0.25","","Zhou, Jian; Xiao, Hong; Xiao, Hong-Ping; Yang, Tao; Zou, Hua-Hong; Liu, Xing; Zhao, Rong-Qing; Tang, Qiuling","Two types of lanthanide selenidostannates(IV) first prepared under the same solvothermal conditions.","Dalton transactions (Cambridge, England : 2003)","2015","44","3","1350","1357","10.1039/c4dt03099k","","","0.71073","MoKα","","0.03","0.0244","","","0.0606","0.063","","","","","","1.06","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7033100","28.208","0.0003","28.208","0.0003","11.0142","0.0003","90","","90","","90","","8763.9","0.3","296","2","296","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C32 H104 Cl4 N20 O8 Se10 Sn4 Tm4 -","- C32 H96 Cl4 N20 O4 Se10 Sn4 Tm4 -","- C128 H384 Cl16 N80 O16 Se40 Sn16 Tm16 -","4","0.25","","Zhou, Jian; Xiao, Hong; Xiao, Hong-Ping; Yang, Tao; Zou, Hua-Hong; Liu, Xing; Zhao, Rong-Qing; Tang, Qiuling","Two types of lanthanide selenidostannates(IV) first prepared under the same solvothermal conditions.","Dalton transactions (Cambridge, England : 2003)","2015","44","3","1350","1357","10.1039/c4dt03099k","","","0.71073","MoKα","","0.0388","0.0301","","","0.0735","0.0773","","","","","","1.092","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7033412","18.1586","0.0014","18.1586","0.0014","14.416","0.002","90","","90","","90","","4753.5","0.8","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C11 H9 Cd O6 -","- C11 H9 Cd O6 -","- C176 H144 Cd16 O96 -","16","1","","Wu, Yunlong; Yang, Guo-Ping; Zhao, Yanqing; Wu, Wei-Ping; Liu, Bo; Wang, Yao-Yu","Three new solvent-directed Cd(ii)-based MOFs with unique luminescent properties and highly selective sensors for Cu(2+) cations and nitrobenzene.","Dalton transactions (Cambridge, England : 2003)","2015","44","7","3271","3277","10.1039/c4dt03415e","","","0.71073","MoKα","","0.0306","0.0283","","","0.0986","0.1006","","","","","","1.038","","","","has coordinates","180040","2020-10-21","18:00:00",""
"7033877","23.1255","0.0004","23.1255","0.0004","12.3948","0.0005","90","","90","","90","","6628.6","0.3","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C20 H4 Cl2 F24 O9 Ti2 -","- C20 H4 Cl2 F24 O9 Ti2 -","- C160 H32 Cl16 F192 O72 Ti16 -","8","0.5","","Kuhn, A.; Conradie, J.","Observed hydrolysis of fluorine substituted bis(β-diketonato)-dichlorotitanium(iv) complexes.","Dalton transactions (Cambridge, England : 2003)","2015","44","11","5106","5113","10.1039/c4dt02614d","","","0.71073","MoKα","","0.0454","0.0357","","","0.0812","0.0871","","","","","","1.017","","","","has coordinates","180044","2020-10-21","18:00:00",""
"7034153","22.683","0.002","22.683","0.002","11.5196","0.0009","90","","90","","90","","5927","0.9","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C48 H48 Mn4 N12 O12 -","- C48 H48 Mn4 N12 O12 -","- C192 H192 Mn16 N48 O48 -","4","0.25","","Yang, Hua; Cao, Fan; Li, Dacheng; Zeng, Suyuan; Song, You; Dou, Jianmin","Solvent dependent reactivities of di-, tetra- and hexanuclear manganese complexes: syntheses, structures and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2015","44","14","6620","6629","10.1039/c4dt03822c","","","0.71073","MoKα","","0.1603","0.0647","","","0.1423","0.1582","","","","","","1.009","","","","has coordinates","180047","2020-10-21","18:00:00",""
"7034243","36.3651","0.0006","36.3651","0.0006","14.855","0.0003","90","","90","","90","","19644.6","0.6","183","2","183","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","(2-[bis(1-methylethyl)phosphanyl-κ<i>P</i>]-<i>N</i>-{2-[bis(1-methylethyl)phosphanyl-κ<i>P</i>]ethyl}ethanamine-κ<i>N</i>)(carbonyl)(formato-κ<i>O</i>)(nitrosyl)tungsten tetrahydrofuran solvate (8/1)","","- C148 H312 N16 O33 P16 W8 -","- C148 H312 N16 O33 P16 W8 -","- C592 H1248 N64 O132 P64 W32 -","4","0.25","","Chakraborty, Subrata; Blacque, Olivier; Berke, Heinz","Ligand assisted carbon dioxide activation and hydrogenation using molybdenum and tungsten amides.","Dalton transactions (Cambridge, England : 2003)","2015","44","14","6560","6570","10.1039/c5dt00278h","","","0.71073","MoKα","","0.0972","0.0488","","","0.0619","0.0744","","","","","","0.987","","","","has coordinates,has disorder","180048","2020-10-21","18:00:00",""
"7035013","12.3057","0.0004","12.3057","0.0004","20.5539","0.0007","90","","90","","90","","3112.48","0.18","294","2","294","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C16 H24 Cl2 N8 O8 S4 Zn -","- C16 H24 Cl2 N8 O8 S4 Zn -","- C64 H96 Cl8 N32 O32 S16 Zn4 -","4","0.25","","Isaia, Francesco; Aragoni, Maria Carla; Arca, Massimiliano; Bettoschi, Alexandre; Caltagirone, Claudia; Castellano, Carlo; Demartin, Francesco; Lippolis, Vito; Pivetta, Tiziana; Valletta, Elisa","Zinc(ii)-methimazole complexes: synthesis and reactivity.","Dalton transactions (Cambridge, England : 2003)","2015","44","21","9805","9814","10.1039/c5dt00917k","","","0.71073","MoKα","","0.0434","0.0341","","","0.1022","0.109","","","","","","1.066","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7036110","37.392","0.003","37.392","0.003","10.8529","0.0013","90","","90","","90","","15174","3","100","","100","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C42 H42 B N3 P2 Se -","- C42 H42 B N3 P2 Se -","- C672 H672 B16 N48 P32 Se16 -","16","1","","Jaiswal, Kuldeep; Prashanth, Billa; Ravi, Satyam; Shamasundar, K. R.; Singh, Sanjay","Reactivity of a dihydroboron species: synthesis of a hydroborenium complex and an expedient entry into stable thioxo- and selenoxo-boranes.","Dalton transactions (Cambridge, England : 2003)","2015","44","36","15779","15785","10.1039/c5dt02788h","","","0.71073","MoKα","","0.0822","0.0632","","","0.1326","0.1459","","","","","","1.102","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7036399","21.4058","0.0009","21.4058","0.0009","35.1534","0.0016","90","","90","","90","","16107.6","1.2","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C34.25 H50.5 Cl6.5 Fe N4 -","- C34.25 H50.5 Cl6.5 Fe N4 -","- C548 H808 Cl104 Fe16 N64 -","16","1","","Drake, Jessica L.; Kaplan, Hilan Z.; Wilding, Matthew J. T.; Li, Bo; Byers, Jeffery A.","Spin transitions in bis(amidinato)-N-heterocyclic carbene iron(ii) and iron(iii) complexes.","Dalton transactions (Cambridge, England : 2003)","2015","44","38","16703","16707","10.1039/c5dt02440d","","","0.71073","MoKα","","0.0559","0.0433","","","0.1152","0.1253","","","","","","1.078","","","","has coordinates,has disorder","176429","2020-10-21","18:00:00",""
"7036400","21.3621","0.0004","21.3621","0.0004","35.3633","0.0007","90","","90","","90","","16137.7","0.5","200","2","200","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C34 H50 Cl6 Fe N4 -","- C34 H50 Cl6 Fe N4 -","- C544 H800 Cl96 Fe16 N64 -","16","1","","Drake, Jessica L.; Kaplan, Hilan Z.; Wilding, Matthew J. T.; Li, Bo; Byers, Jeffery A.","Spin transitions in bis(amidinato)-N-heterocyclic carbene iron(ii) and iron(iii) complexes.","Dalton transactions (Cambridge, England : 2003)","2015","44","38","16703","16707","10.1039/c5dt02440d","","","1.54178","CuKα","","0.0455","0.0415","","","0.1133","0.117","","","","","","1.029","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7036401","21.4369","0.0004","21.4369","0.0004","35.4666","0.0008","90","","90","","90","","16298.3","0.6","200","2","200","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C34 H50 Cl6 Fe N4 -","- C34 H50 Cl6 Fe N4 -","- C544 H800 Cl96 Fe16 N64 -","16","1","","Drake, Jessica L.; Kaplan, Hilan Z.; Wilding, Matthew J. T.; Li, Bo; Byers, Jeffery A.","Spin transitions in bis(amidinato)-N-heterocyclic carbene iron(ii) and iron(iii) complexes.","Dalton transactions (Cambridge, England : 2003)","2015","44","38","16703","16707","10.1039/c5dt02440d","","","1.54178","CuKα","","0.0484","0.0425","","","0.1148","0.1198","","","","","","1.027","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7036402","21.5767","0.0007","21.5767","0.0007","35.5041","0.0014","90","","90","","90","","16529.1","1","250","2","250","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C34 H50 Cl6 Fe N4 -","- C34 H50 Cl6 Fe N4 -","- C544 H800 Cl96 Fe16 N64 -","16","1","","Drake, Jessica L.; Kaplan, Hilan Z.; Wilding, Matthew J. T.; Li, Bo; Byers, Jeffery A.","Spin transitions in bis(amidinato)-N-heterocyclic carbene iron(ii) and iron(iii) complexes.","Dalton transactions (Cambridge, England : 2003)","2015","44","38","16703","16707","10.1039/c5dt02440d","","","1.54178","CuKα","","0.0639","0.052","","","0.145","0.1557","","","","","","1.02","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7036559","5.172556","0.00009","5.172556","0.00009","11.39257","0.0002","90","","90","","90","","304.812","0.009","300","","300","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Ag Lu Mo2 O8 -","- Ag Lu Mo2 O8 -","- Ag2 Lu2 Mo4 O16 -","2","0.125","","Cheng, Fangrui; Xia, Zhiguo; Molokeev, Maxim S.; Jing, Xiping","Effects of composition modulation on the luminescence properties of Eu(3+) doped Li1-xAgxLu(MoO4)2 solid-solution phosphors.","Dalton transactions (Cambridge, England : 2003)","2015","44","41","18078","18089","10.1039/c5dt02760h","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.31","1.835","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"7036560","5.26334","0.000022","5.26334","0.000022","11.543334","0.000056","90","","90","","90","","319.782","0.002","300","","300","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Ag Eu Mo2 O8 -","- Ag Eu Mo2 O8 -","- Ag2 Eu2 Mo4 O16 -","2","0.125","","Cheng, Fangrui; Xia, Zhiguo; Molokeev, Maxim S.; Jing, Xiping","Effects of composition modulation on the luminescence properties of Eu(3+) doped Li1-xAgxLu(MoO4)2 solid-solution phosphors.","Dalton transactions (Cambridge, England : 2003)","2015","44","41","18078","18089","10.1039/c5dt02760h","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","0.26","3.861","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"7036561","5.10332","0.00011","5.10332","0.00011","11.0829","0.00027","90","","90","","90","","288.642","0.011","300","","300","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Li Lu Mo2 O8 -","- Li Lu Mo2 O8 -","- Li2 Lu2 Mo4 O16 -","2","0.125","","Cheng, Fangrui; Xia, Zhiguo; Molokeev, Maxim S.; Jing, Xiping","Effects of composition modulation on the luminescence properties of Eu(3+) doped Li1-xAgxLu(MoO4)2 solid-solution phosphors.","Dalton transactions (Cambridge, England : 2003)","2015","44","41","18078","18089","10.1039/c5dt02760h","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","0.9","2.445","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"7036562","5.202625","0.000016","5.202625","0.000016","11.338236","0.000045","90","","90","","90","","306.896","0.0018","300","","300","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Eu Li Mo2 O8 -","- Eu Li Mo2 O8 -","- Eu2 Li2 Mo4 O16 -","2","0.125","","Cheng, Fangrui; Xia, Zhiguo; Molokeev, Maxim S.; Jing, Xiping","Effects of composition modulation on the luminescence properties of Eu(3+) doped Li1-xAgxLu(MoO4)2 solid-solution phosphors.","Dalton transactions (Cambridge, England : 2003)","2015","44","41","18078","18089","10.1039/c5dt02760h","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","0.34","2.748","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"7036820","31.6465","0.0007","31.6465","0.0007","30.383","0.0008","90","","90","","90","","30428.6","1.2","120","","120","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C86 H80 Cl2 N4 Ni3 O P6 -","- C86 H80 Cl2 N4 Ni3 O P6 -","- C1376 H1280 Cl32 N64 Ni48 O16 P96 -","16","1","","Evers-McGregor, Deirdra A; Bezpalko, Mark W.; Foxman, Bruce M.; Thomas, Christine M.","N-heterocyclic phosphenium and phosphido nickel complexes supported by a pincer ligand framework.","Dalton transactions (Cambridge, England : 2003)","2016","45","5","1918","1929","10.1039/c5dt03549j","","","0.71073","MoKα","","0.0657","0.0409","","0.0959","0.0873","0.0959","","","","","","1.0109","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7037230","40.556","0.005","40.556","0.005","12.276","0.005","90","0.005","90","0.005","90","0.005","20191","9","100","2","100","2","","","","","","","","8","I 41/a :2","-I 4ad","88","dh2_135c","dh2_135c","","- C616 H716 Co16 F288 N196 O32 P48 Ru16 -","- C616 H716 Co16 F288 N196 O32 P48 Ru16 -","- C616 H716 Co16 F288 N196 O32 P48 Ru16 -","1","0.0625","","Henckel, Danielle A.; Lin, Yuting F.; McCormick, Theresa M.; Kaminsky, Werner; Cossairt, Brandi M.","A doubly deprotonated diimine dioximate metalloligand as a synthon for multimetallic complex assembly.","Dalton transactions (Cambridge, England : 2003)","2016","45","24","10068","10075","10.1039/c5dt03650j","","","0.71073","MoKα","","0.27","0.0861","","","0.1621","0.2331","","","","","","0.991","","","","has coordinates,has disorder","185385","2020-10-21","18:00:00",""
"7037733","58.317","0.006","58.317","0.006","16.7336","0.0018","90","","90","","90","","56909","10","150","2","150","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","[nPr2NH2][Cr7NiF8(O2C5H9)(O2CC5H4N)]2[Co2(O2C5H9)4]","","- C194 H346 Co2 Cr14 F16 N4 Ni2 O72 -","- C194 H346 Co2 Cr14 F16 N4 Ni2 O72 -","- C1552 H2768 Co16 Cr112 F128 N32 Ni16 O576 -","8","0.5","","Whitehead, George F. S.; Ferrando-Soria, Jesús; Carthy, Laura; Pritchard, Robin G.; Teat, Simon J.; Timco, Grigore A.; Winpenny, Richard E. P.","Synthesis and reactions of N-heterocycle functionalised variants of heterometallic {Cr7Ni} rings.","Dalton transactions (Cambridge, England : 2003)","2016","45","4","1638","1647","10.1039/c5dt04062k","","x-ray","1.54178","CuKα","","0.1616","0.0791","","","0.1892","0.225","","","","","","1.05","","","","has coordinates","176005","2020-10-21","18:00:00",""
"7039730","18.0191","0.0006","18.0191","0.0006","37.65","0.003","90","","90","","90","","12224.5","1.1","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C35 H35 Mn N2 O4 -","- C35 H35 Mn N2 O4 -","- C560 H560 Mn16 N32 O64 -","16","1","","Valyaev, Dmitry A.; Uvarova, Marina A.; Grineva, Alina A.; César, Vincent; Nefedov, Sergei N.; Lugan, Noël","Post-coordination backbone functionalization of an imidazol-2-ylidene and its application to synthesize heteropolymetallic complexes incorporating the ambidentate IMes(CO2(-)) ligand.","Dalton transactions (Cambridge, England : 2003)","2016","45","30","11953","11957","10.1039/c6dt02060g","","x-ray","0.71073","MoKα","","0.0607","0.0404","","","0.1002","0.1131","","","","","","1.035","","","","has coordinates","185320","2020-10-21","18:00:00",""
"7040528","5.242071","0.000096","5.242071","0.000096","11.46775","0.00023","90","","90","","90","","315.126","0.01","300","","300","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- Ca1.33 Er0.07 La0.67 Mo4 Na1.33 O16 Yb0.6 -","- Ca1.33333 Er0.0666667 La0.666667 Mo4 Na1.33333 O16 Yb0.6 -","- Ca1.33333 Er0.0666667 La0.666667 Mo4 Na1.33333 O16 Yb0.6 -","1","0.0625","","Lim, Chang Sung; Aleksandrovsky, Aleksandr S.; Molokeev, Maxim S.; Oreshonkov, Aleksandr S.; Ikonnikov, Denis A.; Atuchin, Victor V.","Triple molybdate scheelite-type upconversion phosphor NaCaLa(MoO4)3:Er(3+)/Yb(3+): structural and spectroscopic properties.","Dalton transactions (Cambridge, England : 2003)","2016","45","39","15541","15551","10.1039/c6dt02378a","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.65","1.116","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"7040529","5.29916","0.00013","5.29916","0.00013","11.62227","0.00028","90","","90","","90","","326.366","0.014","300","","300","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- Ca1.33 La1.33 Mo4 Na1.33 O16 -","- Ca1.33333 La1.33333 Mo4 Na1.33333 O16 -","- Ca1.33333 La1.33333 Mo4 Na1.33333 O16 -","1","0.0625","","Lim, Chang Sung; Aleksandrovsky, Aleksandr S.; Molokeev, Maxim S.; Oreshonkov, Aleksandr S.; Ikonnikov, Denis A.; Atuchin, Victor V.","Triple molybdate scheelite-type upconversion phosphor NaCaLa(MoO4)3:Er(3+)/Yb(3+): structural and spectroscopic properties.","Dalton transactions (Cambridge, England : 2003)","2016","45","39","15541","15551","10.1039/c6dt02378a","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","5.29","1.2","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"7040530","5.26749","0.00013","5.26749","0.00013","11.53772","0.00032","90","","90","","90","","320.131","0.014","300","","300","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- Ca1.33 Er0.13 La0.93 Mo4 Na1.33 O16 Yb0.27 -","- Ca1.33333 Er0.133333 La0.933333 Mo4 Na1.33333 O16 Yb0.266667 -","- Ca1.33333 Er0.133333 La0.933333 Mo4 Na1.33333 O16 Yb0.266667 -","1","0.0625","","Lim, Chang Sung; Aleksandrovsky, Aleksandr S.; Molokeev, Maxim S.; Oreshonkov, Aleksandr S.; Ikonnikov, Denis A.; Atuchin, Victor V.","Triple molybdate scheelite-type upconversion phosphor NaCaLa(MoO4)3:Er(3+)/Yb(3+): structural and spectroscopic properties.","Dalton transactions (Cambridge, England : 2003)","2016","45","39","15541","15551","10.1039/c6dt02378a","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","2.09","1.15","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"7040531","5.28062","0.00015","5.28062","0.00015","11.57258","0.00034","90","","90","","90","","322.701","0.016","300","","300","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- Ca1.33 Er0.27 La1.07 Mo4 Na1.33 O16 -","- Ca1.33333 Er0.266667 La1.06667 Mo4 Na1.33333 O16 -","- Ca1.33333 Er0.266667 La1.06667 Mo4 Na1.33333 O16 -","1","0.0625","","Lim, Chang Sung; Aleksandrovsky, Aleksandr S.; Molokeev, Maxim S.; Oreshonkov, Aleksandr S.; Ikonnikov, Denis A.; Atuchin, Victor V.","Triple molybdate scheelite-type upconversion phosphor NaCaLa(MoO4)3:Er(3+)/Yb(3+): structural and spectroscopic properties.","Dalton transactions (Cambridge, England : 2003)","2016","45","39","15541","15551","10.1039/c6dt02378a","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","3.15","1.126","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"7041199","16.814","0.005","16.814","0.005","14.083","0.004","90","","90","","90","","3981","2","113","","113","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H26 N4 O4 Pt -","- C20 H26 N4 O4 Pt -","- C160 H208 N32 O32 Pt8 -","8","0.5","","Hashimoto, Takumi; Fukumoto, Kanako; Le, Ngoc Ha-Thu; Matsuoka, Tatsuya; Kawamorita, Soichiro; Komiya, Naruyoshi; Naota, Takeshi","Dynamic neighbouring participation of nitrogen lone pairs on the chromogenic behaviour of trans-bis(salicylaldiminato)Pt(ii) coordination platforms.","Dalton transactions (Cambridge, England : 2003)","2016","45","48","19257","19268","10.1039/c6dt04005e","","","0.71075","MoKα","","","0.0199","","","","0.0632","","","","","","1.273","","","","has coordinates","190142","2020-10-21","18:00:00",""
"7041396","38.1049","0.0009","38.1049","0.0009","14.2257","0.0007","90","","90","","90","","20655.5","1.2","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C91 H90 Au2 Cl8 O8 P6 Pt -","- C88 H84 Au2 Cl2 O8 P6 Pt -","- C704 H672 Au16 Cl16 O64 P48 Pt8 -","8","0.5","","Zhang, Li-Yi; Xu, Liang-Jin; Wang, Jin-Yun; Zeng, Xian-Chong; Chen, Zhong-Ning","Photoluminescence and electroluminescence of cationic PtAu2 heterotrinuclear complexes with aromatic acetylides.","Dalton transactions (Cambridge, England : 2003)","2017","46","3","865","874","10.1039/c6dt04249j","","","0.71073","MoKα","","0.0574","0.0468","","","0.1219","0.1291","","","","","","1.055","","","","has coordinates,has disorder","191626","2020-10-21","18:00:00",""
"7041948","19.7293","0.0005","19.7293","0.0005","30.589","0.0017","90","","90","","90","","11906.6","0.8","294","2","294","2","","","","","","","synthetic","7","I 41/a :2","-I 4ad","88","","Bis(1-(4-phenyl-1,3-selenazol-2-yl)-2-(pyridin-2-ylmethylene)hydrazin-1-ide- Cobalt(III) tetrafluoridoborate","","- C30 H22 B Co F4 N8 Se2 -","- C30 H22 B Co F4 N8 Se2 -","- C480 H352 B16 Co16 F64 N128 Se32 -","16","1","","Filipović, Nenad R; Elshaflu, Hana; Grubišić, Sonja; Jovanović, Ljiljana S; Rodić, Marko; Novaković, Irena; Malešević, Aleksandar; Djordjević, Ivana S; Li, Haidong; Šojić, Nešo; Marinković, Aleksandar; Todorović, Tamara R","Co(iii) complexes of (1,3-selenazol-2-yl)hydrazones and their sulphur analogues.","Dalton transactions (Cambridge, England : 2003)","2017","46","9","2910","2924","10.1039/c6dt04785h","","x-ray","0.71073","MoKα","","0.1271","0.0557","","","0.0906","0.114","","","","","","1.008","","","","has coordinates","193843","2020-10-21","18:00:00",""
"7041950","19.716","0.0003","19.716","0.0003","30.3333","0.0006","90","","90","","90","","11791.2","0.3","294","2","294","2","","","","","","","synthetic","7","I 41/a :2","-I 4ad","88","","Bis(1-(4-phenylthiazol-2-yl)-2-(pyridin-2-ylmethylene)hydrazin-1-ide)- Cobalt(III) tetrafluoridoborate","","- C30 H22 B Co F4 N8 S2 -","- C30 H22 B Co F4 N8 S2 -","- C480 H352 B16 Co16 F64 N128 S32 -","16","1","","Filipović, Nenad R; Elshaflu, Hana; Grubišić, Sonja; Jovanović, Ljiljana S; Rodić, Marko; Novaković, Irena; Malešević, Aleksandar; Djordjević, Ivana S; Li, Haidong; Šojić, Nešo; Marinković, Aleksandar; Todorović, Tamara R","Co(iii) complexes of (1,3-selenazol-2-yl)hydrazones and their sulphur analogues.","Dalton transactions (Cambridge, England : 2003)","2017","46","9","2910","2924","10.1039/c6dt04785h","","x-ray","0.71073","MoKα","","0.0843","0.05","","","0.117","0.1327","","","","","","1.022","","","","has coordinates","193843","2020-10-21","18:00:00",""
"7042161","24.003","0.003","24.003","0.003","85.886","0.013","90","","90","","90","","49483","12","100","","100","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C192 H220 Ga70 N36 S112 -","- C192 H220 Ga70 N36 S112 -","- C768 H880 Ga280 N144 S448 -","4","0.25","","Vaqueiro, P.; Makin, S.; Tong, Y.; Ewing, S. J.","A new class of hybrid super-supertetrahedral cluster and its assembly into a five-fold interpenetrating network.","Dalton transactions (Cambridge, England : 2003)","2017","46","12","3816","3819","10.1039/c7dt00280g","","","0.71073","MoKα","","0.128","0.0709","","0.1517","0.0755","0.0719","","","","","","1.1295","","","","has coordinates","195121","2020-10-21","18:00:00",""
"7044828","16.7858","0.0013","16.7858","0.0013","34.934","0.004","90","","90","","90","","9843.1","1.6","128","2","128","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C23.5 H31 Br Cl N3 Ni O2 -","- C23.5 H29 Br Cl N3 Ni O2 -","- C376 H464 Br16 Cl16 N48 Ni16 O32 -","16","1","","Yang, Dandan; Dong, Jie; Wang, Baiquan","Homo- and copolymerization of norbornene with tridentate nickel complexes bearing o-aryloxide-N-heterocyclic carbene ligands.","Dalton transactions (Cambridge, England : 2003)","2018","47","1","180","189","10.1039/c7dt03928j","","","0.71073","MoKα","","0.0349","0.0279","","","0.079","0.0808","","","","","","1.059","","","","has coordinates,has disorder","229391","2020-10-21","18:00:00",""
"7045356","20.9243","0.0001","20.9243","0.0001","23.8905","0.0002","90","","90","","90","","10459.9","0.11","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C54 H76 Cl2 N4 Si2 -","- C54 H76 Cl2 N4 Si2 -","- C432 H608 Cl16 N32 Si16 -","8","0.5","","Xiong, Yun; Yao, Shenglai; Kostenko, Arseni; Driess, Matthias","An isolable β-diketiminato chlorosilylene.","Dalton transactions (Cambridge, England : 2003)","2018","47","7","2152","2155","10.1039/c8dt00121a","","","1.54184","CuKα","","0.046","0.0404","","","0.1075","0.1149","","","","","","1.029","","","","has coordinates","229791","2020-10-21","18:00:00",""
"7047624","7.8032","0.0003","7.8032","0.0003","31.528","0.003","90","","90","","90","","1919.7","0.2","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C2 H8 N2 Se4 Sn Zn2 -","- C2 H8 N2 Se4 Sn Zn2 -","- C8 H32 N8 Se16 Sn4 Zn8 -","4","0.25","","Luo, Hai-Ying; Zhou, Jian","A series of new hybrid selenidostannates with metal complexes prepared in alkylol amines.","Dalton transactions (Cambridge, England : 2003)","2018","47","41","14751","14759","10.1039/c8dt03322f","","","0.71073","MoKα","","0.0825","0.0553","","","0.1648","0.1853","","","","","","1.063","","","","has coordinates,has disorder","229353","2020-10-21","18:00:00",""
"7050042","26.7896","0.0005","26.7896","0.0005","22.2608","0.0004","90","","90","","90","","15976.2","0.5","183.2","","183.2","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C29 H11 Cl3 F20 O P2 Re -","- C26 H4 Cl3 F20 O P2 Re -","- C416 H64 Cl48 F320 O16 P32 Re16 -","16","1","","Parr, Maria L.; Perez-Acosta, Carmen; Faller, J. W.","Synthesis, characterization and structural investigation of new rhenium-oxo complexes containing bidentate phosphine ligands: an exploration of chirality and conformation in chelate rings of small and large bite angle ligands","New Journal of Chemistry","2005","29","4","613","","10.1039/b412818d","","","0.7107","MoKα","","0.0535","0.031","","0.042","","0.038","","","0.866","","","1.03","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050677","22.2498","0.0005","22.2498","0.0005","13.304","0.0004","90","","90","","90","","6586.2","0.3","173","","173","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C76 H66 N8 O16 -","- C76 H40 N8 O16 -","- C304 H160 N32 O64 -","4","0.25","","Zimmer, Bertrand; Bulach, Véronique; Drexler, Cathy; Erhardt, Sabine; Hosseini, Mir Wais; De Cian, André","Design, synthesis, structural analysis and atropoisomerisation studies of polynucleating ligands based on porphyrins bearing catechol units","New Journal of Chemistry","2002","26","1","43","57","10.1039/b104084g","","","0.71073","Mo-Kα","","0.116","0.062","","0.087","","0.074","","","1.523","","","1.344","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050716","20.928","0.002","20.928","0.002","17.798","0.004","90","","90","","90","","7795","2","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C36.5 H41 Cl3 N2 O4 P2 Ru -","- C36.5 H40 Cl3 N2 O4 P2 Ru -","- C292 H320 Cl24 N16 O32 P16 Ru8 -","8","0.5","","Hai-Bin Song; Zheng-Zhi Zhang; Thomas C. W. Mak","Hetero-binuclear complexes containing a Ru0→Mn+ bond bridged by P,N-phosphine ligands: convenient synthesis of tridentate organometallic trans-Ru(CO)3(L)2(L=phosphine bearing an N-donor substituent) ligands","New J. Chem.","2002","26","1","113","119","10.1039/b108287f","","","0.71073","MoKα","","0.0893","0.0487","","","0.1274","0.1464","","","","","","1.043","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051116","18.9969","0.001","18.9969","0.001","13.3498","0.001","90","","90","","90","","4817.7","0.5","173","2","173","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C12 H22 N2 -","- C12 H22 N2 -","- C192 H352 N32 -","16","1","","Trofimenko, Swiatoslaw; Rheingold, Arnold L.; Liable-Sands, Louise M.; María Claramunt, Rosa; López, Concepción; Dolores Santa María, María; Elguero, Jose","The molecular structure of 4-tert-butylpyrazoles in the solid state and in solution: an X-ray, NMR and calorimetric study of the buttressing effect of a 4-tert-butyl substituent","New Journal of Chemistry","2001","25","6","819","","10.1039/b101733k","","","0.71073","MoKα","","0.1141","0.0609","","","0.1123","0.1388","","","","","","1.056","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051127","29.1337","0.0002","29.1337","0.0002","19.7246","0.0002","90","","90","","90","","16741.7","0.2","293","2","293","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C32 H41 Cu2 Mo N2 O P2 S5 -","- C32 H41 Cu2 Mo N2 O P2 S5 -","- C512 H656 Cu32 Mo16 N32 O16 P32 S80 -","16","1","","Fun, Hoong-Kun; Li, Feng; Niu, Yunyin; Song, Yinglin; Xin, Xinquan; Zheng, Hegen","","New Journal of Chemistry","2001","","","","","10.1039/b102238p","","","","","","","","","","","","","","","","","","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051471","16.504","0.001","16.504","0.001","30.677","0.002","90","","90","","90","","8355.9","0.9","153","2","153","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C36 H8 Ag4 F36 -","- C36 H8 Ag4 F36 -","- C288 H64 Ag32 F288 -","8","0.5","","Voelker, Heike; Labahn, Dieter; Bohnen, Frank-Michael; Herbst-Irmer, Regine; Stalke, Dietmar; Edelmann, Frank T.; Roesky, Herbert W.","Structural Diversity in Nonafluoromesityl Chemistry","New Journal of Chemistry","1999","","","","","10.1039/a903798e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","180068","2020-10-21","18:00:00",""
"7052040","18.795","0.0009","18.795","0.0009","29.9286","0.0019","90","","90","","90","","10572.3","1","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C23 H45 Ce0.5 Cl N2 Na0.5 -","- C23 H45 Ce0.5 Cl N2 Na0.5 -","- C368 H720 Ce8 Cl16 N32 Na8 -","16","1","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.0628","0.0333","","","0.0715","0.0798","","","","","","0.914","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052959","36.9262","0.0005","36.9262","0.0005","14.7933","0.0008","90","","90","","90","","20171.3","1.2","120","2","120","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C220 H238 Fe4 N4 O P8 Zn -","- C220 H238 Fe4 N4 O P8 Zn -","- C880 H952 Fe16 N16 O4 P32 Zn4 -","4","0.25","","Drouet, Samuel; Merhi, Areej; Grelaud, Guillaume; Cifuentes, Marie P.; Humphrey, Mark G.; Matczyszyn, Katarzyna; Samoc, Marek; Toupet, Loïc; Paul-Roth, Christine O.; Paul, Frédéric","Enhanced two-photon absorption cross-sections of zinc(II) tetraphenylporphyrins peripherally substituted with d6-metal alkynyl complexes","New Journal of Chemistry","2012","36","11","2192","","10.1039/c2nj40589j","","","0.71073","MoKα","","0.1684","0.1141","","","0.2885","0.3241","","","","","","1.133","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7053239","30.805","0.007","30.805","0.007","14.937","0.003","90","","90","","90","","14174","5","110","","110","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C39.07 H42.07 Cl0.22 N4 -","- C39.0731 H42.0731 Cl0.2193 N4 -","- C625.17 H673.17 Cl3.5088 N64 -","16","1","","Deans, Richard M.; Mass, Olga; Diers, James R.; Bocian, David F.; Lindsey, Jonathan S.","Serendipitous synthetic entrée to tetradehydro analogues of cobalamins","New Journal of Chemistry","2013","37","12","3964","","10.1039/c3nj00574g","","","0.71073","MoKα","","0.0963","0.053","","","0.1321","0.1543","","","","","","1.034","","","","has coordinates,has disorder","180086","2020-10-21","18:00:00",""
"7053284","9.7332","0.0004","9.7332","0.0004","29.9414","0.0012","90","","90","","90","","2836.5","0.2","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C3 H3 N2 O3 Rb S -","- C3 H3 N2 O3 Rb S -","- C48 H48 N32 O48 Rb16 S16 -","16","1","","Fernando, Isurika R.; Daskalakis, Nikos; Demadis, Konstantinos D.; Mezei, Gellert","Cation effect on the inorganic‒organic layered structure of pyrazole-4-sulfonate networks and inhibitory effects on copper corrosion","New Journal of Chemistry","2010","34","2","221","","10.1039/b9nj00361d","","","0.71073","MoKα","","0.0351","0.0259","","","0.1012","0.1169","","","","","","0.966","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053855","14.976","0.002","14.976","0.002","39.297","0.008","90","","90","","90","","8814","2","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C47 H53 N O10 -","- C47 H53 N O10 -","- C376 H424 N8 O80 -","8","0.5","","Tan, Li-Li; Zhang, Yumo; Li, Bao; Wang, Kai; Zhang, Sean Xiao-An; Tao, Yanchun; Yang, Ying-Wei","Selective recognition of “solvent” molecules in solution and the solid state by 1,4-dimethoxypillar[5]arene driven by attractive forces","New Journal of Chemistry","2014","38","2","845","","10.1039/c3nj01498c","","","0.71073","MoKα","","0.1983","0.084","","","0.1502","0.1862","","","","","","1.044","","","","has coordinates,has disorder","180092","2020-10-21","18:00:00",""
"7053856","14.928","0.004","14.928","0.004","39.286","0.01","90","","90","","90","","8755","4","153","2","153","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C46 H52 Cl2 O10 -","- C46 H52 Cl2 O10 -","- C368 H416 Cl16 O80 -","8","0.5","","Tan, Li-Li; Zhang, Yumo; Li, Bao; Wang, Kai; Zhang, Sean Xiao-An; Tao, Yanchun; Yang, Ying-Wei","Selective recognition of “solvent” molecules in solution and the solid state by 1,4-dimethoxypillar[5]arene driven by attractive forces","New Journal of Chemistry","2014","38","2","845","","10.1039/c3nj01498c","","","0.71073","MoKα","","0.0784","0.0519","","","0.1271","0.1398","","","","","","1.065","","","","has coordinates,has disorder","180092","2020-10-21","18:00:00",""
"7053857","15.03","0.002","15.03","0.002","40.076","0.008","90","","90","","90","","9053","2","291","2","291","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C49 H58 O12 -","- C49 H58 O12 -","- C392 H464 O96 -","8","0.5","","Tan, Li-Li; Zhang, Yumo; Li, Bao; Wang, Kai; Zhang, Sean Xiao-An; Tao, Yanchun; Yang, Ying-Wei","Selective recognition of “solvent” molecules in solution and the solid state by 1,4-dimethoxypillar[5]arene driven by attractive forces","New Journal of Chemistry","2014","38","2","845","","10.1039/c3nj01498c","","","0.71073","MoKα","","0.1173","0.0666","","","0.1788","0.2071","","","","","","1.064","","","","has coordinates,has disorder","180092","2020-10-21","18:00:00",""
"7053858","14.938","0.0005","14.938","0.0005","39.779","0.003","90","","90","","90","","8876.4","0.8","296","2","296","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C48 H56 O11 -","- C48 H56 O11 -","- C384 H448 O88 -","8","0.5","","Tan, Li-Li; Zhang, Yumo; Li, Bao; Wang, Kai; Zhang, Sean Xiao-An; Tao, Yanchun; Yang, Ying-Wei","Selective recognition of “solvent” molecules in solution and the solid state by 1,4-dimethoxypillar[5]arene driven by attractive forces","New Journal of Chemistry","2014","38","2","845","","10.1039/c3nj01498c","","","0.71073","MoKα","","0.1518","0.0622","","","0.1717","0.2206","","","","","","1.048","","","","has coordinates,has disorder","180092","2020-10-21","18:00:00",""
"7053981","24.074","0.004","24.074","0.004","5.1021","0.0016","90","","90","","90","","2957","1.2","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","[Cu2(1-tza)4]BF4.H3O.H2O","","","- C12 H19 B Cu2 F4 N16 O10 -","- C12 H12 B Cu2 F4 N16 O10 -","- C48 H48 B4 Cu8 F16 N64 O40 -","4","0.25","","Chen, Jun; Wang, Shuai-Hua; Liu, Zhi-Fa; Wu, Mei-Feng; Xiao, Yu; Zheng, Fa-Kun; Guo, Guo-Cong; Huang, Jin-Shun","Anion-directed self-assembly of Cu(ii) coordination compounds with tetrazole-1-acetic acid: syntheses in ionic liquids and crystal structures","New Journal of Chemistry","2014","38","1","269","","10.1039/c3nj01198d","","","0.71073","MoKα","","0.0862","0.0666","","","0.171","0.1875","","","","","","1.095","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054009","17.158","0.003","17.158","0.003","15.91","0.005","90","","90","","90","","4683.9","1.9","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C48 H48 Co N12 O8 -","- C48 H48 Co N12 O8 -","- C192 H192 Co4 N48 O32 -","4","0.25","","Dey, Soumyajit; Ikbal, Sk Asif; Rath, Sankar Prasad","Self-assembly of cobalt(ii) and zinc(ii) tetranitrooctaethylporphyrin via bidentate axial ligands: synthesis, structure, surface morphology and effect of axial coordination","New Journal of Chemistry","2014","38","4","1458","","10.1039/c3nj01248d","","","0.71073","MoKα","","0.0771","0.0577","","","0.1446","0.1615","","","","","","1.047","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054371","22.468","0.002","22.468","0.002","13.1835","0.0015","90","","90","","90","","6655.2","1.1","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","DMBBTS","","","- C18 H14 S2 Si -","- C18 H14 S2 Si -","- C288 H224 S32 Si16 -","16","1","","Zhao, Yunfang; Hao, Wanglong; Ma, Wangjing; Zang, Zhanzhan; Zhang, Huarong; Liu, Xiaoxia; Zou, Sufen; Zhang, Haixia; Liu, Weichao; Gao, Jianhua","Easily-soluble heteroacene bis(benzothieno)silole derivatives for sensing of nitro explosives","New J. Chem.","2014","38","12","5754","","10.1039/C4NJ00913D","","","0.71073","MoKα","","0.0647","0.0468","","","0.1211","0.1369","","","","","","1.053","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054706","21.71","0.003","21.71","0.003","6.8793","0.0011","90","","90","","90","","3242.4","0.8","273","2","273","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C5 H7 N5 O2 Zn -","- C5 H7 N5 O2 Zn -","- C80 H112 N80 O32 Zn16 -","16","1","","Salinas-Castillo, Alfonso; Calahorro, Antonio Jesús; Briones Gil, David; Fairen-Jimenez, David; gandara, felipe; Mendicute-Fierro, Claudio; Seco, José M; Perez-Mendoza, Manuel; Fernández, Belén; Rodriguez-Dieguez, Antonio","Adsorption and Luminescence Properties of First 2D-Cadmium MOF and Gismondine-Like Zinc Coordination Network Based on N-(2-tetrazolethyl)-4'-Glycine Linker","New J. Chem.","2015","","","","","10.1039/C5NJ00011D","","","0.71073","MoKα","","0.048","0.0381","","","0.0946","0.1001","","","","","","1.069","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054912","17.4781","0.0005","17.4781","0.0005","15.3714","0.0004","90","","90","","90","","4695.7","0.2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C22 H22 O4 Pd S4 -","- C22 H22 O4 Pd S4 -","- C176 H176 O32 Pd8 S32 -","8","0.5","","Yadav, Manoj Kumar; Rajput, Gunjan; Srivastava, Khushboo; Singh, Rakesh K.; Mishra, Rajnikant; Drew, Michael G. B.; Singh, Nanhai","Anti-leishmanial activity of Ni(ii), Pd(ii) and Pt(ii) β-oxodithioester complexes","New J. Chem.","2015","39","8","6358","","10.1039/C5NJ00765H","","","0.71073","MoKα","","0.0526","0.0327","","","0.075","0.0811","","","","","","1.076","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055977","19.167","0.017","19.167","0.017","16.153","0.015","90","","90","","90","","5934","9","296","2","296","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C24 H28 Br8 Cl16 Fe2 N8 O -","- C24 H28 Br8 Cl16 Fe2 N8 O -","- C96 H112 Br32 Cl64 Fe8 N32 O4 -","4","0.25","","Govor, Evgen V.; Sanakis, Yiannis; Raptis, Raphael G.","Synthesis of pyrazole (hemi)aminals via the cleavage of saturated aliphatic ether C‒O bonds in the presence of ferric halides","New J. Chem.","2017","41","6","2220","","10.1039/C6NJ03822K","","","0.71073","MoKα","","0.116","0.063","","","0.1668","0.2057","","","","","","1.004","","","","has coordinates","195156","2020-10-21","18:00:00",""
"7057860","21.534","0.003","21.534","0.003","15.908","0.003","90","","90","","90","","7377","2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C16 H9 Eu N0 O8 -","- C16 H9 Eu O8 -","- C256 H144 Eu16 O128 -","16","1","","Tao, Yufang; Zhang, Ping; Liu, Junning; Chen, Xiaodong; Guo, Xiuli; Jin, Haoqing; Chai, Juan; Wang, Li; Fan, Yong","Multi-responsive luminescent sensor based on three dimensional lanthanide metal‒organic framework","New Journal of Chemistry","2018","42","24","19485","","10.1039/C8NJ04601H","","","0.71073","MoKα","","0.0337","0.0291","","","0.0664","0.0682","","","","","","1.074","","","","has coordinates","230178","2020-10-21","18:00:00",""
"7059323","26.8502","0.0016","26.8502","0.0016","16.7797","0.0012","90","","90","","90","","12097","1.3","150","2","150","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C80 H104 Gd4 N16 O20 -","- C80 H104 Gd4 N16 O20 -","- C320 H416 Gd16 N64 O80 -","4","0.25","","Wang, Wen-Min; Wang, Mei-Jiao; Hao, Sha-Sha; Shen, Qin-Yu; Wang, Mei-Ling; Liu, Qiao-Ling; Guan, Xiao-Fen; Zhang, Xiu-Tang; Wu, Zhi-Lei","‘Windmill’-shaped LnIII4 (LnIII = Gd and Dy) clusters: magnetocaloric effect and single-molecule-magnet behavior","New Journal of Chemistry","2020","44","11","4631","4638","10.1039/C9NJ05317D","","","0.71073","MoKα","","0.1028","0.0558","","","0.1485","0.183","","","","","","1.03","","","","has coordinates","257887","2020-10-21","18:00:00",""
"7059324","26.902","0.0014","26.902","0.0014","13.9514","0.0009","90","","90","","90","","10096.9","1","150","2","150.01","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C88 H124 Dy4 N16 O24 -","- C88 H124 Dy4 N16 O24 -","- C352 H496 Dy16 N64 O96 -","4","0.25","","Wang, Wen-Min; Wang, Mei-Jiao; Hao, Sha-Sha; Shen, Qin-Yu; Wang, Mei-Ling; Liu, Qiao-Ling; Guan, Xiao-Fen; Zhang, Xiu-Tang; Wu, Zhi-Lei","‘Windmill’-shaped LnIII4 (LnIII = Gd and Dy) clusters: magnetocaloric effect and single-molecule-magnet behavior","New Journal of Chemistry","2020","44","11","4631","4638","10.1039/C9NJ05317D","","","0.71073","MoKα","","0.1627","0.0856","","","0.2116","0.2783","","","","","","1.092","","","","has coordinates,has disorder","257887","2020-10-21","18:00:00",""
"7059366","12.4234","0.0002","12.4234","0.0002","27.7432","0.0011","90","","90","","90","","4281.9","0.2","293","2","293","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C28 H48 B2 F10 N8 Se4 Zn -","- C28 H48 B2 F10 N8 Se4 Zn -","- C112 H192 B8 F40 N32 Se16 Zn4 -","4","0.25","","Vaddamanu, Moulali; Velappan, Kavitha; Prabusankar, Ganesan","Homoleptic and heteroleptic Zn(ii) selone catalysts for thioetherification of aryl halides without scrubbing oxygen","New Journal of Chemistry","2020","44","9","3574","3583","10.1039/C9NJ05818D","","","1.54184","CuKα","","0.0695","0.0536","","","0.1478","0.1735","","","","","","1.0413","","","","has coordinates","257822","2020-10-21","18:00:00",""
"7060302","13.266","0.0004","13.266","0.0004","28.9624","0.0012","90","","90","","90","","5097","0.3","143","2","143","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C48 H48 Cu4 N20 O14 -","- C48 H48 Cu4 N20 O14 -","- C192 H192 Cu16 N80 O56 -","4","0.25","","Nandi, Nishithendu Bikash; Purkayastha, Atanu; Roy, Shaktibrata; Kłak, Julia; Ganguly, Rakesh; Alkorta, Ibon; Misra, Tarun Kumar","Tetranuclear copper(ii) cubane complexes derived from self-assembled 1,3-dimethyl-5-(o-phenolate-azo)-6-aminouracil: structures, non-covalent interactions and magnetic property","New Journal of Chemistry","2021","45","5","2742","2753","10.1039/D0NJ05232A","","","1.54178","CuKα","","0.0776","0.0544","","","0.136","0.1526","","","","","","1.065","","","","has coordinates,has disorder","262685","2021-03-05","02:17:50",""
"7060338","17.2939","0.0014","17.2939","0.0014","34.055","0.003","90","","90","","90","","10185.1","1.5","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24 H43 Co N2 Si -","- C24 H43 Co N2 Si -","- C384 H688 Co16 N32 Si16 -","16","1","","Ertler, Daniel; Kuntze-Fechner, Maximilian W.; Dürr, Simon; Lubitz, Katharina; Radius, Udo","C‒F bond activation of perfluorinated arenes using NHC-stabilized cobalt half-sandwich complexes","New Journal of Chemistry","2021","45","33","14999","15016","10.1039/D0NJ06137A","","","0.71073","MoKα","","0.0401","0.0323","","","0.0815","0.0857","","","","","","1.072","","","","has coordinates","268869","2021-09-06","12:03:43",""
"7061009","16.6637","0.0003","16.6637","0.0003","23.1974","0.0006","90","","90","","90","","6441.4","0.2","298","","298","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C8 H60 Co4 Mo12 N16 O62 Si -","- C8 H60 Co4 Mo12 N16 O62 Si -","- C32 H240 Co16 Mo48 N64 O248 Si4 -","4","0.25","","Kuzman, Dino; Damjanović, Vladimir; Stilinović, Vladimir; Cindrić, Marina; Vrdoljak, Višnja","The role of mono- and dicarboxylic acids in the building of oxomolybdates containing {MoO4}, {Mo2O5}, {Mo2O6}, {Mo3O8}, {Mo5O17}, {Mo5O18}, {Mo8O26}, and {SiMo12O40} units","New Journal of Chemistry","2021","45","42","19764","19774","10.1039/D1NJ03280A","","x-ray","0.71073","MoKα","","0.0411","0.0315","","","0.07","0.0746","","","","","","1.087","","","","has coordinates","270480","2021-11-06","20:31:15",""
"7061172","18.03","0.03","18.03","0.03","20.39","0.04","90","","90","","90","","6628","2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C14 H15 N5 O4 S -","- C14 H15 N5 O4 S -","- C224 H240 N80 O64 S16 -","16","1","","Shyamsivappan, Selvaraj; Vivek, Raju; Suresh, Thangaraj; Naveen, Palanivel; Kaviyarasu, Adhigaman; Amsaveni, Sundarasamy; Athimoolam, Shunmuganarayanan; Mohan, Palathurai Subramaniam","New N-(3′-acetyl-8-nitro-2,3-dihydro-1H,3′H-spiro[quinoline-4,2′-[1,3,4]thiadiazol]-5′-yl) acetamides induced cell death in MCF-7 cells via G2/M phase cell cycle arrest","New Journal of Chemistry","2022","46","6","2817","2828","10.1039/D1NJ02550C","","","0.71073","MoKα","","0.0539","0.044","","","0.1151","0.1224","","","","","","1.078","","","","has coordinates","273390","2022-03-04","22:19:39",""
"7061530","23.2647","0.0018","23.2647","0.0018","9.6364","0.0007","90","","90","","90","","5215.7","0.7","296","2","296.15","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C10 H10 Cl N O4 Zn -","- C10 H10 Cl N O4 Zn -","- C160 H160 Cl16 N16 O64 Zn16 -","16","1","","Yan, Li; Li, Zhongkui; Xiong, Yan; Zhong, Xue; Peng, Shaochun; Li, Hui","Zinc(ii) Schiff base complexes as dual probes for the detection of NH4+ and HPO42− ions","New Journal of Chemistry","2022","46","27","12910","12917","10.1039/D2NJ01686A","","","0.71073","MoKα","","0.0532","0.0408","","","0.1118","0.1165","","","","","","1.083","","","","has coordinates","277128","2022-08-06","11:57:00",""
"7062056","20.2575","0.0003","20.2575","0.0003","47.4558","0.001","90","","90","","90","","19474.3","0.6","298","2","298","2","","","","","","","","11","I 41/a :2","-I 4ad","88","","","","- C167 H135 Cl15 F18 Fe4 N4 O18 P8 Pt4 S6 Se4 -","- C164 H132 Cl12 F12 Fe4 N4 O12 P8 Pt4 S4 Se4 -","- C656 H528 Cl48 F48 Fe16 N16 O48 P32 Pt16 S16 Se16 -","4","0.25","","Pal, M. K.; Majumdar, A. G.; Vivekananda, K. V.; Wadawale, A. P.; Subramanian, M.; Bhuvanesh, N.; Dey, S.","Anticancer activity of Pt-selenolate metallacycles","New Journal of Chemistry","2022","46","48","23198","23212","10.1039/D2NJ03931A","","x-ray","0.71073","MoKα","","0.051","0.0328","","","0.0849","0.0937","","","","","","0.848","","","","has coordinates,has disorder","280203","2023-01-06","09:54:49",""
"7062057","19.9324","0.0004","19.9324","0.0004","47.0921","0.0019","90","","90","","90","","18709.7","0.9","298","2","298","2","","","","","","","","10","I 41/a :2","-I 4ad","88","","","","- C165 H133 Cl9 F18 Fe4 N4 O18 P8 Pt4 S10 -","- C160 H128 F12 Fe4 N4 O12 P8 Pt4 S8 -","- C640 H512 F48 Fe16 N16 O48 P32 Pt16 S32 -","4","0.25","","Pal, M. K.; Majumdar, A. G.; Vivekananda, K. V.; Wadawale, A. P.; Subramanian, M.; Bhuvanesh, N.; Dey, S.","Anticancer activity of Pt-selenolate metallacycles","New Journal of Chemistry","2022","46","48","23198","23212","10.1039/D2NJ03931A","","x-ray","1.54184","CuKα","","0.0696","0.052","","","0.1426","0.157","","","","","","0.979","","","","has coordinates","280203","2023-01-06","09:54:49",""
"7062210","21.46514","0.00004","21.46514","0.00004","26.19638","0.00011","90","","90","","90","","12070","0.06","100","0.1","100","0.1","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C13 H14 N22 O18 -","- C13 H14 N22 O18 -","- C208 H224 N352 O288 -","16","1","","Parakhin, Vladimir V.; Pokhvisneva, Galina V.; Ternikova, Tatyana V.; Shlykova, Nina I.; Samigullina, Aida I.; Nikitin, Sergei V.; Gordeev, Pavel B.; Smirnov, Gennady A.; Kon’kova, Tatyana S.; Lempert, David B.; Pivkina, Alla N.","Linking polynitro hexaazaisowurtzitane cages via an N,N'-methylene bridge: a promising strategy for designing energetic ensembles of CL-20 derivatives and adjusting their properties","New Journal of Chemistry","2023","47","5","2444","2455","10.1039/D2NJ05332B","","x-ray","1.54184","CuKα","","0.0453","0.0435","","","0.1103","0.1119","","","","","","1.021","","","","has coordinates,has disorder","281516","2023-03-04","18:32:22",""
"7062211","21.5383","0.0001","21.5383","0.0001","26.3607","0.0002","90","","90","","90","","12228.7","0.12","99.98","0.1","99.98","0.1","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C13 H14 N22 O19 -","- C13 H14 N21.9997 O18.9997 -","- C208 H224 N351.995 O303.995 -","16","1","","Parakhin, Vladimir V.; Pokhvisneva, Galina V.; Ternikova, Tatyana V.; Shlykova, Nina I.; Samigullina, Aida I.; Nikitin, Sergei V.; Gordeev, Pavel B.; Smirnov, Gennady A.; Kon’kova, Tatyana S.; Lempert, David B.; Pivkina, Alla N.","Linking polynitro hexaazaisowurtzitane cages via an N,N'-methylene bridge: a promising strategy for designing energetic ensembles of CL-20 derivatives and adjusting their properties","New Journal of Chemistry","2023","47","5","2444","2455","10.1039/D2NJ05332B","","x-ray","1.54184","CuKα","","0.0508","0.0482","","","0.1192","0.121","","","","","","1.038","","","","has coordinates,has disorder","281516","2023-03-04","18:32:22",""
"7062262","21.6843","0.0002","21.6843","0.0002","9.7108","0.0002","90","","90","","90","","4566.1","0.11","200","2","200","2","","","","","","","no","2","I 41/a :2","-I 4ad","88","Me2Flu","9,9-dimethylfluorene","","- C15 H14 -","- C15 H14 -","- C240 H224 -","16","1","","Yoshizawa, Reina; Inagaki, Yusuke; Momma, Hiroyuki; Kwon, Eunsang; Ohara, Kazuaki; Yamaguchi, Kentaro; Setaka, Wataru","Synthesis and fluorescence properties of 9,9-dimethylfluorene-diyl bridged molecular gyrotops: effects of slight fluorophore motion on fluorescence efficiency in the solid state","New Journal of Chemistry","2023","47","12","5946","5952","10.1039/D2NJ05873A","","","1.54178","CuKα","","0.0564","0.0536","","","0.1285","0.1311","","","","","","1.078","","","","has coordinates","283423","2023-05-05","03:07:18",""
"7062432","11.9032","0.0001","11.9032","0.0001","41.3061","0.0007","90","","90","","90","","5852.5","0.12","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H20 Cu4 N16 Na4 O18 -","- C32 H20 Cu4 N16 Na4 O18 -","- C128 H80 Cu16 N64 Na16 O72 -","4","0.25","","Klongdee, Fatima; Sasada, Yuto; Nakano, Motohiro; Chainok, Kittipong; Youngme, Sujittra; Boonmak, Jaursup","Synthesis, X-ray structures, and magnetic properties of seven polynuclear Cu(ii) complexes containing pyrazole-3,5-dicarboxylate with various ancillary ligands","New Journal of Chemistry","2023","47","20","9669","9680","10.1039/D3NJ00821E","","","0.71073","MoKα","","0.0725","0.0588","","","0.1846","0.1926","","","","","","1.08","","","","has coordinates,has disorder","284297","2023-06-05","04:45:17",""
"7062725","11.494","0.0005","11.494","0.0005","35.533","0.004","90","","90","","90","","4694.3","0.6","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C44 H34 Cl2 Co N6 -","- C44 H34 Cl2 Co N6 -","- C176 H136 Cl8 Co4 N24 -","4","0.25","","Chen, Min; Sun, Dameng; Li, Jiahe; Wang, Zhiyuan; Liu, Hongming; Pan, Lixia; Chen, Hailan; Ma, Zhen","Cobalt(ii) terpyridine complexes: synthesis, characterization, antiproliferative activity and molecular docking with proteins and DNA","New Journal of Chemistry","2023","47","40","18785","18793","10.1039/D3NJ03445C","","","0.71073","MoKα","","0.0945","0.0695","","","0.2129","0.2407","","","","","","1.058","","","","has coordinates,has disorder","287401","2023-11-06","08:05:36",""
"7062881","28.4678","0.0008","28.4678","0.0008","6.3147","0.0002","90","","90","","90","","5117.5","0.3","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C20 H38 I2 N6 -","- C20 H38 I2 N6 -","- C160 H304 I16 N48 -","8","0.5","","Mesías-Salazar, Ángela; Rojas, René S.; Carrillo-Hermosilla, Fernando; Martínez, Javier; Antiñolo, Antonio; Trofymchuk, Oleksandra S.; Nachtigall, Fabiane M.; Santos, Leonardo S.; Daniliuc, Constantin G.","Guanidinium iodide salts as single component catalysts for CO2 to epoxide fixation","New Journal of Chemistry","2024","48","1","105","111","10.1039/D3NJ03959E","","","1.54178","CuKα","","0.0218","0.0197","","","0.0489","0.0518","","","","","","1.082","","","","has coordinates","289576","2024-02-04","12:19:09",""
"7062925","28.068","0.008","28.068","0.008","9.344","0.003","90","","90","","90","","7361","4","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C13 H24 Cu N4 O7 -","- C13 H24 Cu N4 O7 -","- C208 H384 Cu16 N64 O112 -","16","1","","Köse Yaman, Pelin; Demir, Sevde; Denizaltı, Serpil; Erer, Hakan; Yeşilel, Okan Zafer","A copper(ii) metal–organic framework with 2,2-dimethylglutarate and imidazole ligands: synthesis, characterization and catalytic performance for cycloaddition of CO2 to epoxides","New Journal of Chemistry","2024","48","4","1850","1855","10.1039/D3NJ04256A","","","0.71073","MoKα","","0.0676","0.0546","","","0.1028","0.1095","","","","","","1.201","","","","has coordinates","289590","2024-02-04","12:22:16",""
"7100620","18.053","0.014","18.053","0.014","16.603","0.005","90","","90","","90","","5411","6","294","","294","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C26 H42 N P2 Rh -","- C26 H40 N P2 Rh -","- C208 H320 N8 P16 Rh8 -","8","0.5","","","","Chemical Communications","2006","","","","","10.1039/b511148j","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7100729","25.47","0.05","25.471","","41.51","0.07","90","","90","","90","","26929","68","153","2","153","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C42 H57.5 Co N6 O20.75 Pr0.17 S4 -","- C42 H46 Co N6 O20.75 Pr0.17 S4 -","- C672 H736 Co16 N96 O332 Pr2.72 S64 -","16","1","","C.B. Smith; L.J. Barbour; M. Makha; C.L. Raston; A.N. Sobolev","Inclusion of Co(III) Sepulchrate Cations within the cavity of p-sulfonatocalix[4]arene: the effect of lanthanide(III) ions on the interplay of binary complex motifs","Chemical Communications","2006","","","","","10.1039/b515580k","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7100794","14.2642","0.0006","14.2642","0.0006","18.6642","0.0016","90","","90","","90","","3797.6","0.4","90","2","90","2","","","","","","","","5","I 41/a :2","-I 4ad","88","[Rh(i-PrNC)~4~]B(C~6~H~5~)~4~","","","- C40 H48 B N4 Rh -","- C40 H48 B N4 Rh -","- C160 H192 B4 N16 Rh4 -","4","0.25","","A.L. Balch; James C. Fettinger; Marilyn M. Olmstead; David Pham; Jay Stork; Ngon Tran","Variation in Crystallization Conditions Allows the Isolation of Trimeric as Well as Dimeric and Monomeric Forms of [(Alkyl Isocyanide)4RhI]+.","Chemical Communications","2006","","","","","10.1039/b513700d","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","180109","2020-10-21","18:00:00",""
"7101115","32.464","0.002","32.464","","9.9286","0.0007","90","","90","","90","","10463.7","1","113","2","113","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C29 H36 Cl N2 Rh -","- C29 H36 Cl N2 Rh -","- C464 H576 Cl16 N32 Rh16 -","16","1","","Evans, P. Andrew; Baum, Erich W.; Fazal, Aleem N.; Pink, Maren","Diastereoselective metal-catalyzed [4+2+2] carbocyclization reactions utilizing a rhodium(I) N-heterocyclic carbene (NHC) complex: the first example of a rhodium(I)-NHC-catalyzed carbocyclization","Chemical Communications","2005","","1","","","10.1039/b413438a","","","0.71073","MoKα","","0.0385","0.0276","","","0.0635","0.069","","","","","","1.033","","","","has coordinates","180113","2020-10-21","18:00:00",""
"7101153","15.0031","0.0001","15.0031","0.0001","24.7185","0.0004","90","","90","","90","","5563.96","0.1","100","2","100","2","","","","","","","synthesized","4","I 41/a :2","-I 4ad","88","","","","- C15 H17 Li O3.5 -","- C12 H11 Li O2 -","- C192 H176 Li16 O32 -","16","1","","Kenneth Henderson; Dugald J. MacDougall; J. Jacob Morris; Bruce C. Noll","Use of tetrameric cubane aggregates of lithium aryloxides as secondary building units in controlling network assembly","Chemical Communications","2005","","4","","","10.1039/b413434f","","x-ray","0.71073","MoKα","","0.0583","0.0458","","","0.1319","0.136","","","","","","1.161","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101168","12.9385","0.0001","12.9385","0.0001","13.1962","0.0002","90","","90","","90","","2209.11","0.04","173.2","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C12 H14 N2 O2 -","- C12 H14 N2 O2 -","- C96 H112 N16 O16 -","8","0.5","","Fumio Toda; Shinji Toyota","A new [2+2] photodimerization of 5-chloro- and 5-methyl-2-pyridone in their inclusion complexes with 1,1f-biphenyl-2,2f-dicarboxylic acid as a model for DNA damage by photodimerization of its thymine component","Chemical Communications","2005","","5","","","10.1039/b414134b","","","0.7107","MoKα","","","0.0367","","","","0.1699","","","","","","1.009","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101489","30.5756","0.001","30.5756","0.001","7.8321","0.0004","90","","90","","90","","7322","0.5","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H10 Br N5 O5 -","- C20 H10 Br N5 O5 -","- C320 H160 Br16 N80 O80 -","16","1","","Sergey Kurbatov; Vladimir Minkin; Artem Tatarov; Regis Goumont; Francois Terrier","Ring Opening and Ring Closure in an Indolizine Structure Activated through SNAr Coupling with Superelectrophilic 4,6-Dinitrobenzofuroxan. An Unusual Intramolecular Oxygen Transfer from a N-Oxide Functionality.","Chemical Communications","2006","","41","","","10.1039/b608350a","","","0.71073","MoKα","","0.0439","0.0329","","","0.0484","0.0502","","","","","","1","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101509","26.0844","0.0016","26.0844","0.0016","31.49","0.003","90","","90","","90","","21426","3","90","2","90","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C135 H144 Mn N47.54 O86.54 Pd6 -","- C134.8 H144 Mn N47.54 O86.54 Pd6 -","- C539.2 H576 Mn4 N190.16 O346.16 Pd24 -","4","0.25","","Yasuhiro Kobayashi; Masaki Kawano; Makoto Fujita","Networking a Hollow Cage via Guest Coordination","Chemical Communications","2006","","42","","","10.1039/b612562j","","","0.71073","MoKα","","0.0879","0.0643","","","0.1784","0.2078","","","","","","1.08","","","","has coordinates,has disorder","180117","2020-10-21","18:00:00",""
"7101598","40.698","0.002","40.698","0.002","13.5231","0.001","90","","90","","90","","22399","2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C168 H188 Cd16 N8 O118 -","- C168 H188 Cd16 N8 O118 -","- C672 H752 Cd64 N32 O472 -","4","0.25","","Zang, Shuangquan; Su, Yang; Duan, Chunying; Li, Yizhi; Zhu, Huizhen; Meng, Qingjin","Coexistence of chiral hydrophilic and achiral hydrophobic channels in one multi-helical-array metal–organic framework incorporating helical water cluster chains","Chemical Communications (Cambridge, United Kingdom)","2006","","48","4997","4999","10.1039/b611994h","","","0.71073","MoKα","","0.0717","0.0535","","","0.1276","0.1344","","","","","","1.084","","","","has coordinates","288004","2023-12-04","16:04:21",""
"7101801","20.1904","0.0002","20.1904","0.0002","12.8455","0.0003","90","","90","","90","","5236.5","0.14","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C36 H60 N8 O12 P4 Zn4 -","- C36 H60 N8 O12 P4 Zn4 -","- C144 H240 N32 O48 P16 Zn16 -","4","0.25","","Murugavel, Ramaswamy; Shanmugan, Swaminathan","Seeking tetrameric transition metal phosphonate with a D4R core and organising it into a 3-D supramolecular assembly.","Chemical communications (Cambridge, England)","2007","","12","1257","1259","10.1039/b616439k","","","0.71073","MoKα","","0.0394","0.0305","","","0.0957","0.105","","","","","","1.135","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7102345","21.1129","0.0007","21.1129","0.0007","11.1505","0.0007","90","","90","","90","","4970.4","0.4","103","2","103","0.1","","","100","","","","Synthesis via corner capping","5","I 41/a :2","-I 4ad","88","Octa(3,3,3-trifluropropyl)-T8-Silsesquioxane","Octa(3,3,3-trifluropropyl)-T8-Silsesquioxane","","- C28 H40 F24 O13 Si8 -","- C28 H40 F24 O13 Si8 -","- C112 H160 F96 O52 Si32 -","4","0.25","","Iacono, Scott T; Vij, Ashwani; Grabow, Wade; Smith, Jr, Dennis W; Mabry, Joseph M","Facile synthesis of hydrophobic fluoroalkyl functionalized silsesquioxane nanostructures.","Chemical communications (Cambridge, England)","2007","","47","4992","4994","10.1039/b712976a","","x-ray","0.71073","MoKα","","0.0306","0.0286","","","0.0857","0.088","","","","","","1.09","","","","has coordinates,has disorder","180125","2020-10-21","18:00:00",""
"7102594","25.58","0.006","25.58","0.006","12.455","0.004","90","","90","","90","","8150","4","546","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","3b","","","- C23 H14 F6 O S2 -","- C23 H14 F6 O S2 -","- C368 H224 F96 O16 S32 -","16","1","","Yamaguchi, Tadatsugu; Fujita, Yuji; Irie, Masahiro","Photochromism of a novel 6pi conjugate system having a bis(2,3'-benzothienyl) unit.","Chemical communications (Cambridge, England)","2004","","8","1010","1011","10.1039/b401207k","","","0.71073","MoKα","","0.1221","0.0499","","","0.1206","0.1657","","","","","","1.047","","","","has coordinates","180127","2020-10-21","18:00:00",""
"7102644","16.7128","0.0008","16.7128","0.0008","13.9916","0.0011","90","","90","","90","","3908.1","0.4","140","2","140","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C44 H32 B4 N4 O8 -","- C44 H32 B4 N4 O8 -","- C176 H128 B16 N16 O32 -","4","0.25","","N.Christinat; R.Scopelliti; K.Severin","A new method for the synthesis of boronate macrocycles","Chemical communications (Cambridge, England)","2004","","10","1158","1159","10.1039/b402510e","","","0.71073","MoKα","","0.0499","0.0347","","","0.0874","0.0943","","","","","","1.097","","","","has coordinates","180128","2020-10-21","18:00:00",""
"7102856","26.7146","0.0011","26.7146","0.0011","8.8972","0.0003","90","","90","","90","","6349.7","0.4","173","2","173","2","","","","","","","synthesis as described","6","I 41/a :2","-I 4ad","88","Compound B, X=NH2","","","- C11 H11 Fe2 N O6 S2 -","- C11 H11 Fe2 N O6 S2 -","- C176 H176 Fe32 N16 O96 S32 -","16","1","","Xu, Fenfen; Tard, Cédric; Wang, Xiufeng; Ibrahim, Saad K; Hughes, David L; Zhong, Wei; Zeng, Xirui; Luo, Qiuyan; Liu, Xiaoming; Pickett, Christopher J","Controlling carbon monoxide binding at di-iron units related to the iron-only hydrogenase sub-site.","Chemical communications (Cambridge, England)","2008","","5","606","608","10.1039/b712805c","","x-ray","0.71073","MoKα","","0.0745","0.0459","","","0.0908","0.102","","","","","","1.045","","","","has coordinates","180130","2020-10-21","18:00:00",""
"7102880","27.87","0.005","27.87","0.005","28.442","0.006","90","","90","","90","","22092","8","120","2","120","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C140 H108 B4 N8 O12 -","- C141 H108 B4 N8 O12 -","- C1128 H864 B32 N64 O96 -","8","0.5","","Ikeda, Chusaku; Nabeshima, Tatsuya","Self-assembled cyclic boron-dipyrrin oligomers","Chemical Communications (Cambridge, United Kingdom)","2008","","6","721","723","10.1039/b716453j","","","0.71075","MoKα","","0.1591","0.1038","","","0.2736","0.3183","","","","","","1.033","","","","has coordinates,has disorder","210419","2020-10-21","18:00:00",""
"7102887","18.695","0.005","18.695","0.005","81.28","0.002","90","","90","","90","","28408","11","100","2","100","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C75.5 H59 Cl3 F12 N2 P2 Pd Sb2 -","- C75.5 H59 Cl3 F12 N2 P2 Pd Sb2 -","- C1208 H944 Cl48 F192 N32 P32 Pd16 Sb32 -","16","1","","Shen, Wenting; Graule, Sébastien; Crassous, Jeanne; Lescop, Christophe; Gornitzka, Heinz; Réau, Régis","Stereoselective coordination of ditopic phospholyl-azahelicenes: a novel approach towards structural diversity in chiral pi-conjugated assemblies.","Chemical communications (Cambridge, England)","2008","","7","850","852","10.1039/b714340k","","","0.71069","MoKα","","0.1827","0.1074","","","0.2213","0.2542","","","","","","1.128","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7103206","27.92","0.005","27.92","0.005","46.94","0.005","90","","90","","90","","36591","10","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C31 H19 Cl12 N3 O9 Tb -","- C31 H19 Cl12 N3 O9 Tb -","- C496 H304 Cl192 N48 O144 Tb16 -","16","1","","Roques, Nans; Maspoch, Daniel; Imaz, Inhar; Datcu, Angela; Sutter, Jean-Pascal; Rovira, Concepció; Veciana, Jaume","A three-dimensional lanthanide-organic radical open-framework.","Chemical communications (Cambridge, England)","2008","","27","3160","3162","10.1039/b802196a","","","0.987","synchrotron","","0.0451","0.0435","","","0.1364","0.1376","","","","","","1.051","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7103207","28.486","0.005","28.486","0.005","46.678","0.005","90","","90","","90","","37877","10","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C28 H17 Cl12 N2 O9 Tb -","- C28 H17 Cl12 N2 O9 Tb -","- C448 H272 Cl192 N32 O144 Tb16 -","16","1","","Roques, Nans; Maspoch, Daniel; Imaz, Inhar; Datcu, Angela; Sutter, Jean-Pascal; Rovira, Concepció; Veciana, Jaume","A three-dimensional lanthanide-organic radical open-framework.","Chemical communications (Cambridge, England)","2008","","27","3160","3162","10.1039/b802196a","","","0.987","synchrotron","","0.0981","0.0778","","","0.2433","0.2645","","","","","","1.103","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7103345","23.638","0.008","23.638","0.008","16.043","0.004","90","","90","","90","","8964","5","123","2","123","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C25 H29 B N2 O4 -","- C25 H29 B N2 O4 -","- C400 H464 B16 N32 O64 -","16","1","","Maeda, Hiromitsu; Fujii, Yasunobu; Mihashi, Yuta","Diol-substituted boron complexes of dipyrrolyl diketones as anion receptors and covalently linked 'pivotal' dimers.","Chemical communications (Cambridge, England)","2008","","36","4285","4287","10.1039/b806361c","","","0.71075","MoKα","","0.1024","0.0627","","","0.1423","0.1616","","","","","","1.031","","","","has coordinates","180136","2020-10-21","18:00:00",""
"7103625","18.569","0.003","18.569","0.003","23.042","0.002","90","","90","","90","","7945","2","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","1","","","- C12 H11 Cd N4 O4.5 -","- C12 H10 Cd N4 O4.5 -","- C192 H160 Cd16 N64 O72 -","16","1","","Liu, Yen-Hsiang; Wu, Huang-Chun; Lin, Hsiu-Mei; Hou, Wei-Hsien; Lu, Kuang-Lieh","Crystal engineering toward intersecting channels in a interpenetrated diamondoid network based on a net-to-net H-bonding interaction","Chemical Communications (Cambridge, United Kingdom)","2003","","1","60","61","10.1039/b208683b","","","0.71073","MoKα","","0.1042","0.0796","","","0.2154","0.2279","","","","","","1.151","","","","has coordinates","210596","2020-10-21","18:00:00",""
"7103626","18.569","0.003","18.569","0.003","23.042","0.002","90","","90","","90","","7945","2","293","2","293","2","","","","","","","synthesis as described","5","I 41/a :2","-I 4ad","88","","","","- C12 H10 Cd N4 O4 -","- C12 H10 Cd N4 O4 -","- C192 H160 Cd16 N64 O64 -","16","1","","Liu, Yen-Hsiang; Wu, Huang-Chun; Lin, Hsiu-Mei; Hou, Wei-Hsien; Lu, Kuang-Lieh","Crystal engineering toward intersecting channels in a interpenetrated diamondoid network based on a net-to-net H-bonding interaction","Chemical Communications (Cambridge, United Kingdom)","2003","","1","60","61","10.1039/b208683b","","x-ray","0.71073","MoKα","","0.0991","0.0588","","","0.2156","0.248","","","","","","1.08","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7103714","15.049","0.003","15.049","0.003","42.623","0.011","90","","90","","90","","9653","7","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C52 H68 Fe4 N8 O2 -","- C44 H48 Fe4 N8 -","- C352 H384 Fe32 N64 -","8","0.5","","Love, Jason B.; Salyer, Pamela A.; Bailey, Andrew S.; Wilson, Claire; Blake, Alexander J.; Davies, E. Stephen; Evans, David J.","The dipyrrolide ligand as a template for the spontaneous formation of a tetranuclear iron(II) complex","Chemical Communications (Cambridge, United Kingdom)","2003","","12","1390","1391","10.1039/b303485b","","","0.71073","MoKα","","0.115","0.0574","","","0.139","0.159","","","","","","0.916","","","","has coordinates","210605","2020-10-21","18:00:00",""
"7103904","25.6644","0.0003","25.6644","0.0003","12.2028","0.0003","90","","90","","90","","8037.5","0.2","293","2","293","2","","","","","","","Synthesized by the authors. See text","4","I 41/a :2","-I 4ad","88","","","","- C53 H60 N24 O8 -","- C53 H60 N24 O8 -","- C212 H240 N96 O32 -","4","0.25","","Le Fur, Erwan; Demers, Eric; Maris, Thierry; Wuest, James D.","Excavations in molecular crystals","Chemical Communications (Cambridge, United Kingdom)","2003","","24","2966","2967","10.1039/b308355a","","","1.54178","CuKα","","0.1568","0.0824","","","0.1885","0.2306","","","","","","1.097","","","","has coordinates","210493","2020-10-21","18:00:00",""
"7103905","25.649","0.0006","25.649","0.0006","11.942","0.0004","90","","90","","90","","7856.3","0.4","223","2","223","2","","","","","","","Synthesized by the authors. See text","4","I 41/a :2","-I 4ad","88","","","","- C50.6 H60.4 N24 O6.8 -","- C70.6 H56.4 N24 O10.8 -","- C282.4 H225.6 N96 O43.2 -","4","0.25","","Le Fur, Erwan; Demers, Eric; Maris, Thierry; Wuest, James D.","Excavations in molecular crystals","Chemical Communications (Cambridge, United Kingdom)","2003","","24","2966","2967","10.1039/b308355a","","","1.5418","CuKα","","0.3808","0.1196","","","0.3102","0.3579","","","","","","1.094","","","","has coordinates,has disorder","210493","2020-10-21","18:00:00",""
"7104019","29.196","0.002","29.196","0.002","22.406","0.002","90","","90","","90","","19099.1","2.5","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","3,3',5,5'-tetramethyl-4,4'-bipyrazole Chloroform solvate","3,3',5,5'-tetramethyl-4,4'-bipyrazole Chloroform solvate","","- C11 H15 Cl3 N4 -","- C11 H12 Cl3 N4 -","- C528 H576 Cl144 N192 -","48","3","","Boldog, Ishtvan; Rusanov, Eduard B.; Sieler, Joachim; Blaurock, Steffen; Domasevitch, Konstantin V.","Construction of extended networks with a trimeric pyrazole synthon","Chemical Communications (Cambridge, United Kingdom)","2003","","6","740","741","10.1039/b212540d","","","0.71073","MoKα","","0.3327","0.127","","0.4376","0.2836","","","","0.844","1.553","1.553","","","","","has coordinates","210466","2020-10-21","18:00:00",""
"7104156","19.5947","0.0003","19.5947","0.0003","33.4454","0.0011","90","","90","","90","","12841.4","0.5","150","2","150","2","","","","","","","Ross Ellis","6","I 41/a :2","-I 4ad","88","","","","- C56 H100 Cl4 Co N6 O4 -","- C56 H100 Cl4 Co N6 O4 -","- C448 H800 Cl32 Co8 N48 O32 -","8","0.5","","Ellis, Ross J; Chartres, Jy; Sole, Kathryn C; Simmance, Timothy G; Tong, Christine C; White, Fraser J; Schröder, Martin; Tasker, Peter A","Outer-sphere amidopyridyl extractants for zinc(ii) and cobalt(ii) chlorometallates.","Chemical communications (Cambridge, England)","2009","34","5","583","585","10.1039/b815895a","","","0.71073","MoKα","","0.0872","0.0493","","","0.1013","0.1166","","","","","","1.016","","","","has coordinates,has disorder","180144","2020-10-21","18:00:00",""
"7104157","19.6101","0.0004","19.6101","0.0004","33.3823","0.0015","90","","90","","90","","12837.4","0.7","150","2","150","2","","","","","","","Ross Ellis","6","I 41/a :2","-I 4ad","88","","","","- C56 H100 Cl4 N6 O4 Zn -","- C56 H100 Cl4 N6 O4 Zn -","- C448 H800 Cl32 N48 O32 Zn8 -","8","0.5","","Ellis, Ross J; Chartres, Jy; Sole, Kathryn C; Simmance, Timothy G; Tong, Christine C; White, Fraser J; Schröder, Martin; Tasker, Peter A","Outer-sphere amidopyridyl extractants for zinc(ii) and cobalt(ii) chlorometallates.","Chemical communications (Cambridge, England)","2009","34","5","583","585","10.1039/b815895a","","","0.71073","MoKα","","0.0934","0.0874","","","0.2047","0.2086","","","","","","1.179","","","","has coordinates","180144","2020-10-21","18:00:00",""
"7104975","27.1659","0.0009","27.1659","0.0009","60.5418","0.0011","90","","90","","90","","44679","2","123.15","","123.15","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C73.5 H77.5 Cl14.5 Ir4 N12 O14 -","- C73.5 H77.5 Cl14.5 Ir4 N12 O14 -","- C1176 H1240 Cl232 Ir64 N192 O224 -","16","1","","Kojima, Takahiko; Inui, Yuji; Miyazaki, Soushi; Shiro, Motoo; Fukuzumi, Shunichi","A tetranuclear iridium(iii) complex with a flavin analogue as a bridging ligand in different coordination modes and exchangeable anion encapsulation in a supramolecular cage.","Chemical communications (Cambridge, England)","2009","","43","6643","6645","10.1039/b911033j","","","0.71075","MoKα","","","0.1078","","","","0.3517","","","","","","1.346","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7105047","26.912","0.004","26.912","0.004","13.231","0.003","90","","90","","90","","9583","3","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","(Mn4F4(1,10-phen)8(NO3)4.12(H2O)","","","- C96 H88 F4 Mn4 N20 O24 -","- C96 H64 F4 Mn4 N20 O24 -","- C384 H256 F16 Mn16 N80 O96 -","4","0.25","","Meally, Seán T; Mason, Kevin; McArdle, Patrick; Brechin, Euan K; Ryder, Alan G; Jones, Leigh F","A F-bridged Mn(II) molecular square.","Chemical communications (Cambridge, England)","2009","","45","7024","7026","10.1039/b916153h","","","0.7107","MoKα","","0.1394","0.0848","","","0.2105","0.2268","","","","","","1.099","","","","has coordinates","180154","2020-10-21","18:00:00",""
"7105614","26.0405","0.0017","26.0405","0.0017","31.603","0.002","90","","90","","90","","21430","2","80","2","80","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C134 H167 N53.8 O82.4 Pd6 -","- C134 H167 N53.8 O82.4 Pd6 -","- C536 H668 N215.2 O329.6 Pd24 -","4","0.25","","Horiuchi, Shinnosuke; Nishioka, Yuki; Murase, Takashi; Fujita, Makoto","Both [2+2] and [2+4] additions of inert aromatics via identical ternary host‒guest complexes","Chemical Communications","2010","46","20","3460","","10.1039/c003191g","","","0.71073","MoKα","","0.1087","0.0678","","","0.1896","0.2255","","","","","","1.036","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7106210","9.4114","0.0007","9.4114","","12.7128","0.0012","90","","90","","90","","1126.03","0.14","298","","298","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- B4 H20 Mg N4 Na2 -","- B4 H20 Mg N4 Na2 -","- B16 H80 Mg4 N16 Na8 -","4","0.25","","Hui Wu; Wei Zhou; Frederick E.Pinkerton; Martin S.Meyer; Qingrong Yao; Srinivas Gadipelli; Terrence J.Udovic; Taner Yildirim; John J. Rush","Sodium magnesium amidoborane: the first mixed-metal amidoborane","Chem.Commun.","2011","47","","4102","","10.1039/c0cc05814a","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","0.07013","","1.014","","","","","","","has coordinates","180166","2020-10-21","18:00:00",""
"7106220","21.356","0.0019","21.356","0.0019","11.329","0.002","90","","90","","90","","5166.9","1.1","273","2","273","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C30 H36 N4 O2 -","- C30 H36 N4 O2 -","- C240 H288 N32 O16 -","8","0.5","","Sanjeev P. Mahanta; B. Sathish Kumar; Pradeepta K. Panda","Meso-diacylated calix[4]pyrrole: Structural diversities and enhanced binding towards dihydrogenphosphate ion","Chem.Commun.","2011","47","","4496","","10.1039/c1cc10284b","","","0.71073","MoKα","","0.1238","0.1076","","","0.2051","0.2133","","","","","","1.234","","","","has coordinates","180166","2020-10-21","18:00:00",""
"7106312","23.3452","0.001","23.3452","0.001","14.9359","0.0013","90","","90","","90","","8140","0.9","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C15 H14 Co N6 O2 -","- C15 H9 Co N6 O2 -","- C240 H144 Co16 N96 O32 -","16","1","","Shui-Sheng Chen; Min Chen; Satoshi Takamizawa; Peng Wang; Gao-Chao Lv; Wei-Yin Sun","Porous cobalt(II)-imidazolate supramolecular isomeric frameworks with selective gas sorption property","Chem.Commun.","2011","47","","4902","","10.1039/c1cc10899a","","","0.71073","MoKα","","0.0707","0.0568","","","0.1614","0.1707","","","","","","1.113","","","","has coordinates","180167","2020-10-21","18:00:00",""
"7106444","34.877","0.003","34.877","0.003","23.646","0.003","90","","90","","90","","28763","5","150","2","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C284 H452 Fe4 O84 -","- C171.88 H199.64 Fe4 O28 -","- C687.52 H798.56 Fe16 O112 -","4","0.25","","Lindoy, Leonard","An Expanded Neutral M4L6 Cage that Encapsulates Four Tetrahydrofuran Molecules","Chem.Commun.","2011","47","","6042","","10.1039/c1cc11167a","","","0.71073","MoKα","","0.1249","0.0821","","","0.2143","0.2407","","","","","","0.917","","","","has coordinates,has disorder","192777","2020-10-21","18:00:00",""
"7107317","25.1377","0.0007","25.1377","0.0007","27.1775","0.0008","90","","90","","90","","17173.6","0.8","90","2","90","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C21 H15 B N2 O2 -","- C15.2727 H10.9091 B0.727273 N1.45455 O1.45455 -","- C672 H480 B32 N64 O64 -","44","2.75","","Victoria J. Richards; Alexandra L. Gower; Jasper E. H. B. Smith; E. Stephen Davies; Dorothee Lahaye; Anna G. Slater; William Lewis; Alexander J. Blake; Neil R. Champness; Deborah L. Kays","Synthesis and characterisation of BODIPY radical anions","Chem.Commun.","2012","48","","1751","","10.1039/c2cc16047a","","","1.54184","CuKα","","0.114","0.0707","","","0.17","0.186","","","","","","0.95","","","","has coordinates","180177","2020-10-21","18:00:00",""
"7107717","39.3354","0.0014","39.3354","0.0014","11.0574","0.0006","90","","90","","90","","17108.8","1.3","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C42 H61 N Os P2 -","- C42 H61 N Os P2 -","- C672 H976 N16 Os16 P32 -","16","1","","Olga Crespo; Beatriz Eguillor; Miguel A. Esteruelas; Israel Fernandez; Jorge Garcia-Raboso; Mar Gomez-Gallego; Mamen Martin-Ortiz; Montserrat Olivan; Miguel A. Sierra","Preparation and Characterisation of [6]-Azaosmahelicenes: The First d4-Heterometallahelicenes","Chem.Commun.","2012","48","","5328","5330","10.1039/c2cc30356f","","","0.71073","MoKα","","0.1243","0.0435","","","0.1001","0.1194","","","","","","0.857","","","","has coordinates,has disorder","180181","2020-10-21","18:00:00",""
"7107798","25.502","0.004","25.502","0.004","49.611","0.007","90","","90","","90","","32265","8","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","IFMC-10","","","- C54 H48 N2 O14 Zn2 -","- C51 H39 O10 Zn2 -","- C816 H624 O160 Zn32 -","16","1","","Lei Chen; Ke Tan; Ya-Qian Lan; Shun-Li Li; Kui-Zhan Shao; Zhong-Min Su","Unusual microporous polycatenane-like metal-organic frameworks for the luminescent sensing of Ln3+ cations and rapid adsorption of iodine","Chem.Commun.","2012","48","","5919","","10.1039/c2cc31257c","","","0.71069","MoKα","","0.2846","0.0906","","","0.2611","0.325","","","","","","0.894","","","","has coordinates","180181","2020-10-21","18:00:00",""
"7107799","24.337","0.003","24.337","0.003","39.257","0.004","90","","90","","90","","23252","5","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","IFMC-11","","","- C39.63 H36.38 N1.19 O13.19 Zn2 -","- C39 H33 O10 Zn2 -","- C624 H528 O160 Zn32 -","16","1","","Lei Chen; Ke Tan; Ya-Qian Lan; Shun-Li Li; Kui-Zhan Shao; Zhong-Min Su","Unusual microporous polycatenane-like metal-organic frameworks for the luminescent sensing of Ln3+ cations and rapid adsorption of iodine","Chem.Commun.","2012","48","","5919","","10.1039/c2cc31257c","","","0.71069","MoKα","","0.2642","0.1497","","","0.3887","0.4431","","","","","","1.227","","","","has coordinates","180181","2020-10-21","18:00:00",""
"7107910","20.068","0.006","20.068","0.006","28.016","0.011","90","","90","","90","","11283","7","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C59 H76 Al2 N2 O2 -","- C59 H76 Al2 N2 O2 -","- C472 H608 Al16 N16 O16 -","8","0.5","","Yuan Wang; Haiyan Ma","Exploitation of dinuclear salan aluminum complexes for versatile copolymerization of epsilon-caprolactone and L-lactide","Chem.Commun.","2012","48","","6729","","10.1039/c2cc31716h","","","0.71073","MoKα","","0.1296","0.0618","","","0.1499","0.1711","","","","","","0.839","","","","has coordinates","180183","2020-10-21","18:00:00",""
"7108423","17.924","0.003","17.924","0.003","17.225","0.006","90","","90","","90","","5534","2","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C14 H13 Cu N O6 -","- C14 H13 Cu N O6 -","- C224 H208 Cu16 N16 O96 -","16","1","","Qingxiang Yang; Xingqiu Chen; Zhijun Chen; Ying Hao; Yizhi Li; Qingyi Lu; Hegen Zheng","Metal-organic frameworks constructed from flexible V-shaped ligands: adjustment of the topology, interpenetration and porosity via a solvent system","Chem.Commun.","2012","48","","10016","","10.1039/c2cc35340g","","","0.71073","MoKα","","0.0848","0.0577","","","0.1584","0.1745","","","","","","1.063","","","","has coordinates","180188","2020-10-21","18:00:00",""
"7108735","28.281","0.0008","28.281","0.0008","13.5488","0.0007","90","","90","","90","","10836.5","0.7","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24 H26 Ca N4 O9 -","- C24 H26 Ca N4 O9 -","- C384 H416 Ca16 N64 O144 -","16","1","","Lei Han; Lan Qin; Lanping Xu; Yan Zhou; Junliang Sun; Xiaodong Zou","A novel photochromic calcium-based metal-organic framework derived from a naphthalene diimide chromophore","Chem.Commun.","2013","49","","406","","10.1039/c2cc37497h","","","0.71073","MoKα","","0.1268","0.0613","","","0.1387","0.1529","","","","","","0.886","","","","has coordinates","180191","2020-10-21","18:00:00",""
"7109324","20.2549","0.0014","20.2549","0.0014","12.4783","0.0009","90","","90","","90","","5119.4","0.6","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C48 H68 N8 Na4 O4 -","- C48 H68 N8 Na4 O4 -","- C192 H272 N32 Na16 O16 -","4","0.25","","Xiaolu Song; Zhe Wang; Jin Zhao; T. S. Andy Hor","Sodium cubane and double-cubane aggregates of hybridised salicylaldimines and their transmetallation to nickel for catalytic ethylene oligomerisation","Chem.Commun.","2013","49","","4992","","10.1039/c3cc40320c","","","0.71073","MoKα","","0.0441","0.0406","","","0.1033","0.1055","","","","","","1.043","","","","has coordinates","180197","2020-10-21","18:00:00",""
"7109477","14.4293","0.0016","14.4293","0.0016","22.345","0.005","90","","90","","90","","4652.3","1.3","293","2","293","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C15 H14 N2 -","- C15 H14 N2 -","- C240 H224 N32 -","16","1","","Yunhe Lv; Yan Li; Tao Xiong; Weiya Pu; Hongwei Zhang; Kai Sun; Qun Liu; Qian Zhang","Copper-catalyzed annulation of amidines for quinazoline synthesis","Chem.Commun.","2013","49","","6439","","10.1039/c3cc43129k","","","0.71073","MoKα","","0.2632","0.2096","","","0.5257","0.5567","","","","","","1.104","","","","has coordinates","180198","2020-10-21","18:00:00",""
"7109648","25.255","0.003","25.255","0.003","39.511","0.004","90","","90","","90","","25201","5","100","","100","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C26 H42 F6 Fe N6 O2 P -","- C26 H42 F6 Fe N6 O2 P -","- C832 H1344 F192 Fe32 N192 O64 P32 -","32","2","","Megumi Okuhata; Yusuke Funasako; Kazuyuki Takahashi; Tomoyuki Mochida","A spin-crossover ionic liquid from the cationic iron(III) Schiff base complex","Chem.Commun.","2013","49","","7662","","10.1039/c3cc44199g","","","0.71073","MoKα","","0.0457","0.039","","","0.097","0.1028","","","","","","1.017","","","","has coordinates","180202","2020-10-21","18:00:00",""
"7109862","26.773","0.004","26.773","0.004","45.788","0.009","90","","90","","90","","32821","9","153","2","153","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C261 H252 N32 O50.52 Yb12 -","- C261 H252 N32 O50.52 Yb12 -","- C1044 H1008 N128 O202.08 Yb48 -","4","0.25","","Xiaoping Yang; Michael M. Oye; Richard A. Jones; Shaoming Huang","Anion dependent self-assembly of a linear hexanuclear Yb(III) salen complex with enhanced near-infrared (NIR) luminescence properties","Chem.Commun.","2013","49","","9579","","10.1039/c3cc45651j","","","0.71073","MoKα","","0.1005","0.0693","","","0.1785","0.2059","","","","","","1.069","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7110473","28.5339","0.0002","28.5339","0.0002","24.6067","0.0001","90","","90","","90","","20034.4","0.2","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C60 H68 Fe2 N4 Ni O0.25 -","- C59.996 H68 Fe2 N3.996 Ni O0.25 -","- C959.936 H1088 Fe32 N63.936 Ni16 O4 -","16","1","","Burrell, Anthony K.; Campbell, Wayne M.; Jameson, Geoffrey B.; Officer, David L.; Boyd, Peter D. W.; Zhao, Zhongde; Cocks, Paul A.; Gordon, Keith C.","Bis(ferrocenyl)porphyrins. Compounds with strong long-range metal‒metal coupling†","Chemical Communications","1999","","7","637","","10.1039/a900691e","","","0.71073","MoKα","","0.1354","0.0809","","","0.2048","0.2328","","","","","","1.071","","","","has coordinates,has disorder","180218","2020-10-21","18:00:00",""
"7110697","17.3435","0.0006","17.3435","0.0006","24.104","0.001","90","","90","","90","","7250.4","0.5","173","","173","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C68 H68 Cl12 N8 O4 -","- C68 H68 Cl12 N8 O4 -","- C272 H272 Cl48 N32 O16 -","4","0.25","","Jaunky, Wojciech; Hosseini, Mir Wais; Planeix, Jean Marc; Cian, André De; Kyritsakas, Nathalie; Fischer, Jean","Molecular braids: quintuple helical hydrogen bonded molecular network†","Chemical Communications","1999","","22","2313","","10.1039/a906728k","","","0.71073","Mo-Kα","","0.183","0.067","","0.14","","0.079","","","2.483","","","1.414","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110759","29.539","0.002","29.539","0.002","12.1044","0.0011","90","","90","","90","","10561.7","1.4","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","Compound 2b","","","- C61 H45 Cl3 N4 O3 Zn -","- C61 H42 Cl3 N4 O3 Zn -","- C488 H336 Cl24 N32 O24 Zn8 -","8","0.5","","Harmjanz, Michael; Scott, Michael J.","A convenient synthesis of porphodimethenes and their conversion to trans-porphyrins with two functionalized meso-naphthyl substituents","Chemical Communications","2000","","5","397","","10.1039/a907992k","","","0.71073","MoKα","","0.1111","0.0704","","","0.201","0.243","","","","","","1.029","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110932","20.262","0.0005","20.262","0.0005","43.104","0.0007","90","","90","","90","","17696.3","0.7","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","resorcarene","4,6,10,12,16,18,22,24-Octahydroxy-2,8,14,20-(tetraethyl)calix[4]arene","","- C78 H80 Br N O31.63 -","- C78 H80 Br N O31.62 -","- C624 H640 Br8 N8 O252.96 -","8","0.5","","Shivanyuk, Alexander; Rissanen, Kari; Kolehmainen, Erkki","Encapsulation of Et3N±-H···OH2 in a hydrogen-bonded resorcarene capsule","Chemical Communications","2000","","13","1107","","10.1039/b002144j","","","0.71073","MoKα","","0.0809","0.0539","","","0.1598","0.18","","","","","","1.106","","","","has coordinates","180223","2020-10-21","18:00:00",""
"7111250","13.4001","0.001","13.4001","0.001","34.747","0.004","90","","90","","90","","6239.3","1","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C48 H88 Cl4 Cu4 N8 O34 -","- C48 H80 Cl4 Cu4 N8 O27.92 -","- C192 H320 Cl16 Cu16 N32 O111.68 -","4","0.25","","Du, Miao; Bu, Xian-He; Guo, Ya-Mei; Ribas, Joan; Diaz, Carmen","Proton-controlled inter-conversion between an achiral discrete molecular square and a chiral interpenetrated double-chain architecture","Chemical Communications","2002","","21","2550","","10.1039/b207294g","","","0.71073","MoKα","","0.1843","0.139","","","0.3252","0.3578","","","","","","1.095","","","","has coordinates","180226","2020-10-21","18:00:00",""
"7111455","34.436","0.008","34.436","0.008","17.721","0.005","90","","90","","90","","21014","9","123.1","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C96 H80 F22 N6 O10 -","- C96 H80 F22 N6 O10 -","- C768 H640 F176 N48 O80 -","8","0.5","","Suzuki, Masaaki; Taniguchi, Ryuichiro; Osuka, Atsuhiro","Doubly N-fused meso-aryl substituted hexaphyrins(1.1.1.1.1.1)","Chemical Communications","2004","","23","2682","2683","10.1039/b410011e","","","0.7107","MoKα","","","0.094","","","","0.138","","","","","","1.147","","","","has coordinates","210357","2020-10-21","18:00:00",""
"7111539","10.724","0.002","10.724","0.002","36.099","0.014","90","","90","","90","","4151.5","1.9","296","2","296","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C18 H18 Br6 -","- C18 H18 Br6 -","- C144 H144 Br48 -","8","0.5","","Wei, Junfa; Jia, Xiaowei; Yu, Jun; Shi, Xianying; Zhang, Congjie; Chen, Zhanguo","Synthesis of 1,4,5,8,9,12-hexabromododecahydrotriphenylene and its application in constructing polycyclic thioaromatics","Chemical Communications","2009","","31","4714","4716","10.1039/b904477a","","","0.71073","MoKα","","0.0743","0.0413","","","0.0937","0.1112","","","","","","1.001","","","","has coordinates","180229","2020-10-21","18:00:00",""
"7111672","19.8605","0.0004","19.8605","0.0004","10.4054","0.0005","90","","90","","90","","4104.3","0.2","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C48 H44 Fe4 O8 Sn -","- C48 H44 Fe4 O8 Sn -","- C192 H176 Fe16 O32 Sn4 -","4","0.25","","Siebler, Daniel; Förster, Christoph; Gasi, Teuta; Heinze, Katja","Formation and mixed-valent behaviour of a substituted tetraferrocenylstannane","Chemical Communications","2010","46","25","4490","4492","10.1039/c0cc00227e","","","0.71073","MoKα","","0.0275","0.0213","","","0.053","0.0549","","","","","","1.013","","","","has coordinates","180230","2020-10-21","18:00:00",""
"7112088","28.3891","0.0012","28.3891","0.0012","18.8932","0.0017","90","","90","","90","","15226.8","1.6","100","2","100","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C78 H58 B4 Br2 F4 Fe2 N12 O12 -","- C78 H58 B4 Br2 F4 Fe2 N12 O12 -","- C624 H464 B32 Br16 F32 Fe16 N96 O96 -","8","0.5","","O. A. Varzatskii; V. V. Novikov; S. V. Shulga; A. S. Belov; A. V. Vologzhanina; V. V. Negrutska; I. Y. Dubey; Yu. N. Bubnov; Ya. Z. Voloshin","Copper-promoted reductive homocoupling of quasi-aromatic iron(II) clathrochelates: boosting the inhibitory activity in a transcription assay","Chem. Commun.","2014","50","","3166","","10.1039/c3cc47018k","","","0.71073","MoKα","","0.115","0.0481","","","0.0887","0.103","","","","","","1.005","","","","has coordinates","180234","2020-10-21","18:00:00",""
"7112147","18.3203","0.0002","18.3203","0.0002","45.4431","0.0011","90","","90","","90","","15252.2","0.4","296","2","296","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C65.63 H63.13 Ag2 Cd3 N3.88 O1.88 S8 -","- C60 H50 Ag2 Cd3 N2 S8 -","- C480 H400 Ag16 Cd24 N16 S64 -","8","0.5","","Chao Xu; Niklas Hedin; Hua-Tian Shi; Qian-Feng Zhang","A semiconducting microporous framework of Cd6Ag4(SPh)16 clusters interlinked using rigid and conjugated bipyridines","Chem.Commun.","2014","50","","3710","","10.1039/c3cc49660k","","","0.71073","MoKα","","0.1149","0.0551","","","0.1421","0.157","","","","","","1.045","","","","has coordinates","180235","2020-10-21","18:00:00",""
"7112867","12.20346","0.00009","12.20346","0.00009","23.7125","0.0003","90","","90","","90","","3531.37","0.06","297","1","297","1","","","","","","","","3","I 41/a :2","-I 4ad","88","rhodium selenium chloride","dirhodium nonaselenium hexachloride","","- Cl6 Rh2 Se9 -","- Cl6 Rh2 Se9 -","- Cl48 Rh16 Se72 -","8","0.5","","Demchenko, Pavlo Yu; Gladyshevskii, Roman E.; Volkov, Sergei V.; Yanko, Oleg G.; Kharkova, Lyudmila B.; Fokina, Zoya A.; Fokin, Andrey A.","The first nonaselenium ring.","Chemical communications (Cambridge, England)","2010","46","25","4520","4522","10.1039/c0cc00192a","powder diffraction","x-ray","1.5406","CuKα~1~","","","","","","","","","0.028175","1.1651","","","","","","","has coordinates","180242","2020-10-21","18:00:00",""
"7112894","19.7317","0.0012","19.7317","0.0012","29.047","0.004","90","","90","","90","","11309.2","1.8","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C24 H48 Mo12 N6 Na O65 P8 -","- C24 H48 Mo12 N6 Na O65 P8 -","- C96 H192 Mo48 N24 Na4 O260 P32 -","4","0.25","","Compain, Jean-Daniel; Deniard, Philippe; Dessapt, Rémi; Dolbecq, Anne; Oms, Olivier; Sécheresse, Francis; Marrot, Jérôme; Mialane, Pierre","Functionalized polyoxometalates with intrinsic photochromic properties and their association with spiropyran cations.","Chemical communications (Cambridge, England)","2010","46","41","7733","7735","10.1039/c0cc02533j","","","0.71073","MoKα","","0.1418","0.0582","","","0.1866","0.258","","","","","","1.054","","","","has coordinates","180242","2020-10-21","18:00:00",""
"7112918","34.1449","0.0007","34.1449","0.0007","40.6732","0.0019","90","","90","","90","","47420","3","105","2","105","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C80 H120 Cl13 Rh7 Zn18 -","- C80 H120 Cl13 Rh7 Zn18 -","- C1280 H1920 Cl208 Rh112 Zn288 -","16","1","","Molon, Mariusz; Cadenbach, Thomas; Bollermann, Timo; Gemel, Christian; Fischer, Roland A.","One electron organozinc ligands in metal rich molecules by Ga/Zn exchange: from Cp*Rh(GaCp*)2 to Cp*Rh(ZnR)4 units.","Chemical communications (Cambridge, England)","2010","46","31","5677","5679","10.1039/c0cc00146e","","","0.71073","MoKα","","0.1108","0.0415","","","0.0778","0.0847","","","","","","0.661","","","","has coordinates","180243","2020-10-21","18:00:00",""
"7114076","23.589","0.005","23.589","0.005","23.06","0.005","90","0.005","90","0.005","90","0.005","12832","5","150","1","150","1","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C32 H56 O P2 Tm -","- C32 H56 O P2 Tm -","- C512 H896 O16 P32 Tm16 -","16","1","","Nief, François; Turcitu, Daniela; Ricard, Louis","Synthesis and structure of phospholyl- and arsolylthulium(ii) complexes","Chemical Communications","2002","","15","1646","","10.1039/b204337h","","","0.71069","MoKα","","0.0572","0.0367","","","0.088","0.0981","","","","","","1.055","","","","has coordinates","180254","2020-10-21","18:00:00",""
"7114496","17.7598","0.0011","17.7598","0.0011","47.817","0.004","90","","90","","90","","15082","1.8","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","N-(2-(4-hydrophenyl)ethyl)aza-15-crown-5.sodium tetraphenylborate","","- C42 H50 B N Na O5.5 -","- C42 H50 B N Na O5.5 -","- C672 H800 B16 N16 Na16 O88 -","16","1","","Hu, Jiaxin; Barbour, Leonard J.; Ferdani, Riccardo; Gokel, George W.","Sodium cation complexation behavior of the heteroaromatic sidechains of histidine and tryptophan","Chemical Communications","2002","","17","1810","","10.1039/b204321c","","","0.71073","MoKα","","0.1609","0.068","","","0.1328","0.1597","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115420","23.3014","0.0013","23.3014","0.0013","8.5463","0.0005","90","","90","","90","","4640.3","0.5","100","2","100","2","","","","","","","synthesis as described","3","I 41/a :2","-I 4ad","88","","","","- C13 H18 O4 -","- C13 H18 O4 -","- C208 H288 O64 -","16","1","","Simanis, Justin A.; Law, C. Marshall; Woodall, Erica L.; Hamaker, Christopher G.; Goodell, John R.; Mitchell, T. Andrew","Investigation of oxidopyrylium-alkene [5+2] cycloaddition conjugate addition cascade (C^3^) sequences","Chemical Communications (Cambridge, United Kingdom)","2014","50","65","9130","9133","10.1039/c4cc04163a","","x-ray","0.71073","MoKα","","0.0391","0.0337","","","0.0854","0.0896","","","","","","1.042","","","","has coordinates","210848","2020-10-21","18:00:00",""
"7115674","30.8293","0.0003","30.8293","0.0003","54.2835","0.0007","90","","90","","90","","51593.5","1","100","2","100","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C63.5 H127 Ag10 Cl7 N20 S20 Sn10 -","- C63.5 H115 Ag10 Cl7 N20 S20 Sn10 -","- C1016 H1840 Ag160 Cl112 N320 S320 Sn160 -","16","1","","Jens P. Eussner; Stefanie Dehnen","Bronze, silver and gold: functionalized group 11 organotin sulfide clusters","Chem.Commun.","2014","50","","11385","","10.1039/C4cc05666C","","","0.71073","MoKα","","0.0569","0.0406","","","0.0921","0.0975","","","","","","1.003","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7115964","20.088","0.004","20.088","0.004","13.191","0.003","90","","90","","90","","5322.9","1.9","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C15 H9 F3 N2 O -","- C15 H9 F3 N2 O -","- C240 H144 F48 N32 O16 -","16","1","","Zhi-Jun Yang; Chuan-Zhuo Liu; Bo-Lun Hu; Chen-Liang Deng; Xing-Guo Zhang","Oxidative tandem nitrosation/cyclization of N-aryl enamines with nitromethane toward 3-(trifluoromethyl)quinoxalines","Chem.Commun.","2014","50","","14554","","10.1039/C4cc07083F","","","0.71073","MoKα","","0.0734","0.0516","","","0.1742","0.2005","","","","","","1.092","","","","has coordinates","180273","2020-10-21","18:00:00",""
"7116213","25.645","0.0005","25.645","0.0005","16.21","0.0005","90","","90","","90","","10660.8","0.4","293","2","293","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C16 H118 Cu4 N16 Nb12 O66 Sb2 Si -","- C16 H64 Cu4 N16 Nb12 O66 Sb2 Si -","- C64 H256 Cu16 N64 Nb48 O264 Sb8 Si4 -","4","0.25","","Zhang, Zhe-Yu; Peng, Jun; Shi, Zhen-Yu; Zhou, Wan-Li; Khan, Shifa Ullah; Liu, Hong-Sheng","Antimony-dependent expansion for the Keggin heteropolyniobate family.","Chemical communications (Cambridge, England)","2015","51","15","3091","3093","10.1039/c4cc09612f","","","0.71069","MoKα","","0.1174","0.0578","","","0.1581","0.1889","","","","","","1.026","","","","has coordinates","180276","2020-10-21","18:00:00",""
"7116214","25.541","0.0004","25.541","0.0004","16.145","0.0004","90","","90","","90","","10532.1","0.4","293","2","293","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C16 H118 Cu4 Ge N16 Nb12 O66 Sb2 -","- C16 H64 Cu4 Ge N16 Nb12 O66 Sb2 -","- C64 H256 Cu16 Ge4 N64 Nb48 O264 Sb8 -","4","0.25","","Zhang, Zhe-Yu; Peng, Jun; Shi, Zhen-Yu; Zhou, Wan-Li; Khan, Shifa Ullah; Liu, Hong-Sheng","Antimony-dependent expansion for the Keggin heteropolyniobate family.","Chemical communications (Cambridge, England)","2015","51","15","3091","3093","10.1039/c4cc09612f","","","0.71069","MoKα","","0.0473","0.0373","","","0.1134","0.1202","","","","","","1.096","","","","has coordinates","180276","2020-10-21","18:00:00",""
"7116215","25.61","0.0005","25.61","0.0005","16.186","0.0006","90","","90","","90","","10615.9","0.5","293","2","293","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C16 H117 Cu4 N16 Nb12 O66 P Sb2 -","- C16 H64 Cu4 N16 Nb12 O66 P Sb2 -","- C64 H256 Cu16 N64 Nb48 O264 P4 Sb8 -","4","0.25","","Zhang, Zhe-Yu; Peng, Jun; Shi, Zhen-Yu; Zhou, Wan-Li; Khan, Shifa Ullah; Liu, Hong-Sheng","Antimony-dependent expansion for the Keggin heteropolyniobate family.","Chemical communications (Cambridge, England)","2015","51","15","3091","3093","10.1039/c4cc09612f","","","0.71069","MoKα","","0.0737","0.0477","","","0.1313","0.1451","","","","","","1.072","","","","has coordinates","180276","2020-10-21","18:00:00",""
"7116216","25.605","0.0005","25.605","0.0005","16.189","0.0005","90","","90","","90","","10613.8","0.4","293","2","293","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C16 H117 As Cu4 N16 Nb12 O66 Sb2 -","- C16 H64 As Cu4 N16 Nb12 O66 Sb2 -","- C64 H256 As4 Cu16 N64 Nb48 O264 Sb8 -","4","0.25","","Zhang, Zhe-Yu; Peng, Jun; Shi, Zhen-Yu; Zhou, Wan-Li; Khan, Shifa Ullah; Liu, Hong-Sheng","Antimony-dependent expansion for the Keggin heteropolyniobate family.","Chemical communications (Cambridge, England)","2015","51","15","3091","3093","10.1039/c4cc09612f","","","0.71069","MoKα","","0.0514","0.0402","","","0.1207","0.1295","","","","","","1.071","","","","has coordinates","180276","2020-10-21","18:00:00",""
"7116221","25.702","0.0005","25.702","0.0005","16.236","0.0006","90","","90","","90","","10725.4","0.5","293","2","293","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C16 H117 Cu4 N16 Nb12 O66 Sb2 V -","- C16 H64 Cu4 N16 Nb12 O66 Sb2 V -","- C64 H256 Cu16 N64 Nb48 O264 Sb8 V4 -","4","0.25","","Zhang, Zhe-Yu; Peng, Jun; Shi, Zhen-Yu; Zhou, Wan-Li; Khan, Shifa Ullah; Liu, Hong-Sheng","Antimony-dependent expansion for the Keggin heteropolyniobate family.","Chemical communications (Cambridge, England)","2015","51","15","3091","3093","10.1039/c4cc09612f","","","0.71069","MoKα","","0.0568","0.0436","","","0.1326","0.1407","","","","","","1.079","","","","has coordinates,has disorder","180276","2020-10-21","18:00:00",""
"7116592","22.4956","0.001","22.4956","0.001","37.984","0.003","90","","90","","90","","19221.9","1.9","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Ge3.88 In22.12 O Se50 -","- Ge3.84 In22.16 O Se50 -","- Ge15.36 In88.64 O4 Se200 -","4","0.25","","Han, Xiaohui; Xu, Jin; Wang, Zhenqing; Liu, Dan; Wang, Cheng","A hybrid linkage mode between T2,2 and T3 selenide clusters","Chemical Communications (Cambridge, United Kingdom)","2015","51","18","3919","3922","10.1039/c5cc00084j","","","0.71073","MoKα","","0.1548","0.0691","","","0.2078","0.2609","","","","","","1.043","","","","has coordinates","211003","2020-10-21","18:00:00",""
"7116975","27.745","0.009","27.745","0.009","6.4943","0.0014","90","","90","","90","","4999","3","293","","293","","","","","","","","see text","4","I 41/a :2","-I 4ad","88","","","","- C32 H30 N O -","- C28 H32 N2 O2 -","- C224 H256 N16 O16 -","8","0.5","","Subham Bhattacharjee; Santanu Bhattacharya","Role of synergistic pi-pi stacking and X-H^...^Cl (X = C, N, O) H-bonding interactions in gelation and gel phase crystallization","Chem.Commun.","2015","51","","7019","","10.1039/C5cc00930H","","x-ray","0.71073","MoKα","","0.1714","0.0668","","","0.1669","0.1993","","","","","","0.953","","","","has coordinates","180283","2020-10-21","18:00:00",""
"7117244","33.4882","0.0019","33.4882","0.0019","12.9635","0.0015","90","","90","","90","","14538","2","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C33 H43 Cl4 N3 Pd -","- C33 H43 Cl4 N3 Pd -","- C528 H688 Cl64 N48 Pd16 -","16","1","","Christopher J. Adams; Matteo Lusi; Emily M. Mutambi; A. Guy Orpen","Two-step solid-state synthesis of PEPPSI-type compounds","Chem.Commun.","2015","51","","9632","","10.1039/C5cc02924D","","","0.71073","MoKα","","0.1009","0.087","","","0.1848","0.1901","","","","","","1.243","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7121199","27.885","0.006","27.885","","12.931","0.003","90","","90","","90","","10055","3","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C27 H18 F4 Ir N5 O2.5 -","- C27 H18 F4 Ir N5 O2.5 -","- C432 H288 F64 Ir16 N80 O40 -","16","1","","Che, Weilong; Li, Guangfu; Liu, Xingman; Shao, Kuizhan; Zhu, Dongxia; Su, Zhongmin; Bryce, Martin R.","Selective sensing of 2,4,6-trinitrophenol (TNP) in aqueous media with ""aggregation-induced emission enhancement"" (AIEE)-active iridium(iii) complexes.","Chemical communications (Cambridge, England)","2018","54","14","1730","1733","10.1039/c7cc08832a","","","0.71073","MoKα","","0.037","0.0265","","","0.0658","0.0796","","","","","","1.107","","","","has coordinates","228395","2020-10-21","18:00:00",""
"7122201","20.386","0.004","20.386","0.004","24.639","0.005","90","","90","","90","","10240","4","120","2","120","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C25 H41 N3 Ni P2 -","- C25 H41 N3 Ni P2 -","- C400 H656 N48 Ni16 P32 -","16","1","","Li, Huaifeng; Gonçalves, Théo P; Zhao, Qianyi; Gong, Dirong; Lai, Zhiping; Wang, Zhixiang; Zheng, Junrong; Huang, Kuo-Wei","Diverse catalytic reactivity of a dearomatized PN<sup>3</sup>P*-nickel hydride pincer complex towards CO<sub>2</sub> reduction.","Chemical communications (Cambridge, England)","2018","54","81","11395","11398","10.1039/c8cc05948a","","","0.71073","MoKα","","0.025","0.0224","","","0.0592","0.0606","","","","","","1.062","","","","has coordinates","228109","2020-10-21","18:00:00",""
"7122658","20.4193","0.0002","20.4193","0.0002","4.7907","0.0002","90","","90","","90","","1997.47","0.09","185","0.1","185","0.1","","","","","","","","4","I 41/a :2","-I 4ad","88","","1,1,1-Trifluoro-2-iodoethane","","- C2 H2 F3 I -","- C2 H2 F3 I -","- C32 H32 F48 I16 -","16","1","","Bujak, Maciej; Stammler, Georg; Blomeyer, Sebastian; Mitzel, Norbert Werner","The Nature of Interactions of Benzene with CF3I and CF3CH2I","Chemical Communications","2018","","","","","10.1039/C8CC08980A","","","0.71073","MoKα","","0.0212","0.0209","","","0.046","0.0461","","","","","","1.298","","","","has coordinates","212233","2020-10-21","18:00:00",""
"7122659","20.2203","0.0003","20.2203","0.0003","4.7384","0.0002","90","","90","","90","","1937.34","0.09","100","0.1","100","0.1","","","","","","","","4","I 41/a :2","-I 4ad","88","","1,1,1-Trifluoro-2-iodoethane","","- C2 H2 F3 I -","- C2 H2 F3 I -","- C32 H32 F48 I16 -","16","1","","Bujak, Maciej; Stammler, Georg; Blomeyer, Sebastian; Mitzel, Norbert Werner","The Nature of Interactions of Benzene with CF3I and CF3CH2I","Chemical Communications","2018","","","","","10.1039/C8CC08980A","","","0.71073","MoKα","","0.0229","0.0229","","","0.052","0.052","","","","","","1.409","","","","has coordinates","212233","2020-10-21","18:00:00",""
"7124457","28.225","0.005","28.225","0.005","22.062","0.004","90","","90","","90","","17576","5","296.15","","296.15","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C48 H118 N32 O51 -","- C48 H48 N32 O16 -","- C384 H384 N256 O128 -","8","0.5","","Chen, Li-Xia; Liu, Ming; Zhang, Yun-Qian; Zhu, Qian-Jiang; Liu, Jinxin; Zhu, Bixue; Tao, Zhu","Outer surface interaction to drive cucurbit[8]uril-based supramolecular frameworks: possible application in gold recovery","Chemical Communications","2019","","","","","10.1039/C9CC07147D","","x-ray","0.71073","MoKα","","0.1255","0.0742","","","0.1711","0.1941","","","","","","1.023","","","","has coordinates","225405","2020-10-21","18:00:00",""
"7124831","24.583","0.0004","24.583","0.0004","10.8704","0.0003","90","","90","","90","","6569.2","0.2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C13 H12 Cd N2 O2 -","- C13 H12 Cd N2 O2 -","- C208 H192 Cd16 N32 O32 -","16","1","","Xiao, Qiong; Wu, Yuan; Li, Mian; O'Keeffe, Michael; Li, Dan","A metal-organic framework with rod secondary building unit based on the Boerdijk-Coxeter helix.","Chemical communications (Cambridge, England)","2016","52","77","11543","11546","10.1039/c6cc04912e","","","1.54184","CuKα","","0.0647","0.0428","","","0.1297","0.148","","","","","","1.134","","","","has coordinates","234265","2020-10-21","18:00:00",""
"7124832","24.0666","0.0007","24.0666","0.0007","10.5856","0.0011","90","","90","","90","","6131.2","0.7","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C13 H12 Cd N2 O2 -","- C13 H12 Cd N2 O2 -","- C208 H192 Cd16 N32 O32 -","16","1","","Xiao, Qiong; Wu, Yuan; Li, Mian; O'Keeffe, Michael; Li, Dan","A metal-organic framework with rod secondary building unit based on the Boerdijk-Coxeter helix.","Chemical communications (Cambridge, England)","2016","52","77","11543","11546","10.1039/c6cc04912e","","","1.54184","CuKα","","0.0852","0.0566","","","0.1276","0.1426","","","","","","1.074","","","","has coordinates","234265","2020-10-21","18:00:00",""
"7124833","24.6108","0.0003","24.6108","0.0003","10.76785","0.00017","90","","90","","90","","6521.99","0.15","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C13 H12 Cd N2 O2 -","- C13 H12 Cd N2 O2 -","- C208 H192 Cd16 N32 O32 -","16","1","","Xiao, Qiong; Wu, Yuan; Li, Mian; O'Keeffe, Michael; Li, Dan","A metal-organic framework with rod secondary building unit based on the Boerdijk-Coxeter helix.","Chemical communications (Cambridge, England)","2016","52","77","11543","11546","10.1039/c6cc04912e","","","1.54184","CuKα","","0.0289","0.0235","","","0.056","0.0589","","","","","","1.033","","","","has coordinates","234265","2020-10-21","18:00:00",""
"7124834","24.029","0.0005","24.029","0.0005","10.5501","0.0003","90","","90","","90","","6091.6","0.2","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C13 H12 Cd N2 O2 -","- C13 H12 Cd N2 O2 -","- C208 H192 Cd16 N32 O32 -","16","1","","Xiao, Qiong; Wu, Yuan; Li, Mian; O'Keeffe, Michael; Li, Dan","A metal-organic framework with rod secondary building unit based on the Boerdijk-Coxeter helix.","Chemical communications (Cambridge, England)","2016","52","77","11543","11546","10.1039/c6cc04912e","","","1.54184","CuKα","","0.0348","0.0281","","","0.0723","0.0763","","","","","","1.076","","","","has coordinates","234265","2020-10-21","18:00:00",""
"7124911","20.9835","0.001","20.9835","0.001","37.613","0.003","90","","90","","90","","16561.3","1.7","123","2","123","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C45 H54 Br N O3 Si Zn -","- C45 H54 Br N O3 Si Zn -","- C720 H864 Br16 N16 O48 Si16 Zn16 -","16","1","","Dawkins, Michael J. C.; Middleton, Ewart; Kefalidis, Christos E.; Dange, Deepak; Juckel, Martin M.; Maron, Laurent; Jones, Cameron","Two-coordinate terminal zinc hydride complexes: synthesis, structure and preliminary reactivity studies.","Chemical communications (Cambridge, England)","2016","52","69","10490","10492","10.1039/c6cc05445e","","","0.71073","MoKα","","0.112","0.0597","","","0.1136","0.1364","","","","","","1.023","","","","has coordinates","234338","2020-10-21","18:00:00",""
"7124971","31.37","0.003","31.37","0.003","7.8467","0.0013","90","","90","","90","","7721.8","1.7","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C17 H14 Ag N7 O4 -","- C17 H14 Ag N7 O4 -","- C272 H224 Ag16 N112 O64 -","16","1","","Li, Cheng-Peng; Wang, Si; Guo, Wei; Yan, Yan; Du, Miao","Dual structure evolution of a Ag(i) supramolecular framework triggered by anion-exchange: replacement of terminal ligand and switching of network interpenetration degree.","Chemical communications (Cambridge, England)","2016","52","74","11060","11063","10.1039/c6cc05938d","","","0.71073","MoKα","","0.0476","0.0379","","","0.1165","0.131","","","","","","1.094","","","","has coordinates","234397","2020-10-21","18:00:00",""
"7124972","31.065","0.003","31.065","0.003","8.0003","0.0014","90","","90","","90","","7720.6","1.7","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C17 H15 Ag N7 O3.5 -","- C17 H15 Ag N7 O3.5 -","- C272 H240 Ag16 N112 O56 -","16","1","","Li, Cheng-Peng; Wang, Si; Guo, Wei; Yan, Yan; Du, Miao","Dual structure evolution of a Ag(i) supramolecular framework triggered by anion-exchange: replacement of terminal ligand and switching of network interpenetration degree.","Chemical communications (Cambridge, England)","2016","52","74","11060","11063","10.1039/c6cc05938d","","","0.71073","MoKα","","0.0423","0.0309","","","0.0853","0.0917","","","","","","1.051","","","","has coordinates","234397","2020-10-21","18:00:00",""
"7125386","20.1536","0.0004","20.1536","0.0004","55.493","0.002","90","","90","","90","","22539.5","1","99.97","0.16","99.97","0.16","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C72.89 H33.78 Cl0 F8.89 N3.56 O10.67 -","- C72.8889 H33.7778 F8.88889 N3.55556 O10.6667 -","- C656 H304 F80 N32 O96 -","9","0.5625","","Hong, Seong-Jin; Dutta, Ranjan; Kumar, Ravi; He, Qing; Lynch, Vincent M.; Sessler, Jonathan L.; Lee, Chang-Hee","meso-Alkylidenyl dibenzihexaphyrins: synthesis and protonation studies.","Chemical communications (Cambridge, England)","2019","55","65","9693","9696","10.1039/c9cc04607k","","x-ray","1.54184","CuKα","","0.1782","0.1311","","","0.3318","0.3889","","","","","","1.18","","","","has coordinates","237842","2020-10-21","18:00:00",""
"7125398","32.1592","0.0012","32.1592","0.0012","10.0314","0.0004","90","","90","","90","","10374.6","0.7","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C17 H23 N11 Ni O2 -","- C17 H23 N11 Ni O2 -","- C272 H368 N176 Ni16 O32 -","16","1","","Dey, Mamon; Mudoi, Prashurya Pritam; Choudhury, Anup; Sarma, Bipul; Gogoi, Nayanmoni","Deciphering the influence of structural distortions on the uniaxial magnetic anisotropy of pentagonal bipyramidal Ni(ii) complexes.","Chemical communications (Cambridge, England)","2019","55","77","11547","11550","10.1039/c9cc05032a","","","0.71073","MoKα","","0.1076","0.0641","","","0.1895","0.2088","","","","","","1.026","","","","has coordinates","237849","2020-10-21","18:00:00",""
"7125485","19.3309","0.001","19.3309","0.001","13.4691","0.0007","90","","90","","90","","5033.2","0.5","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","[Co(II) 2(NO3) 4(H2O)] [bipydiox]","","","- C20 H24 Co N6 O14 -","- C20 H24 Co N6 O14 -","- C160 H192 Co8 N48 O112 -","8","0.5","","Blake, A. J.; Brett, M. T.; Champness, N. R.; Khlobystov, A. N.; Long, D. L.; Wilson, C.; Schröder, M","Inorganic-organic interpenetrating frameworks: 4,4'-bipyridine N,N'-dioxide as a bridging hydrogen-bond acceptor.","Chemical communications (Cambridge, England)","2001","","21","2258","2259","10.1039/b106348k","","","0.71073","MoKα","","0.0377","0.0276","","","0.0851","0.0897","","","","","","1.012","","","","has coordinates","243956","2020-10-21","18:00:00",""
"7125659","22.6155","0.0005","22.6155","0.0005","13.8933","0.0006","90","","90","","90","","7105.9","0.4","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24 H14 F N O2 -","- C24 H14 F N O2 -","- C384 H224 F16 N16 O32 -","16","1","","Yang, Wan-Wan; Chen, Lu-Lu; Chen, Pei; Ye, Ya-Fang; Wang, Yan-Bo; Zhang, Xiao","Solvent-controlled divergent annulation of ynones and (iso)quinoline N-oxides: of 3-((iso)quinolin-1-yl)-4H-chromen-4-ones and 13H-isoquinolino[2,1-a]quinolin-13-ones.","Chemical communications (Cambridge, England)","2020","56","8","1183","1186","10.1039/c9cc08713c","","","0.71073","MoKα","","0.134","0.0556","","","0.1045","0.1368","","","","","","1.021","","","","has coordinates","247584","2020-10-21","18:00:00",""
"7125678","12.1107","0.0002","12.1107","0.0002","52.4973","0.0014","90","","90","","90","","7699.7","0.3","293","2","293","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C21 H20 O7 -","- C21 H20 O7 -","- C336 H320 O112 -","16","1","","Peng, Haiyun; Wan, Yinbo; Zhang, Yu; Deng, Guisheng","Synthesis of 2-alkenylfurans via a Ag(i)-catalyzed tandem cyclization/cross-coupling reaction of enynones with iodonium ylides.","Chemical communications (Cambridge, England)","2020","56","9","1417","1420","10.1039/c9cc08561k","","x-ray","1.54184","CuKα","","0.045","0.0431","","","0.1102","0.1122","","","","","","1.069","","","","has coordinates","247615","2020-10-21","18:00:00",""
"7125850","34.481","0.003","34.481","0.003","13.9826","0.0014","90","","90","","90","","16624","3","110","2","110","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C46 H59 B N6 Ni -","- C46 H59 B N6 Ni -","- C736 H944 B16 N96 Ni16 -","16","1","","Hill, Ethan A.; Zhao, Norman; Filatov, Alexander S.; Anderson, John S.","Nickel(ii)-methyl complexes adopting unusual seesaw geometries.","Chemical communications (Cambridge, England)","2020","56","57","7861","7864","10.1039/c9cc09249h","","x-ray","0.41328","synchrotron","","0.0434","0.0412","","","0.0984","0.0997","","","","","","1.087","","","","has coordinates","254883","2020-10-21","18:00:00",""
"7126749","31.0847","0.0014","31.0847","0.0014","7.6891","0.0005","90","","90","","90","","7429.7","0.7","292.59","0.1","292.59","0.1","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C20 H10 Br F5 O S -","- C20 H10 Br F5 O S -","- C320 H160 Br16 F80 O16 S16 -","16","1","","Chu, Xue-Qiang; Xie, Ting; Wang, Ya-Wen; Li, Xiang-Rui; Rao, Weidong; Xu, Haiyan; Shen, Zhi-Liang","Synthesis of di(hetero)aryl sulfides by defluorinative sulfenylation of polyfluoroalkyl ketones with sodium sulfinates or arylsulfonyl chlorides.","Chemical communications (Cambridge, England)","2020","56","61","8699","8702","10.1039/d0cc03303k","","","1.54184","CuKα","","0.1168","0.0973","","","0.2749","0.3106","","","","","","1.071","","","","has coordinates","254921","2020-10-21","18:00:00",""
"7126839","15.938","0.0008","15.938","0.0008","15.9529","0.0007","90","","90","","90","","4052.4","0.3","123","","150","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C28 H16 N2 O4 -","- C28 H16 N2 O4 -","- C224 H128 N16 O32 -","8","0.5","","Yakiyama, Yumi; Fujinaka, Takahisa; Nishimura, Mio; Seki, Ryotaro; Sakurai, Hidehiro","Control by one drop of solvent: selective preparation of guest release/trap-triggered interconvertible molecular crystals.","Chemical communications (Cambridge, England)","2020","56","67","9687","9690","10.1039/d0cc03408h","","x-ray","0.71073","MoKα","","0.0429","0.0363","","","0.0941","0.0981","","","","","","1.065","","","","has coordinates","256033","2020-10-21","18:00:00",""
"7126841","15.9394","0.0007","15.9394","0.0007","15.9489","0.0007","90","","90","","90","","4052","0.3","150","2","150","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C28 H16 N2 O4 -","- C28 H16 N2 O4 -","- C224 H128 N16 O32 -","8","0.5","","Yakiyama, Yumi; Fujinaka, Takahisa; Nishimura, Mio; Seki, Ryotaro; Sakurai, Hidehiro","Control by one drop of solvent: selective preparation of guest release/trap-triggered interconvertible molecular crystals.","Chemical communications (Cambridge, England)","2020","56","67","9687","9690","10.1039/d0cc03408h","","x-ray","0.71073","MoKα","","0.0439","0.0385","","","0.0972","0.101","","","","","","1.035","","","","has coordinates","256033","2020-10-21","18:00:00",""
"7126846","15.926","0.002","15.926","0.002","15.916","0.003","90","","90","","90","","4036.9","1","100","","100","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C28 H16 N2 O4 -","- C28 H16 N2 O4 -","- C224 H128 N16 O32 -","8","0.5","","Yakiyama, Yumi; Fujinaka, Takahisa; Nishimura, Mio; Seki, Ryotaro; Sakurai, Hidehiro","Control by one drop of solvent: selective preparation of guest release/trap-triggered interconvertible molecular crystals.","Chemical communications (Cambridge, England)","2020","56","67","9687","9690","10.1039/d0cc03408h","","","0.43158","synchrotron","","0.0386","0.0378","","","0.0983","0.0991","","","","","","1.081","","","","has coordinates","256033","2020-10-21","18:00:00",""
"7126851","15.926","0.002","15.926","0.002","15.926","0.003","90","","90","","90","","4039.4","1","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C28 H16 N2 O4 -","- C28 H16 N2 O4 -","- C224 H128 N16 O32 -","8","0.5","","Yakiyama, Yumi; Fujinaka, Takahisa; Nishimura, Mio; Seki, Ryotaro; Sakurai, Hidehiro","Control by one drop of solvent: selective preparation of guest release/trap-triggered interconvertible molecular crystals.","Chemical communications (Cambridge, England)","2020","56","67","9687","9690","10.1039/d0cc03408h","","","0.7","synchrotron","","0.0475","0.0452","","","0.1234","0.1255","","","","","","1.088","","","","has coordinates","256033","2020-10-21","18:00:00",""
"7127007","15.6151","0.0001","15.6151","0.0001","33.2923","0.0003","90","","90","","90","","8117.71","0.1","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C73 H96 F4 N8 O8 -","- C73 H96 F4 N8 O8 -","- C292 H384 F16 N32 O32 -","4","0.25","","Butera, Roberto; Shrinidhi, Annadka; Kurpiewska, Katarzyna; Kalinowska-Tłuścik, Justyna; Dömling, Alexander","Fourfold symmetric MCR's <i>via</i> the tetraisocyanide 1,3-diisocyano-2,2-bis(isocyanomethyl)propane.","Chemical communications (Cambridge, England)","2020","56","73","10662","10665","10.1039/d0cc04522e","","x-ray","1.54184","CuKα","","0.0654","0.0636","","","0.1691","0.1703","","","","","","1.098","","","","has coordinates","257235","2020-10-21","18:00:00",""
"7127544","18.9386","0.0007","18.9386","0.0007","12.733","0.0009","90","","90","","90","","4567","0.4","294","","294","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C40 H36 Au Cl8 F12 N -","- C40 H36 Au Cl8 F12 N -","- C160 H144 Au4 Cl32 F48 N4 -","4","0.25","","Fernández-Moyano, Sara; Peñas-Defrutos, Marconi N; Bartolomé, Camino; Espinet, Pablo","Striking ligand-disproportionative Cl/aryl scrambling in a simple Au(III) system. Solvent role, driving forces and mechanisms.","Chemical communications (Cambridge, England)","2021","57","1","125","128","10.1039/d0cc06450e","","x-ray","0.71073","MoKα","","0.0927","0.0535","","","0.0885","0.1013","","","","","","1.079","","","","has coordinates","261521","2021-02-04","22:25:47",""
"7128516","26.3794","0.0016","26.3794","","8.4535","0.0005","90","","90","","90","","5882.6","0.5","150","2","150","2","","","","","","","synthesis as described","4","I 41/a :2","-I 4ad","88","","","","- C18 H15 O P -","- C18 H15 O P -","- C288 H240 O16 P16 -","16","1","","Garcia-Marquez, Alfonso; Frontera, Antonio; Roisnel, Thierry; Gramage-Doria, Rafael","Ultrashort Hδ+ ··· Hδ- intermolecular distance in a supramolecular system in the solid state","Chemical Communications","2021","","","","","10.1039/D1CC02143E","","x-ray","0.71073","MoKα","","0.058","0.0435","","","0.0996","0.1084","","","","","","1.081","","","","has coordinates","266572","2021-06-19","00:41:15",""
"7128989","29.5276","0.0011","29.5276","0.0011","6.0515","0.0003","90","","90","","90","","5276.2","0.4","100","0.2","100","0.2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C16 H13 N O S -","- C16 H13 N O S -","- C256 H208 N16 O16 S16 -","16","1","","Fu, Yuanyuan; Zhao, Xueyan; Chen, Dengfeng; Luo, Jinyue; Huang, Shenlin","Cu-catalyzed coupling of indanone oxime acetates with thiols to 2,3-difunctionalized indenones.","Chemical communications (Cambridge, England)","2021","57","82","10719","10722","10.1039/d1cc04167c","","x-ray","1.54184","CuKα","","0.0551","0.0513","","","0.1333","0.1394","","","","","","1.058","","","","has coordinates","270404","2021-11-06","19:02:21",""
"7129340","27.5128","0.0005","27.5128","0.0005","3.52247","0.00009","90","","90","","90","","2666.35","0.1","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","1-H2O","","","- C20 H22 K N8 O19.5 -","- C20 H22 K N8 O19.5 -","- C80 H88 K4 N32 O78 -","4","0.25","","Zhou, Mu-Yang; Wang, Hao-Yu; Wang, Zhi-Shuo; Zhang, Xue-Wen; Feng, Xi; Gao, Le-Yao; Lian, Zhi-Cheng; Lin, Rui-Biao; Zhou, Dong-Dong","Single-crystal superprotonic conductivity in an interpenetrated hydrogen-bonded quadruplex framework","Chemical Communications","2021","","","","","10.1039/D1CC06004J","","","1.54178","CuKα","","0.0755","0.0656","","","0.1703","0.1977","","","","","","1.027","","","","has coordinates,has disorder","270987","2021-12-02","22:57:39",""
"7130005","36.3291","0.0001","36.3291","0.0001","24.6206","0.0001","90","","90","","90","","32494.3","0.18","100","2","100","2","","","","","","","","9","I 41/a :2","-I 4ad","88","","","","- C24 H16 Eu10 Ge4 N4 Na0 O224 Se13 W36 -","- C24 H16 Eu10 Ge4 N4 O224 Se13 W36 -","- C96 H64 Eu40 Ge16 N16 O896 Se52 W144 -","4","0.25","","Yao, Meng-Ying; Liu, Yu-Feng; Li, Xin-Xiong; Yang, Guo-Ping; Zheng, Shou-Tian","The largest Se-4f cluster incorporated polyoxometalate with high Lewis acid–base catalytic activity","Chemical Communications","2022","","","","","10.1039/D2CC01051H","","","0.71073","MoKα","","0.0593","0.0442","","","0.113","0.1167","","","","","","0.97","","","","has coordinates,has disorder","274625","2022-04-21","21:57:04",""
"7130525","22.9527","0.0006","22.9527","0.0006","43.0513","0.0017","90","","90","","90","","22680.6","1.2","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C66 H65 Fe N5 -","- C52 H49 Fe N5 -","- C832 H784 Fe16 N80 -","16","1","","Najera, Daniel C.; Peñas-Defrutos, Marconi N.; García-Melchor, Max; Fout, Alison R.","γ-Agostic interactions in (MesCCC)Fe–Mes(L) complexes","Chemical Communications","2022","","","","","10.1039/D2CC03260K","","x-ray","0.71073","MoKα","","0.0747","0.0541","","","0.1221","0.1304","","","","","","1.032","","","","has coordinates","277217","2022-08-12","21:58:09",""
"7130614","25.16","0.13","25.16","0.13","13.98","0.07","90","","90","","90","","8850","8","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C12 Bi Br8 O5 -","- C12 Bi Br8 O5 -","- C192 Bi16 Br128 O80 -","16","1","","Svensson Grape, Erik; Willhammar, Tom; Inge, Andrew Ken","Triple helix and rod structures of the antiseptic drug bibrocathol revealed by electron crystallography","Chemical Communications","2022","","","","","10.1039/D2CC04209F","","","0.0251","electron","","0.2537","0.2112","","","0.4127","0.4293","","","","","","1.122","","","","has coordinates","277466","2022-08-30","21:55:07",""
"7131284","19.065","0.002","19.065","0.002","13.9","0.003","90","","90","","90","","5052.3","1.3","298","","298","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C14 H20 O -","- C14 H20 O -","- C224 H320 O16 -","16","1","","Dapkekar, Anil Balajirao; Satyanarayana, Gedu","Electrochemical synthesis of 2-alkyl-4-phenylalkan-2-ols <i>via</i> cathodic reductive coupling of alkynes with unactivated aliphatic ketones.","Chemical communications (Cambridge, England)","2023","59","20","2915","2918","10.1039/d2cc06819b","","","0.71073","MoKα","","0.1108","0.0574","","","0.1467","0.1756","","","","","","1.038","","","","has coordinates","283064","2023-05-05","00:18:57",""
"7131648","11.35023","0.00006","11.35023","0.00006","34.2177","0.0003","90","","90","","90","","4408.19","0.05","199.99","0.1","199.99","0.1","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C84 H108 N8 S12 Zn2 -","- C84 H108 N8 S12 Zn2 -","- C168 H216 N16 S24 Zn4 -","2","0.125","","Hou, Qin; Chen, Li-Jun; He, Jing; Chen, Er-Xia; Wang, Bo; Zhou, Xuechou; Dai, Yumei; He, Liang; Lin, Qipu","Thiophenol-spaced 2D coordination polymers with extraordinary alkali resistance and efficient photothermal conversion.","Chemical communications (Cambridge, England)","2023","59","46","7072","7075","10.1039/d3cc00778b","","x-ray","1.3405","GaKα","","0.0547","0.0511","","","0.159","0.1643","","","","","","1.079","","","","has coordinates,has disorder","284844","2023-07-05","08:51:16",""
"7131722","33.5754","0.0018","33.5754","0.0018","17.864","0.0011","90","","90","","90","","20138","2","150","","150","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C78 H68 Cl2 N2 O28 Zr6 -","- C78 H74 Cl2 N2 O28 Zr6 -","- C624 H592 Cl16 N16 O224 Zr48 -","8","0.5","","Dworzak, Michael; Montone, Christine M.; Halaszynski, Nicole Irene; Yap, Glenn P. A.; Kloxin, Christopher; Bloch, Eric D.","Rapid Post-Synthetic Modification of Porous Coordination Cages with Copper-Catalyzed Click Chemistry","Chemical Communications","2023","","","","","10.1039/D3CC02015K","","","1.54178","CuKα","","0.0939","0.073","","","0.2028","0.2214","","","","","","1.046","","","","has coordinates,has disorder","284028","2023-05-26","22:06:16",""
"7132097","21.037","0.005","21.037","0.005","14.026","0.004","90","","90","","90","","6207","3","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C57 H52 Cl12 N4 -","- C57 H52 Cl12 N4 -","- C228 H208 Cl48 N16 -","4","0.25","","Liu, Chuan-Zhi; Wang, Jingjing; Yang, Bo; Li, Zhongyi; Yan, Meng; Liu, Xinming; Hu, Zhiyuan; Liu, Lantao; Li, Zhan-Ting","Two and Three-Dimensional Halogen-Bonded Frameworks: Self-assembly Influenced by Crystallization Solvents","Chemical Communications","2023","","","","","10.1039/D3CC02981F","","","0.71073","MoKα","","0.1792","0.135","","","0.2597","0.275","","","","","","1.092","","","","has coordinates","285991","2023-09-04","21:56:26",""
"7132424","24.2953","0.0006","24.2953","0.0006","16.7274","0.0008","90","","90","","90","","9873.5","0.6","113.15","","113.15","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C24 H21 Cl N2 O2 S -","- C24 H21 Cl N2 O2 S -","- C384 H336 Cl16 N32 O32 S16 -","16","1","","Zhou, Pan; Wu, Senhui; Niu, Kaikai; Song, Hongjian; Liu, Yuxiu; Zhang, Jingjing; Wang, Qingmin","Intramolecular trapping of an iminium salt: rapid construction of quindoline derivatives.","Chemical communications (Cambridge, England)","2024","60","3","292","295","10.1039/d3cc05143a","","x-ray","0.71073","MoKα","","0.1126","0.0934","","","0.2617","0.2778","","","","","","1.061","","","","has coordinates","289393","2024-02-04","11:24:40",""
"7132664","13.6416","0.0003","13.6416","0.0003","14.5402","0.0006","90","","90","","90","","2705.83","0.14","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C38 H20 Co N6 -","- C38 H20 Co N6 -","- C152 H80 Co4 N24 -","4","0.25","","Mine, Kosuke; Arae, Sachie; Murakawa, Hiroshi; Tsuchiizu, Masahisa; Hanasaki, Noriaki; Matsuda, Masaki","Diamond lattice in single-component molecular crystals comprising tetrabenzoporphyrin neutral radicals.","Chemical communications (Cambridge, England)","2024","60","22","3019","3022","10.1039/d3cc05948k","","x-ray","0.71073","MoKα","","0.0444","0.0357","","","0.0957","0.101","","","","","","1.107","","","","has coordinates","291504","2024-05-05","00:43:49",""
"7132665","13.7275","0.0003","13.7275","0.0003","14.5027","0.0007","90","","90","","90","","2732.95","0.16","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C38 H20 Fe N6 -","- C38 H20 Fe N6 -","- C152 H80 Fe4 N24 -","4","0.25","","Mine, Kosuke; Arae, Sachie; Murakawa, Hiroshi; Tsuchiizu, Masahisa; Hanasaki, Noriaki; Matsuda, Masaki","Diamond lattice in single-component molecular crystals comprising tetrabenzoporphyrin neutral radicals.","Chemical communications (Cambridge, England)","2024","60","22","3019","3022","10.1039/d3cc05948k","","x-ray","0.71073","MoKα","","0.0578","0.0404","","","0.1069","0.1161","","","","","","1.073","","","","has coordinates","291504","2024-05-05","00:43:56",""
"7132666","13.789","0.0004","13.789","0.0004","14.4334","0.0008","90","","90","","90","","2744.32","0.19","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C36 H20 Cl2 Mn N4 -","- C36 H20 Cl2 Mn N4 -","- C144 H80 Cl8 Mn4 N16 -","4","0.25","","Mine, Kosuke; Arae, Sachie; Murakawa, Hiroshi; Tsuchiizu, Masahisa; Hanasaki, Noriaki; Matsuda, Masaki","Diamond lattice in single-component molecular crystals comprising tetrabenzoporphyrin neutral radicals.","Chemical communications (Cambridge, England)","2024","60","22","3019","3022","10.1039/d3cc05948k","","x-ray","0.71073","MoKα","","0.0551","0.0379","","","0.1103","0.1199","","","","","","1.077","","","","has coordinates","291504","2024-05-05","00:43:56",""
"7132676","24.3936","0.0008","24.3936","0.0008","16.9622","0.0008","90","","90","","90","","10093.3","0.7","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C27 H24 N4 O -","- C27 H24 N4 O -","- C432 H384 N64 O16 -","16","1","","Yu, Jiulong; Wu, Jinyu; Zhu, Yu; Xiong, Dong; Yang, Lin; Li, Jun; Zheng, Jianfeng","Chiral phosphoric acid-catalyzed enantioselective [5+1] cycloaddition reaction of <i>C</i>,<i>N</i>-cyclic azomethine imines with isocyanides.","Chemical communications (Cambridge, England)","2024","60","19","2637","2640","10.1039/d3cc05890e","","","1.54178","CuKα","","0.0795","0.0664","","","0.1629","0.1736","","","","","","1.052","","","","has coordinates,has disorder","290081","2024-03-04","19:47:51",""
"7150015","19.39","0.001","19.39","0.001","36.077","0.002","90","","90","","90","","13563.9","1.2","173.2","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C180 H134 N4 -","- C180 H134 N4 -","- C720 H536 N16 -","4","0.25","","Uno, Hidemitsu; Watanabe, Hikaru; Yamashita, Yuko; Ono, Noboru","Extremely large cavity assembled by self-interlocking of distorted biconcave porphyrins.","Organic & biomolecular chemistry","2005","3","3","448","453","10.1039/b413082k","","","0.7107","MoKa","","","0.065","","","","0.1587","","","","","","1.117","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7150016","19.3904","0.001","19.3904","0.001","36.077","0.002","90","","90","","90","","13564.5","1.2","173","2","173","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C180 H134 N4 -","- C108 H62 N4 -","- C432 H248 N16 -","4","0.25","","Uno, Hidemitsu; Watanabe, Hikaru; Yamashita, Yuko; Ono, Noboru","Extremely large cavity assembled by self-interlocking of distorted biconcave porphyrins.","Organic & biomolecular chemistry","2005","3","3","448","453","10.1039/b413082k","","","0.7107","MoKa","","0.0789","0.0658","","","0.191","0.198","","","","","","1.001","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7150017","19.72","0.001","19.72","0.001","35.239","0.004","90","","90","","90","","13703.7","1.8","173.2","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C168 H134 Cl8 N4 O4 -","- C168 H134 Cl8 N4 O4 -","- C672 H536 Cl32 N16 O16 -","4","0.25","","Uno, Hidemitsu; Watanabe, Hikaru; Yamashita, Yuko; Ono, Noboru","Extremely large cavity assembled by self-interlocking of distorted biconcave porphyrins.","Organic & biomolecular chemistry","2005","3","3","448","453","10.1039/b413082k","","","0.7107","MoKa","","","0.0968","","","","0.2407","","","","","","1.214","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7150018","19.612","0.003","19.612","0.002","36.445","0.008","90","","90","","90","","14018","4","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C180 H132 N4 Zn -","- C180 H132 N4 Zn -","- C720 H528 N16 Zn4 -","4","0.25","","Uno, Hidemitsu; Watanabe, Hikaru; Yamashita, Yuko; Ono, Noboru","Extremely large cavity assembled by self-interlocking of distorted biconcave porphyrins.","Organic & biomolecular chemistry","2005","3","3","448","453","10.1039/b413082k","","","0.7107","MoKa","","0.1355","0.0592","","","0.1342","0.1589","","","","","","1.005","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7150019","19.2176","0.0008","19.2176","0.0008","36.142","0.002","90","","90","","90","","13347.8","1.1","123.2","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C180 H132 N4 Ni -","- C180 H132 N4 Ni -","- C720 H528 N16 Ni4 -","4","0.25","","Uno, Hidemitsu; Watanabe, Hikaru; Yamashita, Yuko; Ono, Noboru","Extremely large cavity assembled by self-interlocking of distorted biconcave porphyrins.","Organic & biomolecular chemistry","2005","3","3","448","453","10.1039/b413082k","","","0.7107","MoKa","","","0.0697","","","","0.173","","","","","","1.412","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7150020","19.6502","0.001","19.6502","0.001","35.387","0.003","90","","90","","90","","13664","1.5","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C168 H132 Cl8 N4 Ni O4 -","- C108 H60 N4 Ni -","- C432 H240 N16 Ni4 -","4","0.25","","Uno, Hidemitsu; Watanabe, Hikaru; Yamashita, Yuko; Ono, Noboru","Extremely large cavity assembled by self-interlocking of distorted biconcave porphyrins.","Organic & biomolecular chemistry","2005","3","3","448","453","10.1039/b413082k","","","0.7107","MoKa","","0.111","0.0747","","","0.1976","0.2036","","","","","","1","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7150021","19.2176","0.0008","19.2176","0.0008","36.142","0.002","90","","90","","90","","13347.8","1.1","123.1","","123","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C180 H132 N4 Ni -","- C132 H84 N4 Ni -","- C528 H336 N16 Ni4 -","4","0.25","","Uno, Hidemitsu; Watanabe, Hikaru; Yamashita, Yuko; Ono, Noboru","Extremely large cavity assembled by self-interlocking of distorted biconcave porphyrins.","Organic & biomolecular chemistry","2005","3","3","448","453","10.1039/b413082k","","","0.7107","MoKa","","0.0743","0.0614","","","0.164","0.17","","","","","","1.1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7150032","20.9699","0.0009","20.9699","0.0009","11.2756","0.0006","90","","90","","90","","4958.3","0.4","120","2","120","2","","","","","","","","5","I 41/a :2","-I 4ad","88","pt1812","","","- C12 H19 N O2 S -","- C12 H19 N O2 S -","- C192 H304 N16 O32 S16 -","16","1","","Bedford, Simon T.; Grainger, Richard S.; Steed, Jonathan W.; Tisselli, Patrizia","Stereoselective synthesis of 2,5-disubstituted-1,4-oxathiane S-oxides.","Organic & biomolecular chemistry","2005","3","3","404","406","10.1039/b415529g","","","0.71073","MoKα","","0.0866","0.0434","","","0.0804","0.093","","","","","","1.003","","","","has coordinates","180286","2020-10-21","18:00:00",""
"7150664","28.3633","0.0009","28.3633","0.0009","21.8616","0.0016","90","","90","","90","","17587.1","1.5","100","0.1","100","0.1","","","","","","","","4","I 41/a :2","-I 4ad","88","cucurbit[8]uril","","","- C66 H60.8 N32 O20.4 -","- C66 H60.8 N32 O20.4 -","- C528 H486.4 N256 O163.2 -","8","0.5","","Wang, Ruibing; Bardelang, David; Waite, Mélanie; Udachin, Konstantin A.; Leek, Donald M.; Yu, Kui; Ratcliffe, Christopher I.; Ripmeester, John A.","Inclusion complexes of coumarin in cucurbiturils","Organic & Biomolecular Chemistry","2009","7","11","2435","2439","10.1039/b903057c","","","0.7107","MoKα","","0.09","0.0793","","","0.2292","0.2368","","","","","","1.507","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7151525","15.963","0.001","15.963","0.001","20.165","0.002","90","","90","","90","","5138.4","0.7","296.2","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C48 H24 Cl8 F12 N4 -","- C48 H24 Cl8 F12 N4 -","- C192 H96 Cl32 F48 N16 -","4","0.25","","Uno, Hidemitsu; Inoue, Kentarou; Inoue, Takashi; Ono, Noboru","Oligocyclization of 2-(hydroxymethyl)pyrroles with electron-withdrawing groups at ?-positions: formation and structural elucidation of porphyrinogens and hexaphyrinogensElectronic Supporting Information Available: Ortep drawings of 3d�2EtOH, 3d�2DMF, 3e, 3e�2H2O, 3g�2(i-PrOH), 3g�2DMF�2CHCl3, 4a�4CHCl3, 4a�4PhCl, 5a�2PhCl, 5d, 5d��PhCl, and 5e; packing diagrams of 5d and 5d��PhCl; and their X-ray analyses data in CIF format. See http://www.rsc.org/suppdata/ob/b3/b307132d/","Organic & Biomolecular Chemistry","2003","1","21","3857","","10.1039/b307132d","","","0.7107","MoKa","","","0.0692","","","","0.2018","","","","","","1.647","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7151526","13.102","0.002","13.102","0.002","27.375","0.003","90","","90","","90","","4699.3","1.1","298.2","","","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C48 H28 Cl8 F12 N4 O2 -","- C48 H28 Cl8 F12 N4 O2 -","- C192 H112 Cl32 F48 N16 O8 -","4","0.25","","Uno, Hidemitsu; Inoue, Kentarou; Inoue, Takashi; Ono, Noboru","Oligocyclization of 2-(hydroxymethyl)pyrroles with electron-withdrawing groups at ?-positions: formation and structural elucidation of porphyrinogens and hexaphyrinogensElectronic Supporting Information Available: Ortep drawings of 3d�2EtOH, 3d�2DMF, 3e, 3e�2H2O, 3g�2(i-PrOH), 3g�2DMF�2CHCl3, 4a�4CHCl3, 4a�4PhCl, 5a�2PhCl, 5d, 5d��PhCl, and 5e; packing diagrams of 5d and 5d��PhCl; and their X-ray analyses data in CIF format. See http://www.rsc.org/suppdata/ob/b3/b307132d/","Organic & Biomolecular Chemistry","2003","1","21","3857","","10.1039/b307132d","","","0.7107","MoKa","","","0.0528","","","","0.1404","","","","","","1.109","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7151626","18.124","0.0013","18.124","0.0013","9.8424","0.0008","90","","90","","90","","3233","0.4","273","2","273","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C16 H18 O4 Se2 -","- C16 H18 O4 Se2 -","- C128 H144 O32 Se16 -","8","0.5","","Tripathi, Santosh K.; Sharma, Sagar; Singh, Harkesh B.; Butcher, Ray J.","2-Phenoxyethanol derived diselenide and related compounds; synthesis of a seven-membered seleninate ester.","Organic & biomolecular chemistry","2011","9","2","581","587","10.1039/C0OB00038H","","","0.71073","MoKα","","0.1","0.0323","","","0.0567","0.0902","","","","","","1.157","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7152522","28.31","0.004","28.31","0.004","14.618","0.003","90","","90","","90","","11716","3","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C60 H88 O6 Se4 -","- C60 H88 O6 Se4 -","- C480 H704 O48 Se32 -","8","0.5","","Thomas, Joice; Dobrzańska, Liliana; Van Hecke, Kristof; Sonawane, Mahendra P.; Robeyns, Koen; Van Meervelt, Luc; Woźniak, Krzysztof; Smet, Mario; Maes, Wouter; Dehaen, Wim","Homoselenacalix[4]arenes: synthetic exploration and metallosupramolecular chemistry.","Organic & biomolecular chemistry","2012","10","32","6526","6536","10.1039/c2ob25760b","","","0.71073","MoKα","","0.0539","0.0364","","","0.0844","0.0928","","","","","","1.079","","","","has coordinates","180311","2020-10-21","18:00:00",""
"7153036","38.342","0.003","38.342","0.003","5.7826","0.0004","90","","90","","90","","8501.1","1.1","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C25 H27 N O2 -","- C25 H27 N O2 -","- C400 H432 N16 O32 -","16","1","","Ye, Juntao; Li, Suhua; Ma, Shengming","Gorlos-phos: addressing the stereoselectivity in palladium-catalyzed exo-mode cyclization of allenes with a nucleophilic functionality.","Organic & biomolecular chemistry","2013","11","32","5370","5373","10.1039/c3ob40983j","","","0.71073","MoKα","","0.0705","0.0447","","","0.0868","0.0966","","","","","","1.077","","","","has coordinates","180316","2020-10-21","18:00:00",""
"7153294","35.199","0.005","35.199","0.005","11.268","0.002","90","","90","","90","","13961","4","173","2","173","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C48 H68 F12 N4 O14 S4 Zn2 -","- C48 H68 F12 N4 O14 S4 Zn2 -","- C384 H544 F96 N32 O112 S32 Zn16 -","8","0.5","","Li, Dongzhen; Guang, Jie; Zhang, Wen-Xiong; Wang, Yang; Xi, Zhenfeng","Zn(OTf)(2)-catalyzed addition of amines to carbodiimides: efficient synthesis of guanidines and unpredicted formation of Zn-N amido species.","Organic & biomolecular chemistry","2010","8","8","1816","1820","10.1039/b923249b","","","0.71073","MoKα","","0.0681","0.0644","","","0.1956","0.1999","","","","","","1.067","","","","has coordinates,has disorder","180318","2020-10-21","18:00:00",""
"7153833","39.4696","0.0005","39.4696","0.0005","21.8104","0.0004","90","","90","","90","","33977.3","0.9","120","","120","","","","101","","","","","6","I 41/a :2","-I 4ad","88","","","","- C36 H39 Cl Hg O4 S4 -","- C36 H39 Cl Hg O4 S4 -","- C1152 H1248 Cl32 Hg32 O128 S128 -","32","2","","Botha, F.; Böhm, S; Dvořáková, H; Eigner, V.; Lhoták, P","Mercuration of thiacalix[4]arenes in the cone and 1,3-alternate conformations.","Organic & biomolecular chemistry","2014","12","28","5136","5143","10.1039/c4ob00799a","","","1.54184","CuKα","","0.0947","0.0786","","0.2476","0.2225","0.2475","","","","","","0.996","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7154956","14.9522","0.0006","14.9522","0.0006","39.844","0.003","90","","90","","90","","8907.9","0.8","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C27 H23 N3 O3 -","- C27 H23 N3 O3 -","- C432 H368 N48 O48 -","16","1","","Feng, Bin-Bin; Lu, Lian; Li, Chao; Wang, Xiang-Shan","Iodine-catalyzed synthesis of dibenzo[b,h][1,6]naphthyridine-11-carboxamides via a domino reaction involving double elimination of hydrogen bromide.","Organic & biomolecular chemistry","2016","14","9","2774","2779","10.1039/c5ob02620b","","","0.71073","MoKα","","0.0577","0.0404","","","0.1191","0.1438","","","","","","1.089","","","","has coordinates","177925","2020-10-21","18:00:00",""
"7157227","38.315","0.003","38.315","","5.547","0.0008","90","","90","","90","","8143.2","1.3","150","2","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C23 H23 N3 O2 -","- C23 H23 N3 O2 -","- C368 H368 N48 O32 -","16","1","","Aiken, Stuart; Anozie, Kelechi; de Azevedo, Orlando D. C. C.; Cowen, Lewis; Edgar, Ross J. L.; Gabbutt, Christopher D.; Heron, B. Mark; Lawrence, Philippa A.; Mills, Abby J.; Rice, Craig R.; Urquhart, Mike W. J.; Zonidis, Dimitrios","Expedient synthesis of highly substituted 3,4-dihydro-1,2-oxathiine 2,2-dioxides and 1,2-oxathiine 2,2-dioxides: revisiting sulfene additions to enaminoketones.","Organic & biomolecular chemistry","2019","17","44","9585","9604","10.1039/c9ob01657k","","","1.54178","CuKα","","0.0713","0.0502","","","0.1101","0.1205","","","","","","1.055","","","","has coordinates","237922","2020-10-21","18:00:00",""
"7157668","19.7501","0.0018","19.7501","0.0018","7.4965","0.0006","90","","90","","90","","2924.1","0.4","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C5 H9 O S2 -","- C5 H10 O S2 -","- C80 H160 O16 S32 -","16","1","","Scheutz, Georg M.; Rowell, Jonathan L.; Wang, Fu-Sheng; Abboud, Khalil A.; Peng, Chi-How; Sumerlin, Brent S.","Synthesis of functional 1,2-dithiolanes from 1,3-bis-<i>tert</i>-butyl thioethers.","Organic & biomolecular chemistry","2020","18","33","6509","6513","10.1039/d0ob01577f","","","0.71073","MoKα","","0.0609","0.0403","","","0.0934","0.1126","","","","","","1.134","","","","has coordinates","256165","2020-10-21","18:00:00",""
"7157765","26.6744","0.0001","26.6744","0.0001","18.1796","0.0001","90","","90","","90","","12935.2","0.1","100","0.1","100","0.1","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C152 H108 Cl12 N8 O8 S -","- C152 H100 Cl12 N8 O8 S -","- C608 H400 Cl48 N32 O32 S4 -","4","0.25","","Yin, Xinru; Xu, Aimin; Hu, Jidi; Bao, Ming; Hu, Wenhao; Qian, Yu","A Rh(ii)/phosphoric acid co-catalyzed three-component reaction of diazo-ketones with alcohols and azonaphthalenes: access to indole derivatives via a formal [3 + 2]-cycloaddition.","Organic & biomolecular chemistry","2020","18","48","9805","9809","10.1039/d0ob02189j","","x-ray","1.54184","CuKα","","0.0779","0.077","","","0.1983","0.1989","","","","","","1.061","","","","has coordinates,has disorder","260825","2021-01-07","07:08:23",""
"7157808","18.521","0.0004","18.521","0.0004","9.0228","0.0002","90","","90","","90","","3095.07","0.12","90","","90","","","","","","","","","5","I 41/a :2","-I 4ad","88","","2-Toluenesulfonamide","","- C7 H9 N O2 S -","- C7 H9 N O2 S -","- C112 H144 N16 O32 S16 -","16","1","","Ichikawa, Yuki; Hiramatsu, Michiaki; Mita, Yusuke; Makishima, Makoto; Matsumoto, Yotaro; Masumoto, Yui; Muranaka, Atsuya; Uchiyama, Masanobu; Hashimoto, Yuichi; Ishikawa, Minoru","<i>meta</i>-Non-flat substituents: a novel molecular design to improve aqueous solubility in small molecule drug discovery.","Organic & biomolecular chemistry","2021","19","2","446","456","10.1039/d0ob02083d","","","0.71073","MoKα","","0.036","0.0324","","","0.0887","0.0915","","","","","","1.067","","","","has coordinates","261764","2021-02-04","23:31:19",""
"7157944","23.425","0.0003","23.425","0.0003","18.7771","0.0005","90","","90","","90","","10303.6","0.3","150","","150","","","","","","","","synthesized","6","I 41/a :2","-I 4ad","88","","","","- C26 H21 F6 N2 O2 P -","- C26 H21 F6 N2 O2 P -","- C416 H336 F96 N32 O32 P16 -","16","1","","Goodwin, Rosemary J.; Blyth, Mitchell T.; Fung, Alfred K. K.; Smith, Leesa M.; Norcott, Philip L.; Tanovic, Sara; Coote, Michelle L.; White, Nicholas G.","Simple acyclic molecules containing a single charge-assisted O-H group can recognize anions in acetonitrile : water mixtures.","Organic & biomolecular chemistry","2021","19","12","2794","2803","10.1039/d1ob00282a","","","1.54184","CuKα","","0.0402","0.0326","","0.0845","0.0763","0.0845","","","","","","0.9499","","","","has coordinates","263854","2021-04-05","15:20:02",""
"7158286","29.725","0.002","29.725","0.002","7.0358","0.0008","90","","90","","90","","6216.7","0.9","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C19 H14 N2 O2 -","- C19 H14 N2 O2 -","- C304 H224 N32 O32 -","16","1","","Singh, Rashmi; Sharma, Vishal Prasad; Yadav, Priyanka; Sonker, Priyanka; Singh, Radhey Mohan; Tewari, Ashish Kumar","Sodium sulphide promoted synthesis of fused quinoline at room temperature.","Organic & biomolecular chemistry","2021","19","37","8108","8112","10.1039/d1ob01085a","","","0.71073","MoKα","","0.1242","0.0587","","","0.1524","0.1871","","","","","","0.942","","","","has coordinates","269775","2021-10-06","16:14:05",""
"7159508","34.488","0.0003","34.488","0.0003","10.2956","0.0001","90","","90","","90","","12245.8","0.19","120.01","0.1","120.01","0.1","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C33 H46 N4 O2.25 -","- C33 H46 N4 O2.25 -","- C528 H736 N64 O36 -","16","1","","Pamuła, Małgorzata; Bulatov, Evgeny; Martínez-Crespo, Luis; Kiesilä, Anniina; Naulapää, Julia; Kalenius, Elina; Helttunen, Kaisa","Anion binding and transport with <i>meso</i>-alkyl substituted two-armed calix[4]pyrroles bearing urea and hydroxyl groups.","Organic & biomolecular chemistry","2023","21","32","6595","6603","10.1039/d3ob00919j","","","1.54184","CuKα","","0.0623","0.0559","","","0.1681","0.177","","","","","","1.032","","","","has coordinates","286178","2023-09-05","20:20:57",""
"7159679","23.118","0.012","23.118","0.012","14.243","0.009","90","","90","","90","","7612","7","300","","300","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C21 H17 N O3 -","- C21 H17 N O3 -","- C336 H272 N16 O48 -","16","1","","He, Xinwei; Wang, Demao; Liu, Yanan; Wu, Mengdi; Kong, Yangzilin; Tang, Qiang; Wang, Yiping; Fan, Chenli; Shang, Yongjia","Synthesis of arene-functionalized fused heterocyclic scaffolds <i>via</i> a regioselective cascade 1,4-conjugate addition/5-<i>exo-dig</i> annulation strategy.","Organic & biomolecular chemistry","2023","21","46","9159","9172","10.1039/d3ob01572f","","x-ray","0.71073","MoKα","","0.2022","0.0862","","","0.1958","0.2671","","","","","","1.014","","","","has coordinates,has disorder","288880","2024-01-06","09:34:17",""
"7200423","22.1046","0.0016","22.1046","0.0016","9.7539","0.0015","90","","90","","90","","4765.9","0.9","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C40 H56 Co4 O20 -","- C40 H56 Co4 O20 -","- C160 H224 Co16 O80 -","4","0.25","","Shu-Hua Zhang; You Song; Hong Liang; Ming-Hua Zeng","Microwave-assisted synthesis, crystal structure and properties of a disc-like heptanuclear Co(II) cluster and a heterometallic cubanic Co(II) cluster","CrystEngComm","2009","11","5","865","872","10.1039/b815675a","","","0.71073","MoKα","","0.0524","0.0349","","","0.0877","0.0971","","","","","","1.077","","","","has coordinates","180335","2020-10-21","18:00:00",""
"7200759","17.1338","0.0012","17.1338","0.0012","19.6083","0.0013","90","","90","","90","","5756.4","0.7","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C6 H10 Cu2 I N3 -","- C6 H10 Cu2 I N3 -","- C96 H160 Cu32 I16 N48 -","16","1","","Zhao, Zhen-Guo; Yu, Rong-Min; Wu, Xiao-Yuan; Zhang, Qi-Sheng; Xie, Yi-Ming; Wang, Fei; Ng, Seik Weng; Lu, Can-Zhong","One-pot synthesis of two new copper(i) coordination polymers: in situ formation of different ligands from 4-aminotriazole","CrystEngComm","2009","11","11","2494","","10.1039/b821491c","","","0.71073","MoKα","","0.0526","0.0434","","","0.125","0.1434","","","","","","1.097","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7201042","29.3618","0.0006","29.3618","0.0006","37.1534","0.0014","90","","90","","90","","32030.5","1.5","200","2","200","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C61 H59 Cu3 N7 O19 S3 -","- C55 H35 Cu3 N7 O14 -","- C880 H560 Cu48 N112 O224 -","16","1","","Guo, Zhiyong; Yu, Jiangbo; Li, Guanghua; Si, Zhenjun; Guo, Huadong; Zhang, Hongjie","A three-dimensional metal‒organic framework based on a triazine derivative: syntheses, structure analysis, and sorption studies","CrystEngComm","2009","11","11","2254","","10.1039/b903932e","","","0.71073","MoKα","","0.1313","0.0938","","","0.2542","0.2743","","","","","","1.017","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7201689","17.3064","0.0008","17.3064","0.0008","18.5975","0.0016","90","","90","","90","","5570.2","0.6","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C4 H6 Cu2 I N3 O2 -","- C4 H6 Cu2 I N3 O2 -","- C64 H96 Cu32 I16 N48 O32 -","16","1","","Zhao, Zhen-Guo; Zhang, Jian; Wu, Xiao-Yuan; Zhai, Quan-Guo; Chen, Li-Juan; Chen, Shu-Mei; Xie, Yi-Ming; Lu, Can-Zhong","(3,4)-Connected jph-type porous framework with Cu4I4 clusters as jointing points of helices","CrystEngComm","2008","10","3","273","","10.1039/b712855j","","","0.71073","MoKα","","0.0753","0.0662","","","0.2045","0.2166","","","","","","1.056","","","","has coordinates","180347","2020-10-21","18:00:00",""
"7202227","12.086","0.0017","12.086","0.0017","12.0361","0.0019","90","","90","","90","","1758.1","0.4","173","","173","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C6 H16 N2 O3.7 -","- C6 H15.404 N2 O3.702 -","- C48 H123.232 N16 O29.616 -","8","0.5","","Laus, Gerhard; Kahlenberg, Volker; Wurst, Klaus; Lörting, Thomas; Schottenberger, Herwig","Hydrogen bonding in the perhydrate and hydrates of 1,4-diazabicyclo[2.2.2]octane (DABCO)","CrystEngComm","2008","10","11","1638","","10.1039/b807303a","","","0.71073","MoKα","","0.0739","0.0563","","","0.1378","0.1534","","","","","","1.084","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202230","19.486","0.003","19.486","0.003","21.706","0.004","90","","90","","90","","8242","2","294","2","294","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C64 H88 Ag4 Cl4 N8 O16 S8 -","- C64 H88 Ag4 Cl4 N8 O16 S8 -","- C256 H352 Ag16 Cl16 N32 O64 S32 -","4","0.25","","Zhang, Shu-Ming; Hu, Tong-Liang; Li, Jian-Rong; Du, Jian-Long; Bu, Xian-He","Silver(I) coordination architectures with quinoxaline-based N,S-donor ligands: structures and luminescent properties","CrystEngComm","2008","10","11","1595","","10.1039/b807485b","","","0.71073","MoKα","","0.0976","0.064","","","0.1563","0.1809","","","","","","1.026","","","","has coordinates,has disorder","180353","2020-10-21","18:00:00",""
"7202828","13.1259","0.0003","13.1259","0.0003","22.2808","0.0006","90","","90","","90","","3838.74","0.16","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","(2,2'-bipyridine-3,3'-diol -H)chlorocopper(ii)","","","- C10 H7 Cl Cu N2 O2 -","- C10 H7 Cl Cu N2 O2 -","- C160 H112 Cl16 Cu16 N32 O32 -","16","1","","Stephenson, Maria D.; Hardie, Michaele J.","Network structures with 2,2?-bipyridine-3,3?diol: a discrete Co(III) complex that forms a porous 3-D hydrogen bonded network, and Cu(ii) coordination chains","CrystEngComm","2007","9","6","496","","10.1039/b702509m","","","0.71073","MoKα","","0.0467","0.0364","","","0.0887","0.0949","","","","","","1.074","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202829","13.2775","0.0001","13.2775","0.0001","22.4184","0.0003","90","","90","","90","","3952.18","0.07","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","(2,2'-bipyridine-3,3'-diol-H)bromocopper(ii)","","","- C10 H7 Br Cu N2 O2 -","- C10 H7 Br Cu N2 O2 -","- C160 H112 Br16 Cu16 N32 O32 -","16","1","","Stephenson, Maria D.; Hardie, Michaele J.","Network structures with 2,2?-bipyridine-3,3?diol: a discrete Co(III) complex that forms a porous 3-D hydrogen bonded network, and Cu(ii) coordination chains","CrystEngComm","2007","9","6","496","","10.1039/b702509m","","","0.71073","MoKα","","0.0562","0.0539","","","0.1403","0.1413","","","","","","1.287","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202931","21.8492","0.0012","21.8492","0.0012","7.3635","0.0009","90","","90","","90","","3515.2","0.5","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","Tetrakis-(4-sulfonatophenyl)methane","Tetrakis-(4-sulfonatophenyl)methane","","- C50 H32 O44 S8 -","- C50 H32 O44 S8 -","- C100 H64 O88 S16 -","2","0.125","","Sarma, Bipul; Nangia, Ashwini","Tetrakis(4-sulfophenyl)methane dodecahydrate. Reversible and selective water inclusion and release in an organic host","CrystEngComm","2007","9","8","628","","10.1039/b706194c","","","0.71073","MoKα","","0.1272","0.0818","","","0.1821","0.2067","","","","","","1.084","","","","has coordinates,has disorder","180360","2020-10-21","18:00:00",""
"7203605","18.711","0.003","18.711","0.003","22.584","0.003","90","","90","","90","","7907","2","298","2","298","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C4 H4 Ag F6 I N3 P -","- C4 H4 Ag F6 I N3 P -","- C64 H64 Ag16 F96 I16 N48 P16 -","16","1","","Lin, Chih-Yuan; Chan, Zhi-Kai; Yeh, Chun-Wei; Wu, Chia-Jun; Chen, Jhy-Der; Wang, Ju-Chun","Roles of I?I and Ag?I interactions on the self-assembly of Ag(i) complexes containing 2-amino-5-iodopyrimidine; formation of the unique Ag?I?I?Ag interaction","CrystEngComm","2006","8","11","841","","10.1039/b611044d","","","0.71073","MoKα","","0.0995","0.0481","","","0.103","0.1133","","","","","","1.034","","","","has coordinates","180367","2020-10-21","18:00:00",""
"7203825","35.505","0.008","35.505","0.008","15.724","0.004","90","","90","","90","","19822","8","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C62 H138 N2 O28 S2 Sn12 -","- C62 H132 N2 O28 S2 Sn12 -","- C496 H1056 N16 O224 S16 Sn96 -","8","0.5","","Ribot, François; Veautier, Delphine; Guillaudeu, Steven J.; Lalot, Thierry","Poly[{(BuSn)12O14(OH)6}(AMPS)2] and poly[methyl acrylate-co-{(BuSn)12O14(OH)6}(AMPS)2]: hybrid polymers cross-linked through electrostatic interactions","Journal of Materials Chemistry","2005","15","35-36","3973","","10.1039/b507214j","","","0.71073","MoKα","","0.0822","0.0611","","","0.1205","0.1581","","","","","","0.983","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7204278","16.563","0.001","16.563","0.001","20.657","0.001","90","","90","","90","","5666.9","0.6","293","2","293","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C33 H38 S2 -","- C33 H38 S2 -","- C264 H304 S16 -","8","0.5","","Destri, Silvia; Pasini, Mariacecilia; Botta, Chiara; Porzio, William; Bertini, Fabio; Marchiò, Luciano","Synthesis and crystal structure and optical properties of fluorenic-core oligomers","Journal of Materials Chemistry","2002","12","4","924","","10.1039/b109089p","","","0.71073","MoKα","","0.0786","0.041","","","0.0914","0.0944","","","","","","0.728","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204862","17.0947","0.0011","17.0947","0.0011","10.7531","0.0008","90","","90","","90","","3142.4","0.4","297","2","297","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C6 H26 Co3 N6 O28 P4 W4 -","- C6 H26 Co3 N6 O28 P4 W4 -","- C24 H104 Co12 N24 O112 P16 W16 -","4","0.25","","Yan, Bangbo; Goh, Ngoh K.; Chia, Lian S.; Stucky, Galen D.","Hydrothermal synthesis, structures and catalytic properties of the new open-framework cobalt tungsten phosphates (enH2)3[Co3W4P4O28] and K6[Co3W4P4O28]�4H2O","Journal of Materials Chemistry","2004","14","10","1567","","10.1039/b402942a","","","0.71073","MoKα","","0.0623","0.0399","","","0.0838","0.0911","","","","","","1.05","","","","has coordinates,has disorder","180379","2020-10-21","18:00:00",""
"7204863","16.96","0.005","16.96","0.005","10.705","0.005","90","","90","","90","","3079.2","1.9","299","2","299","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- Co3 H8 K6 O32 P4 W4 -","- Co3 K6 O31.8 P4 W4 -","- Co12 K24 O127.2 P16 W16 -","4","0.25","","Yan, Bangbo; Goh, Ngoh K.; Chia, Lian S.; Stucky, Galen D.","Hydrothermal synthesis, structures and catalytic properties of the new open-framework cobalt tungsten phosphates (enH2)3[Co3W4P4O28] and K6[Co3W4P4O28]�4H2O","Journal of Materials Chemistry","2004","14","10","1567","","10.1039/b402942a","","","0.71073","MoKα","","0.1066","0.0547","","","0.0955","0.1106","","","","","","0.997","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7205154","26.9217","0.0006","26.9217","0.0006","10.281","0.0002","90","","90","","90","","7451.4","0.3","173","2","173","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C52 H84 Cu4 N12 O8 P4 S8 -","- C52 H84 Cu4 N12 O8 P4 S8 -","- C208 H336 Cu16 N48 O32 P16 S32 -","4","0.25","","Safin, Damir A.; Babashkina, Maria G.; Bolte, Michael; Klein, Axel","Versatile structures and photophysical properties of poly- and mononuclear CuI complexes with N-thiophosphorylated thioureas RNHC(S)NHP(S)(OiPr)2 and phosphanes","CrystEngComm","2011","13","2","568","","10.1039/c0ce00125b","","","0.71073","MoKα","","0.0402","0.0293","","","0.0625","0.0661","","","","","","1.089","","","","has coordinates","180382","2020-10-21","18:00:00",""
"7205205","19.873","0.003","19.873","0.003","12.5477","0.0016","90","","90","","90","","4955.5","1.2","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C48 H40 Cu2 N16 W -","- C48 H40 Cu2 N16 W -","- C192 H160 Cu8 N64 W4 -","4","0.25","","Qian, Jun; Zhao, Huajian; Wei, Hongyang; Li, Jianghua; Zhang, Jinfang; Yoshikawa, Hirofumi; Awaga, Kunio; Zhang, Chi","Two 3D coordination assemblies with same cluster configuration showing different magnetic behaviors: a ferromagnetic {[W(CN)8Co2(DMF)8][NO3]}n and a paramagnetic {W(CN)8Cu2(py)8}n","CrystEngComm","2011","13","2","517","","10.1039/c0ce00227e","","","0.7107","MoKα","","0.0642","0.0583","","","0.0951","0.0968","","","","","","1.292","","","","has coordinates","180383","2020-10-21","18:00:00",""
"7205206","12.1408","0.0002","12.1408","0.0002","34.7802","0.0008","90","","90","","90","","5126.57","0.17","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H56 Co2 N16 O8 W -","- C32 H56 Co2 N16 O8 W -","- C128 H224 Co8 N64 O32 W4 -","4","0.25","","Qian, Jun; Zhao, Huajian; Wei, Hongyang; Li, Jianghua; Zhang, Jinfang; Yoshikawa, Hirofumi; Awaga, Kunio; Zhang, Chi","Two 3D coordination assemblies with same cluster configuration showing different magnetic behaviors: a ferromagnetic {[W(CN)8Co2(DMF)8][NO3]}n and a paramagnetic {W(CN)8Cu2(py)8}n","CrystEngComm","2011","13","2","517","","10.1039/c0ce00227e","","","0.71073","MoKα","","0.0267","0.0224","","","0.0524","0.0536","","","","","","1.042","","","","has coordinates","180383","2020-10-21","18:00:00",""
"7205351","9.742","0.0014","9.742","0.0014","74.419","0.015","90","","90","","90","","7063","2","343","2","343","2","","","","","","","","6","I 41/a :2","-I 4ad","88","bis(ethylenedithio)tetrathiafulvalenium_ tetrabromocobaltate(II)_dichlorobenzene_(4/1/1)","","","- C46 H36 Br4 Cl2 Co S32 -","- C46 H36 Br4 Cl2 Co S32 -","- C184 H144 Br16 Cl8 Co4 S128 -","4","0.25","","Shilov, Gena V.; Zhilyaeva, Elena I.; Flakina, Alexandra M.; Torunova, Svetlana A.; Lyubovskii, Rustem B.; Aldoshin, Sergey M.; Lyubovskaya, Rimma N.","Phase transition at 320 K in a new layered organic metal conductor (BEDT-TTF)4CoBr4(C6H4Cl2)","CrystEngComm","2011","13","5","1467","","10.1039/c0ce00409j","","","0.71073","MoKα","","0.2886","0.0546","","","0.0846","0.0978","","","","","","0.975","","","","has coordinates,has disorder","180384","2020-10-21","18:00:00",""
"7205393","29.9029","0.0008","29.9029","0.0008","6.6248","0.0003","90","","90","","90","","5923.8","0.3","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C18 H12 Mn N2 O2 -","- C18 H12 Mn N2 O2 -","- C288 H192 Mn16 N32 O32 -","16","1","","Li, Bo; Zhang, Jingping; Zhang, Yan; Cui, Shuxin; Li, Wenliang; Wang, Yu; Zhang, Xiaoying","Two unique 8-quinolinato (q) based one dimensional complexes [FeIIMnII(q)4·(H2O)0.25]n and [MnII(q)2]n: synthesis, structures, and magnetism","CrystEngComm","2011","13","2","418","","10.1039/c0ce00488j","","","0.71073","MoKα","","0.0956","0.0363","","","0.0381","0.0416","","","","","","0.838","","","","has coordinates","180384","2020-10-21","18:00:00",""
"7205681","22.841","0.003","22.841","0.003","15.503","0.003","90","","90","","90","","8088","2","150","2","150","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C56 H57 Co Mo8 N16 O42 P V6 -","- C56 H56 Co Mo8 N16 O42 P V6 -","- C224 H224 Co4 Mo32 N64 O168 P4 V24 -","4","0.25","","Meng, Jing-Xin; Lu, Ying; Li, Yang-Guang; Fu, Hai; Wang, En-Bo","Controllable self-assembly of four new metal‒organic frameworks based on different phosphomolybdate clusters by altering the molar ratio of H3PO4 and Na2MoO4","CrystEngComm","2011","13","7","2479","","10.1039/c0ce00639d","","","0.71073","MoKα","","0.0358","0.0293","","","0.0779","0.0811","","","","","","1.061","","","","has coordinates","180387","2020-10-21","18:00:00",""
"7205684","17.11","0.002","17.11","0.002","10.74","0.002","90","","90","","90","","3144.2","0.8","150","2","150","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C6 H30 Co3 Mo4 N6 O28 P4 -","- C6 Co3 Mo4 N6 O28 P4 -","- C24 Co12 Mo16 N24 O112 P16 -","4","0.25","","Meng, Jing-Xin; Lu, Ying; Li, Yang-Guang; Fu, Hai; Wang, En-Bo","Controllable self-assembly of four new metal‒organic frameworks based on different phosphomolybdate clusters by altering the molar ratio of H3PO4 and Na2MoO4","CrystEngComm","2011","13","7","2479","","10.1039/c0ce00639d","","","0.71073","MoKα","","0.0408","0.0358","","","0.0927","0.0951","","","","","","1.144","","","","has coordinates","180387","2020-10-21","18:00:00",""
"7205764","29.9753","0.0005","29.9753","0.0005","6.0374","0.0002","90","","90","","90","","5424.7","0.2","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","(cycloheptylammonium).(benzoate)","","- C14 H21 N O2 -","- C14 H21 N O2 -","- C224 H336 N16 O32 -","16","1","","Lemmerer, Andreas","Steric effects in hydrogen bonded columns of salts of benzoic acid and 1-adamantanecarboxylic acid with the cyclic amines CnH2n+1NH2, n = 5, 6, 7, 8 and 12","CrystEngComm","2011","13","8","2849","","10.1039/c0ce00749h","","","0.71073","MoKα","","0.0742","0.0442","","","0.0974","0.1117","","","","","","1.021","","","","has coordinates,has disorder","180388","2020-10-21","18:00:00",""
"7205817","17.1496","0.0004","17.1496","0.0004","16.3976","0.0008","90","","90","","90","","4822.7","0.3","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C36 H48 Br4 N4 Ni4 O16 -","- C36 H48 Br4 N4 Ni4 O16 -","- C144 H192 Br16 N16 Ni16 O64 -","4","0.25","","Zhang, Wen-Hua; Sulaiman, Norlela Binte; Tio, P. X. Shaun; Hor, T. S. Andy","Nuclearity growth towards Ni(ii) cubane in self-assembly with 2-hydroxymethyl pyridine (hmpH) and 5-ethoxycarbonyl-2-hydroxymethyl pyridine (5-ehmpH)","CrystEngComm","2011","13","8","2915","","10.1039/c0ce00831a","","","0.71073","MoKα","","0.03","0.0264","","","0.0679","0.0696","","","","","","1.08","","","","has coordinates","180389","2020-10-21","18:00:00",""
"7206215","22.382","0.003","22.382","0.003","11.243","0.002","90","","90","","90","","5632.2","1.5","223","2","223","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C28 H34 N4 O8 Zn2 -","- C28 H34 N4 O8 Zn2 -","- C224 H272 N32 O64 Zn16 -","8","0.5","","Jing, Wang; Ren, Zhi-Gang; Dai, Ming; Chen, Yang; Lang, Jian-Ping","Novel Zn and Cd coordination polymers of 1,1′-(1,6-hexanediyl)bis-1H-benzimidazole: solvothermal synthesis, crystal structures and photoluminescence properties","CrystEngComm","2011","13","16","5111","","10.1039/c1ce05156c","","","0.71073","MoKα","","0.0637","0.0478","","","0.0968","0.1037","","","","","","1.109","","","","has coordinates","180393","2020-10-21","18:00:00",""
"7206356","20.5738","0.001","20.5738","0.001","36.261","0.004","90","","90","","90","","15349","2","85","2","85","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C68 H57 Br8 O12 Si8 -","- C64 H52 Br8 O12 Si8 -","- C512 H416 Br64 O96 Si64 -","8","0.5","","Roll, Mark F.; Mathur, Priyanka; Takahashi, Kunio; Kampf, Jeffrey W.; Laine, R. M.","[PhSiO1.5]8 promotes self-bromination to produce [o-BrPhSiO1.5]8: further bromination gives crystalline [2,5-Br2PhSiO1.5]8 with a density of 2.32 g cm−3 and a calculated refractive index of 1.7 or the tetraicosa bromo compound [Br3PhSiO1.5]8","Journal of Materials Chemistry","2011","21","30","11167","","10.1039/c1jm11536g","","","0.71073","MoKα","","0.0626","0.0526","","","0.146","0.153","","","","","","1.089","","","","has coordinates,has disorder","180394","2020-10-21","18:00:00",""
"7206357","18.2426","0.0005","18.2426","0.0005","8.5167","0.0003","90","","90","","90","","2834.29","0.15","293","2","293","2","","","","","","","Synthesized by the authors. See text","4","I 41/a :2","-I 4ad","88","","","","- C29 H24 N4 O12 -","- C29 H24 N4 O12 -","- C116 H96 N16 O48 -","4","0.25","","Dominic Laliberté; Thierry Maris; James D. Wuest","Molecular networks built from weakly interacting nitro-substituted pentaerythrityl tetraaryl ethers","CrystEngComm","2005","7","","158","160","10.1039/b500757g","","","1.54178","CuKα","","0.0684","0.0534","","","0.1279","0.1385","","","","","","1.071","","","","has coordinates","180394","2020-10-21","18:00:00",""
"7206466","14.335","0.005","14.335","0.005","12.058","0.005","90","","90","","90","","2477.8","1.6","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C4.25 H5 Ag Br N2 -","- C4.25 H5 Ag Br N2 -","- C68 H80 Ag16 Br16 N32 -","16","1","","Bai, Hong-Ye; Yang, Jin; Liu, Bo; Ma, Jian-Fang; Kan, Wei-Qiu; Liu, Yun-Yu; Liu, Ying-Ying","Syntheses, structures, and photoluminescence of five silver(i) coordination polymers based on tetrakis(imidazol-1-ylmethyl)methane","CrystEngComm","2011","13","19","5877","","10.1039/c0ce00834f","","","0.71069","MoKα","","0.0395","0.0271","","","0.061","0.0628","","","","","","1.063","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7206695","10.0681","0.0003","10.0681","0.0003","23.396","0.001","90","","90","","90","","2371.57","0.14","200","2","200","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C8 H16 Br2 Co O4 -","- C8 H16 Br2 Co O4 -","- C64 H128 Br16 Co8 O32 -","8","0.5","","Duan, Zhiming; Zhang, Yan; Zhang, Bin; Zhu, Daoben","Solvent-mediated crystal-to-crystal transformation within the CoBr2(1,4-dioxane)m(H2O)n family (m = 2, 3; n = 0, 2, 4) from 2D to 1D, and 0D","CrystEngComm","2011","13","22","6801","","10.1039/c1ce05668a","","","0.71073","MoKα","","0.0868","0.041","","","0.1179","0.1328","","","","","","1.029","","","","has coordinates","180397","2020-10-21","18:00:00",""
"7206698","9.1728","0.0003","9.1728","0.0003","19.5503","0.0007","90","","90","","90","","1644.97","0.1","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C8 H24 Br2 Co O8 -","- C8 H24 Br2 Co O8 -","- C32 H96 Br8 Co4 O32 -","4","0.25","","Duan, Zhiming; Zhang, Yan; Zhang, Bin; Zhu, Daoben","Solvent-mediated crystal-to-crystal transformation within the CoBr2(1,4-dioxane)m(H2O)n family (m = 2, 3; n = 0, 2, 4) from 2D to 1D, and 0D","CrystEngComm","2011","13","22","6801","","10.1039/c1ce05668a","","","0.71073","MoKα","","0.0621","0.0433","","","0.1132","0.1239","","","","","","1.046","","","","has coordinates","180397","2020-10-21","18:00:00",""
"7206763","27.956","0.002","27.956","0.002","16.8396","0.0013","90","","90","","90","","13160.8","1.7","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","(Co2(oba)2(bpy)3(H2O)2).bpy.H2O","","","- C34 H30 Co N4 O8 -","- C34 H30 Co N4 O8 -","- C544 H480 Co16 N64 O128 -","16","1","","Cheng, Xiao-Ning; Zhang, Wei-Xiong; Chen, Xiao-Ming","Metal ion modulation of polycatenation networks constructed by mixed rigid and flexible bridging ligands","CrystEngComm","2011","13","22","6613","","10.1039/c1ce05933e","","","0.71073","MoKα","","0.0965","0.0608","","","0.1538","0.1888","","","","","","1.055","","","","has coordinates,has disorder","180398","2020-10-21","18:00:00",""
"7206768","14.081","0.0002","14.081","0.0002","27.303","0.0004","90","","90","","90","","5413.49","0.13","150","2","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C11 H24 I N -","- C11 H24 I N -","- C176 H384 I16 N16 -","16","1","","Belhocine, Tayeb; Forsyth, Stewart A.; Gunaratne, H. Q. Nimal; Nieuwenhuyzen, Mark; Nockemann, Peter; Puga, Alberto V.; Seddon, Kenneth R.; Srinivasan, Geetha; Whiston, Keith","Azepanium ionic liquids","Green Chemistry","2011","13","11","3137","","10.1039/c1gc15189d","","","0.71073","MoKα","","0.0518","0.0347","","","0.0947","0.1224","","","","","","1.144","","","","has coordinates,has disorder","180398","2020-10-21","18:00:00",""
"7206998","22.541","0.0006","22.541","0.0006","14.6276","0.0005","90","","90","","90","","7432.2","0.4","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C14 H20 Cu2 I2 N4 -","- C14 H20 Cu2 I2 N4 -","- C224 H320 Cu32 I32 N64 -","16","1","","Bai, Shi-Qiang; Yong, Anna Marie; Hu, Jian Jin; Young, David J.; Zhang, Xinhai; Zong, Yun; Xu, Jianwei; Zuo, Jing-Lin; Hor, T. S. Andy","Zinc, cobalt and copper coordination polymers with different structural motifs from picolyl-triazole hybrid ligands","CrystEngComm","2012","14","3","961","","10.1039/c1ce05808h","","","0.71073","MoKα","","0.0365","0.0324","","","0.0838","0.0857","","","","","","1.071","","","","has coordinates,has disorder","180400","2020-10-21","18:00:00",""
"7207258","27.4538","0.0009","27.4538","0.0009","10.7505","0.0004","90","","90","","90","","8102.8","0.5","173","2","173","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C60 H88 Ag4 N8 O16 P4 S8 -","- C60 H88 Ag4 N8 O16 P4 S8 -","- C240 H352 Ag16 N32 O64 P16 S32 -","4","0.25","","Safin, Damir A.; Babashkina, Maria G.; Bolte, Michael; Garcia, Yann","Homoleptic polynuclear CuI and AgI complexes of N-thiophosphorylated thioureas o-RO(O)CC6H4NHC(S)NHP(S)(OiPr)2 (R = Me, Et)","CrystEngComm","2012","14","3","774","","10.1039/c2ce06346h","","","0.71073","MoKα","","0.0791","0.0551","","","0.1237","0.1374","","","","","","1.049","","","","has coordinates,has disorder","180403","2020-10-21","18:00:00",""
"7207342","17.376","0.0014","17.376","0.0014","10.304","0.0017","90","","90","","90","","3111","0.6","273","2","273","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C6 H3 Cl2 O Tl -","- C6 H3 Cl2 O Tl -","- C96 H48 Cl32 O16 Tl16 -","16","1","","Akhbari, Kamran; Morsali, Ali","Halogen dipole moment effect of phenolic ring on formation of stair like polymers or polymers with tetranuclear cubic cage units; new precursors for preparation of TlCl and Tl2O3 nanostructures","CrystEngComm","2012","14","5","1618","","10.1039/c1ce06132a","","","0.71073","MoKα","","0.0361","0.0291","","","0.0615","0.0636","","","","","","1.113","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207349","17.4773","0.0007","17.4773","0.0007","10.2912","0.0002","90","","90","","90","","3143.51","0.19","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C24 H12 Br4 Cl4 O4 Tl4 -","- C24 H12 Br4 Cl4 O4 Tl4 -","- C96 H48 Br16 Cl16 O16 Tl16 -","4","0.25","","Akhbari, Kamran; Morsali, Ali","Halogen dipole moment effect of phenolic ring on formation of stair like polymers or polymers with tetranuclear cubic cage units; new precursors for preparation of TlCl and Tl2O3 nanostructures","CrystEngComm","2012","14","5","1618","","10.1039/c1ce06132a","","","0.71073","MoKα","","0.0542","0.0326","","","0.0778","0.1142","","","","","","1.108","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207540","31.7755","0.0007","31.7755","0.0007","16.0824","0.0005","90","","90","","90","","16238.1","0.7","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C51 H68 Co3 N24 O31 -","- C51 H42 Co3 N24 O31 -","- C408 H336 Co24 N192 O248 -","8","0.5","","Wang, Nan; Feng, Yue-Chao; Shi, Wei; Zhao, Bin; Cheng, Peng; Liao, Dai-Zheng; Yan, Shi-Ping","Synthesis, structure, fluorescent and magnetic properties of a series of coordination polymers based on a long and flexible bis-triazole ligand","CrystEngComm","2012","14","8","2769","","10.1039/c2ce06290a","","","0.71073","MoKα","","0.1186","0.0736","","","0.2197","0.237","","","","","","1.011","","","","has coordinates,has disorder","180406","2020-10-21","18:00:00",""
"7207818","27.312","0.0005","27.312","0.0005","34.5543","0.0015","90","","90","","90","","25775.6","1.3","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C125 H134 N10 Ni5 O32 -","- C125 H134 N10 Ni5 O32 -","- C1000 H1072 N80 Ni40 O256 -","8","0.5","","Xu, Xinxin; Zhang, Xia; Liu, Xiaoxia; Wang, Linshan; Wang, Enbo","Two 2D →3D entangled coordination polymers with polycatenated and polythreaded features based on 44-sql layers","CrystEngComm","2012","14","9","3264","","10.1039/c2ce06593b","","","0.71073","MoKα","","0.1049","0.0489","","","0.0957","0.1197","","","","","","0.928","","","","has coordinates","180409","2020-10-21","18:00:00",""
"7207853","18.775","0.001","18.775","0.001","19.672","0.003","90","","90","","90","","6934.4","1.2","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H10 Cu I2 N O4 -","- C16 H10 Cu I2 N O4 -","- C256 H160 Cu16 I32 N16 O64 -","16","1","","Burrows, Andrew D.; Mahon, Mary F.; Raithby, Paul R.; Warren, Anna J.; Teat, Simon J.; Warren, John E.","The effect of carboxylate and N,N′-ditopic ligand lengths on the structures of copper and zinc coordination polymers","CrystEngComm","2012","14","10","3658","","10.1039/c2ce06709a","","","0.71073","MoKα","","0.1125","0.0668","","","0.175","0.189","","","","","","1.06","","","","has coordinates,has disorder","180409","2020-10-21","18:00:00",""
"7208252","22.658","0.003","22.658","0.003","14.766","0.004","90","","90","","90","","7581","2","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C17 H14 Cd N2 O5 -","- C17 H14 Cd N2 O5 -","- C272 H224 Cd16 N32 O80 -","16","1","","Guo, Mengwei; Chen, Nan; Yue, Zhifang; Zhang, Yu; Li, Gang","Two unprecedented strontium(ii) and cadmium(ii) MOFs constructed from 2-naphthyl imidazole dicarboxylate ligand","CrystEngComm","2012","14","15","4955","","10.1039/c2ce25314c","","","0.71073","MoKα","","0.0974","0.0694","","","0.2166","0.2419","","","","","","1.013","","","","has coordinates,has disorder","180413","2020-10-21","18:00:00",""
"7208374","27.9106","0.001","27.9106","0.001","9.8447","0.0007","90","","90","","90","","7669","0.7","298","2","298","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C22 H22 N2 O2 -","- C22 H22 N2 O2 -","- C352 H352 N32 O32 -","16","1","","Pang, Tao; Shang, Jie; Yang, Qin-Wan; Sun, Yu; Wu, An-Xin; Jiang, Hua","An unprecedented triple helix based on the tetrameric assembly of a macrocycle driven by weak C‒H⋯π and C‒H⋯O interactions","CrystEngComm","2012","14","16","5170","","10.1039/c2ce25549a","","","0.71073","MoKα","","0.1018","0.0938","","","0.2019","0.2055","","","","","","1.25","","","","has coordinates","180414","2020-10-21","18:00:00",""
"7208493","19.777","0.003","19.777","0.003","46.892","0.009","90","","90","","90","","18341","5","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C100 H79 N10 O25 Zn5 -","- C100 H66 N10 O25 Zn5 -","- C800 H528 N80 O200 Zn40 -","8","0.5","","Dai, Ming; Yan, Wen-Yan; Ren, Zhi-Gang; Wang, Hui-Fang; Gong, Wei-Jie; Li, Fu-Ling; Zhao, Xin; Li, Hong-Xi; Lang, Jian-Ping","Zinc(ii) coordination polymers of tetrakis(4-pyridyl)cyclobutane and various dicarboxylates: Syntheses, structures and luminescent properties","CrystEngComm","2012","14","19","6230","","10.1039/c2ce25482d","","","0.71073","MoKα","","0.1295","0.1","","","0.2486","0.2707","","","","","","1.175","","","","has coordinates","180415","2020-10-21","18:00:00",""
"7208561","21.6024","0.0008","21.6024","0.0008","11.3824","0.0008","90","","90","","90","","5311.8","0.5","293.15","","293.15","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C12 H11 Eu N O9.5 -","- C12 H8 Eu N O8.5 -","- C192 H128 Eu16 N16 O136 -","16","1","","Ma, Jie; Jiang, Fei-Long; Chen, Lian; Wu, Ming-Yan; Zhang, Shu-Quan; Xiong, Ke-cai; Han, Dong; Hong, Mao-Chun","Structure and photoluminescent properties of lanthanide coordination polymers based on two isomers of iminodiacetic acid substituted isophthalate and terephthalate ligands","CrystEngComm","2012","14","18","6055","","10.1039/c2ce25655j","","","0.71073","MoKα","","0.0304","0.027","","","0.0593","0.0614","","","","","","1.065","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7208562","21.4229","0.0006","21.4229","0.0006","11.3047","0.0006","90","","90","","90","","5188.2","0.3","293.15","","293.15","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C12 H11 N O9.5 Tb -","- C12 H8 N O8.5 Tb -","- C192 H128 N16 O136 Tb16 -","16","1","","Ma, Jie; Jiang, Fei-Long; Chen, Lian; Wu, Ming-Yan; Zhang, Shu-Quan; Xiong, Ke-cai; Han, Dong; Hong, Mao-Chun","Structure and photoluminescent properties of lanthanide coordination polymers based on two isomers of iminodiacetic acid substituted isophthalate and terephthalate ligands","CrystEngComm","2012","14","18","6055","","10.1039/c2ce25655j","","","0.71073","MoKα","","0.0315","0.027","","","0.0613","0.0641","","","","","","1.015","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7208563","21.5765","0.0004","21.5765","0.0004","11.3469","0.0004","90","","90","","90","","5282.5","0.2","293.15","","293.15","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C12 H11 N O9.5 Sm -","- C12 H8 N O8.5 Sm -","- C192 H128 N16 O136 Sm16 -","16","1","","Ma, Jie; Jiang, Fei-Long; Chen, Lian; Wu, Ming-Yan; Zhang, Shu-Quan; Xiong, Ke-cai; Han, Dong; Hong, Mao-Chun","Structure and photoluminescent properties of lanthanide coordination polymers based on two isomers of iminodiacetic acid substituted isophthalate and terephthalate ligands","CrystEngComm","2012","14","18","6055","","10.1039/c2ce25655j","","","0.71073","MoKα","","0.0204","0.0178","","","0.0482","0.0494","","","","","","1.036","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7208707","18.5081","0.0005","18.5081","0.0005","13.2016","0.0009","90","","90","","90","","4522.2","0.4","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C48 H32 Cd Cu2 N4 O8 -","- C48 H32 Cd Cu2 N4 O8 -","- C192 H128 Cd4 Cu8 N16 O32 -","4","0.25","","He, Yan-Ping; Tan, Yan-Xi; Zhang, Jian","Deliberate design of a neutral heterometallic organic framework containing a record 25-fold interpenetrating diamondoid network","CrystEngComm","2012","14","20","6359","","10.1039/c2ce25605c","","","0.71073","MoKα","","0.0662","0.0513","","","0.1596","0.1712","","","","","","1.089","","","","has coordinates,has disorder","180418","2020-10-21","18:00:00",""
"7209265","20.423","0.003","20.423","0.003","16.226","0.003","90","","90","","90","","6767.8","1.9","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C10 H12.5 N4 O13.25 Sm2 -","- C10 H12.5 N4 O13.25 Sm2 -","- C160 H200 N64 O212 Sm32 -","16","1","","Wang, Ping; Fan, Rui-Qing; Liu, Xin-Rong; Wang, Li-Yuan; Yang, Yu-Lin; Cao, Wen-Wu; Yang, Bin; Hasi, WuLiJi; Su, Qing; Mu, Ying","Two-/three-dimensional open lanthanide‒organic frameworks containing rigid/flexible dicarboxylate ligands: synthesis, crystal structure and photoluminescent properties","CrystEngComm","2013","15","10","1931","","10.1039/c3ce26684b","","","0.71073","MoKα","","0.0405","0.0299","","","0.0622","0.0652","","","","","","1.039","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209266","20.3131","0.0014","20.3131","0.0014","16.19","0.002","90","","90","","90","","6680.4","1.1","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C10 H12.5 Eu2 N4 O13.25 -","- C10 H12.5 Eu2 N4 O13.25 -","- C160 H200 Eu32 N64 O212 -","16","1","","Wang, Ping; Fan, Rui-Qing; Liu, Xin-Rong; Wang, Li-Yuan; Yang, Yu-Lin; Cao, Wen-Wu; Yang, Bin; Hasi, WuLiJi; Su, Qing; Mu, Ying","Two-/three-dimensional open lanthanide‒organic frameworks containing rigid/flexible dicarboxylate ligands: synthesis, crystal structure and photoluminescent properties","CrystEngComm","2013","15","10","1931","","10.1039/c3ce26684b","","","0.71073","MoKα","","0.0439","0.0312","","","0.0722","0.077","","","","","","1.051","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209267","20.299","0.003","20.299","0.003","16.157","0.003","90","","90","","90","","6657.5","1.9","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C10 H12.5 Gd2 N4 O13.25 -","- C10 H12.5 Gd2 N4 O13.25 -","- C160 H200 Gd32 N64 O212 -","16","1","","Wang, Ping; Fan, Rui-Qing; Liu, Xin-Rong; Wang, Li-Yuan; Yang, Yu-Lin; Cao, Wen-Wu; Yang, Bin; Hasi, WuLiJi; Su, Qing; Mu, Ying","Two-/three-dimensional open lanthanide‒organic frameworks containing rigid/flexible dicarboxylate ligands: synthesis, crystal structure and photoluminescent properties","CrystEngComm","2013","15","10","1931","","10.1039/c3ce26684b","","","0.71073","MoKα","","0.0361","0.0292","","","0.0841","0.0868","","","","","","1.119","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209268","20.227","0.004","20.227","0.004","16.047","0.007","90","","90","","90","","6565","3","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C10 H11.5 N4 O12.75 Tb2 -","- C10 H11.5 N4 O12.75 Tb2 -","- C160 H184 N64 O204 Tb32 -","16","1","","Wang, Ping; Fan, Rui-Qing; Liu, Xin-Rong; Wang, Li-Yuan; Yang, Yu-Lin; Cao, Wen-Wu; Yang, Bin; Hasi, WuLiJi; Su, Qing; Mu, Ying","Two-/three-dimensional open lanthanide‒organic frameworks containing rigid/flexible dicarboxylate ligands: synthesis, crystal structure and photoluminescent properties","CrystEngComm","2013","15","10","1931","","10.1039/c3ce26684b","","","0.71073","MoKα","","0.086","0.0462","","","0.0998","0.1171","","","","","","1.029","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209269","20.213","0.0015","20.213","0.0015","16.001","0.002","90","","90","","90","","6537.5","1.1","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C10 H12.5 Dy2 N4 O13.25 -","- C10 H12.5 Dy2 N4 O13.25 -","- C160 H200 Dy32 N64 O212 -","16","1","","Wang, Ping; Fan, Rui-Qing; Liu, Xin-Rong; Wang, Li-Yuan; Yang, Yu-Lin; Cao, Wen-Wu; Yang, Bin; Hasi, WuLiJi; Su, Qing; Mu, Ying","Two-/three-dimensional open lanthanide‒organic frameworks containing rigid/flexible dicarboxylate ligands: synthesis, crystal structure and photoluminescent properties","CrystEngComm","2013","15","10","1931","","10.1039/c3ce26684b","","","0.71073","MoKα","","0.0456","0.0304","","","0.0666","0.0723","","","","","","1.019","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209291","23.8931","0.0002","23.8931","0.0002","15.9482","0.0003","90","","90","","90","","9104.5","0.2","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C16 H12 Be4 O12 -","- C16 H12 Be4 O12 -","- C256 H192 Be64 O192 -","16","1","","Kang, Maoping; Luo, Daibing; Lin, Zhien; Thiele, Günther; Dehnen, Stefanie","Crystalline beryllium carboxylate frameworks containing inorganic chains of BeO4 tetrahedra","CrystEngComm","2013","15","10","1845","","10.1039/c3ce26983c","","","0.71073","MoKα","","0.0699","0.0506","","","0.1374","0.1467","","","","","","1.047","","","","has coordinates","180423","2020-10-21","18:00:00",""
"7209402","5.9868","","5.9868","","10.043","","90","","90","","90","","359.959","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Ca (Au2 O4)","","- Au2 Ca O4 -","- Au2 Ca O4 -","- Au8 Ca4 O16 -","4","0.25","","Louzikova, A.; Range, K.J.","Hochdrucksynthese und Einkristall-Strukturverfeinerung von Calciumaurat(III), Ca Au2 O4","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1996","51","","747","750","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209729","21.79","0.001","21.79","0.001","6.9741","0.0005","90","","90","","90","","3311.3","0.3","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","[Zn(tzeg)]n","[Zn(tzeg)]n","","- C5 H7 N5 O2 Zn -","- C5 H7 N5 O2 Zn -","- C80 H112 N80 O32 Zn16 -","16","1","","Wang, Shuai-Hua; Zheng, Fa-Kun; Wu, Mei-Feng; Liu, Zhi-Fa; Chen, Jun; Guo, Guo-Cong; Wu, A-Qing","Hydrothermal syntheses, crystal structures and physical properties of a new family of energetic coordination polymers with nitrogen-rich ligand N-[2-(1H-tetrazol-5-yl)ethyl]glycine","CrystEngComm","2013","15","14","2616","","10.1039/c3ce27048c","","","0.71073","MoKα","","0.0324","0.0297","","","0.0742","0.0758","","","","","","1.008","","","","has coordinates","180428","2020-10-21","18:00:00",""
"7209983","19.6971","0.0009","19.6971","0.0009","19.9978","0.0008","90","","90","","90","","7758.7","0.6","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C21 H21 Mn2 N15 O3 -","- C21 H21 Mn2 N15 O3 -","- C168 H168 Mn16 N120 O24 -","8","0.5","","Dong, Wen-Wen; Li, Dong-Sheng; Zhao, Jun; Ma, Lu-Fang; Wu, Ya-Pan; Duan, Ya-Ping","Two solvent-dependent manganese(ii) supramolecular isomers: solid-state transformation and magnetic properties","CrystEngComm","2013","15","27","5412","","10.1039/c3ce40565f","","","0.71073","MoKα","","0.0711","0.0624","","","0.1755","0.1846","","","","","","1.064","","","","has coordinates","180430","2020-10-21","18:00:00",""
"7210048","14.3577","0.0003","14.3577","0.0003","41.3854","0.0019","90","","90","","90","","8531.3","0.5","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C17 H18 Cu N8 O7 -","- C17 H10 Cu N8 O7 -","- C272 H160 Cu16 N128 O112 -","16","1","","Yang, Yan; Du, Peng; Yang, Jin; Kan, Wei-Qiu; Ma, Jian-Fang","A series of Cu(ii) and Cd(ii) coordination polymers constructed by 3,5-dinitrosalicylic acid and flexible bis(triazole) ligands containing different spacers","CrystEngComm","2013","15","21","4357","","10.1039/c3ce00034f","","","0.71073","MoKα","","0.1146","0.0885","","","0.1858","0.1996","","","","","","1.137","","","","has coordinates,has disorder","180431","2020-10-21","18:00:00",""
"7210049","13.9645","0.0001","13.9645","0.0001","35.2304","0.0005","90","","90","","90","","6870.18","0.12","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C28 H28 Cu2 N10 O14 -","- C28 H28 Cu2 N10 O14 -","- C224 H224 Cu16 N80 O112 -","8","0.5","","Yang, Yan; Du, Peng; Yang, Jin; Kan, Wei-Qiu; Ma, Jian-Fang","A series of Cu(ii) and Cd(ii) coordination polymers constructed by 3,5-dinitrosalicylic acid and flexible bis(triazole) ligands containing different spacers","CrystEngComm","2013","15","21","4357","","10.1039/c3ce00034f","","","1.54184","CuKα","","0.073","0.0603","","","0.1571","0.1712","","","","","","0.981","","","","has coordinates,has disorder","180431","2020-10-21","18:00:00",""
"7210208","26.7928","0.0018","26.7928","0.0018","54.09","0.004","90","","90","","90","","38829","5","173","2","173","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C67 H86 Au6 Cl2 O12 P6 S12 -","- C67 H86 Au6 Cl2 O12 P6 S12 -","- C1072 H1376 Au96 Cl32 O192 P96 S192 -","16","1","","Pillay, Michael N.; Omondi, Bernard; Staples, Richard J.; van Zyl, Werner E.","A hexanuclear gold(i) metallatriangle derived from a chiral dithiophosphate: synthesis, structure, luminescence and oxidative bromination reactivity","CrystEngComm","2013","15","22","4417","","10.1039/c3ce40496j","","","0.71073","MoKα","","0.059","0.0357","","","0.0911","0.1045","","","","","","1.061","","","","has coordinates","180433","2020-10-21","18:00:00",""
"7210221","16.82","0.005","16.82","0.005","18.022","0.006","90","","90","","90","","5099","3","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C26 H22 N4 O12 Sr -","- C26 H22 N4 O12 Sr -","- C208 H176 N32 O96 Sr8 -","8","0.5","","Xiong, Zhifang; Shi, Bingbing; Li, Li; Zhu, Yanyan; Li, Gang","Construction of transition-metal coordination polymers using multifunctional imidazole dicarboxylates as spacers","CrystEngComm","2013","15","24","4885","","10.1039/c3ce40511g","","","0.71073","MoKα","","0.1443","0.0763","","","0.159","0.1995","","","","","","1.106","","","","has coordinates,has disorder","180433","2020-10-21","18:00:00",""
"7210500","29.7088","0.001","29.7088","0.001","10.3135","0.0007","90","","90","","90","","9102.8","0.8","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C21 H14 Cd N4 O5 -","- C21 H14 Cd N4 O5 -","- C336 H224 Cd16 N64 O80 -","16","1","","Chen, Jing; Li, Cheng-Peng; Du, Miao","Substituent effect of R-isophthalates (R = ‒H, ‒CH3, ‒OCH3, ‒tBu, ‒OH, and ‒NO2) on the construction of CdII coordination polymers incorporating a dipyridyl tecton 2,5-bis(3-pyridyl)-1,3,4-oxadiazole","CrystEngComm","2011","13","6","1885","","10.1039/c0ce00555j","","","0.71073","MoKα","","0.0796","0.0563","","","0.1334","0.1488","","","","","","1.081","","","","has coordinates","180436","2020-10-21","18:00:00",""
"7210779","17.9776","0.0002","17.9776","0.0002","22.3567","0.0003","90","","90","","90","","7225.55","0.15","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H24 Co N4 O14 S2 -","- C32 H24 Co N4 O14 S2 -","- C256 H192 Co8 N32 O112 S16 -","8","0.5","","Fidalgo-Marijuan, Arkaitz; Barandika, Gotzone; Bazán, Begoña; Urtiaga, Miren-Karmele; Arriortua, María Isabel","Thermal stability and crystallochemical analysis for CoII-based coordination polymers with TPP and TPPS porphyrins","CrystEngComm","2013","15","20","4181","","10.1039/c3ce40161h","","","1.54184","CuKα","","0.0856","0.0669","","","0.1845","0.204","","","","","","1.051","","","","has coordinates,has disorder","180438","2020-10-21","18:00:00",""
"7211169","10.2788","0.001","10.2788","0.001","26.373","0.003","90","","90","","90","","2786.4","0.5","213","2","213","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24 H24 Co2 O12 Zn -","- C24 H24 Co2 O12 Zn -","- C96 H96 Co8 O48 Zn4 -","4","0.25","","Kettner, Florian; Kischel, Marcus; Krautscheid, Harald","Coordination polymers based on 1,1′-cobaltocenium dicarboxylate linkers","CrystEngComm","2013","15","42","8437","","10.1039/c3ce41371c","","","0.71073","MoKα","","0.0408","0.029","","","0.0736","0.0763","","","","","","0.927","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7211640","30.168","0.001","30.168","0.001","7.1749","0.0002","90","","90","","90","","6529.9","0.4","180","2","180","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","2,6-difluoro-1,2,3,5-dithiadiazolyl","","- C7 H3 F2 N2 S2 -","- C7 H3 F2 N2 S2 -","- C224 H96 F64 N64 S64 -","32","2","","Clarke, Caroline S.; Haynes, Delia A.; Smith, J. Nicholas B.; Batsanov, Andrei S.; Howard, Judith A. K.; Pascu, Sofia I.; Rawson, Jeremy M.","The effect of fluorinated aryl substituents on the crystal structures of 1,2,3,5-dithiadiazolyl radicals","CrystEngComm","2010","12","1","172","","10.1039/b911636b","","","0.71073","MoKα","","0.0487","0.0337","","","0.0785","0.0847","","","","","","1.028","","","","has coordinates","180447","2020-10-21","18:00:00",""
"7211643","30.483","0.002","30.483","0.002","7.117","0.001","90","","90","","90","","6613.2","1.1","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","2,3,6-trifluoro-1,2,3,5-dithiadiazolyl","","- C7 H2 F3 N2 S2 -","- C7 H2 F3 N2 S2 -","- C224 H64 F96 N64 S64 -","32","2","","Clarke, Caroline S.; Haynes, Delia A.; Smith, J. Nicholas B.; Batsanov, Andrei S.; Howard, Judith A. K.; Pascu, Sofia I.; Rawson, Jeremy M.","The effect of fluorinated aryl substituents on the crystal structures of 1,2,3,5-dithiadiazolyl radicals","CrystEngComm","2010","12","1","172","","10.1039/b911636b","","","0.71073","MoKα","","0.035","0.0274","","","0.0671","0.072","","","","","","1.133","","","","has coordinates,has disorder","180447","2020-10-21","18:00:00",""
"7212243","15.6671","0.0002","15.6671","0.0002","12.6333","0.0002","90","","90","","90","","3100.94","0.07","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C12 H12 Co N8 O3 -","- C12 H12 Co N8 O3 -","- C96 H96 Co8 N64 O24 -","8","0.5","","Lin, Qi-Pu; Zhang, Jian; Cao, Xin-Yi; Yao, Yuan-Gen; Li, Zhao-Ji; Zhang, Lei; Zhou, Zhang-Feng","Canted antiferromagnetic behaviours in isostructural Co(ii) and Ni(ii) frameworks with helical lvt topology","CrystEngComm","2010","12","10","2938","","10.1039/b923235d","","","0.71073","MoKα","","0.0459","0.0416","","","0.0899","0.0921","","","","","","1.003","","","","has coordinates","180453","2020-10-21","18:00:00",""
"7212244","15.547","0.001","15.547","0.001","12.4988","0.0013","90","","90","","90","","3021.1","0.4","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C12 H12 N8 Ni O3 -","- C12 H12 N8 Ni O3 -","- C96 H96 N64 Ni8 O24 -","8","0.5","","Lin, Qi-Pu; Zhang, Jian; Cao, Xin-Yi; Yao, Yuan-Gen; Li, Zhao-Ji; Zhang, Lei; Zhou, Zhang-Feng","Canted antiferromagnetic behaviours in isostructural Co(ii) and Ni(ii) frameworks with helical lvt topology","CrystEngComm","2010","12","10","2938","","10.1039/b923235d","","","0.71073","MoKα","","0.0416","0.0392","","","0.0979","0.1","","","","","","1.007","","","","has coordinates","180453","2020-10-21","18:00:00",""
"7212750","26.0796","0.0003","26.0796","0.0003","17.9843","0.0005","90","","90","","90","","12231.9","0.4","123","2","123","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C140 H106 Cl4 Co F12 N30 P2 -","- C140 H106 Cl4 Co F12 N30 P2 -","- C560 H424 Cl16 Co4 F48 N120 P8 -","4","0.25","","Scicluna, Todd R.; Fraser, Benjamin H.; Gorham, Nicole T.; MacLellan, Jonathan G.; Massi, Massimiliano; Skelton, Brian W.; St Pierre, Timothy G.; Woodward, Robert C.","Di[2,6-bis(5-phenylpyrazol-3-yl)pyridine]Co(II): an old coordination mode for a novel supramolecular assembly","CrystEngComm","2010","12","11","3422","","10.1039/c0ce00036a","","","0.71073","MoKα","","0.151","0.0869","","","0.2372","0.2916","","","","","","1.039","","","","has coordinates,has disorder","180458","2020-10-21","18:00:00",""
"7212843","40.561","0.004","40.561","0.004","7.4674","0.0007","90","","90","","90","","12285","2","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C22 H30 Cd2 Cl2 N4 O5 -","- C22 H30 Cd2 Cl2 N4 O5 -","- C352 H480 Cd32 Cl32 N64 O80 -","16","1","","Fang, Hua-Cai; Ge, Ying-Ying; Ying, Yin; Zheng, Sheng-Run; Zhan, Qing-Guang; Zhou, Zheng-Yuan; Chen, Li; Cai, Yue-Peng","Syntheses and conversions of dinuclear cadmium(ii) compounds containing N2O/N2O2 donor tridentate/tetradentate asymmetrical Schiff base ligands","CrystEngComm","2010","12","12","4012","","10.1039/c0ce00177e","","","0.71073","MoKα","","0.0575","0.0462","","","0.1245","0.1336","","","","","","0.99","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7212844","40.561","0.004","40.561","0.004","7.4674","0.0007","90","","90","","90","","12285","2","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C22 H30 Cd2 Cl2 N4 O5 -","- C22 H30 Cd2 Cl2 N4 O5 -","- C352 H480 Cd32 Cl32 N64 O80 -","16","1","","Fang, Hua-Cai; Ge, Ying-Ying; Ying, Yin; Zheng, Sheng-Run; Zhan, Qing-Guang; Zhou, Zheng-Yuan; Chen, Li; Cai, Yue-Peng","Syntheses and conversions of dinuclear cadmium(ii) compounds containing N2O/N2O2 donor tridentate/tetradentate asymmetrical Schiff base ligands","CrystEngComm","2010","12","12","4012","","10.1039/c0ce00177e","","","0.71073","MoKα","","0.0572","0.046","","","0.1236","0.1327","","","","","","0.984","","","","has coordinates","180459","2020-10-21","18:00:00",""
"7212896","50.411","0.0007","50.411","0.0007","48.082","0.0006","90","","90","","90","","122189","3","100","2","100","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C288 H342.38 Cu3 N24 Na20 O159.26 S16 -","- C287 H204 Cu3 N24 Na20 O106 S16 -","- C2296 H1632 Cu24 N192 Na160 O848 S128 -","8","0.5","","De Zorzi, Rita; Guidolin, Nicol; Randaccio, Lucio; Geremia, Silvano","A bifunctionalized porous material containing discrete assemblies of copper-porphyrins and calixarenes metallated by ion diffusion","CrystEngComm","2010","12","12","4056","","10.1039/c0ce00440e","","","1","","","0.1242","0.1023","","","0.2637","0.2839","","","","","","1.053","","","","has coordinates,has disorder","290444","2024-03-12","09:55:30",""
"7212897","49.63","0.0007","49.63","0.0007","49.49","0.0006","90","","90","","90","","121901","3","100","2","100","2","","","","","","","","9","I 41/a :2","-I 4ad","88","","","","- C288 H266 Cl4 Cu3 N24 Na16 O169 S16 Zn4 -","- C288 H204 Cl4 Cu3 N24 Na16 O118.2 S16 Zn4 -","- C2304 H1632 Cl32 Cu24 N192 Na128 O945.6 S128 Zn32 -","8","0.5","","De Zorzi, Rita; Guidolin, Nicol; Randaccio, Lucio; Geremia, Silvano","A bifunctionalized porous material containing discrete assemblies of copper-porphyrins and calixarenes metallated by ion diffusion","CrystEngComm","2010","12","12","4056","","10.1039/c0ce00440e","","","1","","","0.1137","0.0867","","","0.2337","0.2625","","","","","","0.985","","","","has coordinates,has disorder","290444","2024-03-12","09:55:30",""
"7212898","50.17","0.004","50.17","0.004","49.46","0.002","90","","90","","90","","124492","15","293","2","293","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C280 H418.26 Cu3 N24 Na12.8 Ni3.6 O201.12 S16 -","- C280 H204 Cu3 N24 Na12.8 Ni3.6 O110 S16 -","- C2240 H1632 Cu24 N192 Na102.4 Ni28.8 O880 S128 -","8","0.5","","De Zorzi, Rita; Guidolin, Nicol; Randaccio, Lucio; Geremia, Silvano","A bifunctionalized porous material containing discrete assemblies of copper-porphyrins and calixarenes metallated by ion diffusion","CrystEngComm","2010","12","12","4056","","10.1039/c0ce00440e","","","1","","","0.1523","0.1287","","","0.3237","0.353","","","","","","1.296","","","","has coordinates","290444","2024-03-12","09:55:30",""
"7213467","25.166","0.008","25.166","0.008","9.246","0.007","90","","90","","90","","5856","5","93.2","","93.2","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C16 H18 N2 S2 -","- C16 H18 N2 S2 -","- C256 H288 N32 S32 -","16","1","","Moriguchi, Tetsuji; Sakata, Kazunori; Tsuge, Akihiko","Intra- and intermolecular interactions in substituted dithia[3.3]metacyclophanes","Journal of the Chemical Society, Perkin Transactions 2","2001","","6","934","","10.1039/b100285f","","","0.7107","MoKα","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213556","28.3249","0.0019","28.3249","0.0019","21.949","0.003","90","","90","","90","","17610","3","223","2","223","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C96 H229 Cl4 Gd N64 O98 -","- C96 H96 Cl4 Gd N64 O36 -","- C384 H384 Cl16 Gd4 N256 O144 -","4","0.25","","Cheng, Xiao-Jie; Ji, Ning-Ning; Zhao, Yi; Liang, Li-Li; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Zhu, Qian-Jiang; Tao, Zhu","[CdCl4]2− anion-induced coordination of Ln3+ to cucurbit[8]uril and the formation of supramolecular self-assemblies: potential application in isolation of light lanthanides","CrystEngComm","2014","16","2","144","","10.1039/c3ce41769g","","","0.71073","MoKα","","0.125","0.0894","","","0.2683","0.2925","","","","","","1.055","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213557","28.3123","0.0019","28.3123","0.0019","21.934","0.003","90","","90","","90","","17582","3","223","2","223","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C96 H235 Cl4 N64 O101 Tb -","- C96 H96 Cl4 N64 O36 Tb -","- C384 H384 Cl16 N256 O144 Tb4 -","4","0.25","","Cheng, Xiao-Jie; Ji, Ning-Ning; Zhao, Yi; Liang, Li-Li; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Zhu, Qian-Jiang; Tao, Zhu","[CdCl4]2− anion-induced coordination of Ln3+ to cucurbit[8]uril and the formation of supramolecular self-assemblies: potential application in isolation of light lanthanides","CrystEngComm","2014","16","2","144","","10.1039/c3ce41769g","","","0.71073","MoKα","","0.1109","0.0791","","","0.2312","0.2506","","","","","","1.038","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213558","28.464","0.004","28.464","0.004","21.992","0.003","90","","90","","90","","17818","4","223","2","223","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C96 H239 Cl4 Ho N64 O103 -","- C96 H96 Cl4 Ho N64 O36 -","- C384 H384 Cl16 Ho4 N256 O144 -","4","0.25","","Cheng, Xiao-Jie; Ji, Ning-Ning; Zhao, Yi; Liang, Li-Li; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Zhu, Qian-Jiang; Tao, Zhu","[CdCl4]2− anion-induced coordination of Ln3+ to cucurbit[8]uril and the formation of supramolecular self-assemblies: potential application in isolation of light lanthanides","CrystEngComm","2014","16","2","144","","10.1039/c3ce41769g","","","0.71073","MoKα","","0.1202","0.0832","","","0.2333","0.2562","","","","","","0.992","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213559","28.44","0.003","28.44","0.003","22.01","0.005","90","","90","","90","","17802","5","223","2","223","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C96 H241 Cl4 Er N64 O104 -","- C96 H96 Cl4 Er0.9998 N64 O36 -","- C384 H384 Cl16 Er3.9992 N256 O144 -","4","0.25","","Cheng, Xiao-Jie; Ji, Ning-Ning; Zhao, Yi; Liang, Li-Li; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Zhu, Qian-Jiang; Tao, Zhu","[CdCl4]2− anion-induced coordination of Ln3+ to cucurbit[8]uril and the formation of supramolecular self-assemblies: potential application in isolation of light lanthanides","CrystEngComm","2014","16","2","144","","10.1039/c3ce41769g","","","0.71073","MoKα","","0.1363","0.0752","","","0.2098","0.2323","","","","","","0.944","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213560","28.4011","0.0018","28.4011","0.0018","21.939","0.003","90","","90","","90","","17696","3","223","2","223","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C96 H247 Cl4 N64 O107 Tm -","- C96 H96 Cl4 N64 O36 Tm -","- C384 H384 Cl16 N256 O144 Tm4 -","4","0.25","","Cheng, Xiao-Jie; Ji, Ning-Ning; Zhao, Yi; Liang, Li-Li; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Zhu, Qian-Jiang; Tao, Zhu","[CdCl4]2− anion-induced coordination of Ln3+ to cucurbit[8]uril and the formation of supramolecular self-assemblies: potential application in isolation of light lanthanides","CrystEngComm","2014","16","2","144","","10.1039/c3ce41769g","","","0.71073","MoKα","","0.148","0.088","","","0.2448","0.2711","","","","","","0.967","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213561","28.388","0.003","28.388","0.003","22.036","0.005","90","","90","","90","","17758","5","223","2","223","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C96 H237 Cl4 N64 O102 Yb -","- C96 H96 Cl4 N64 O36 Yb -","- C384 H384 Cl16 N256 O144 Yb4 -","4","0.25","","Cheng, Xiao-Jie; Ji, Ning-Ning; Zhao, Yi; Liang, Li-Li; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Zhu, Qian-Jiang; Tao, Zhu","[CdCl4]2− anion-induced coordination of Ln3+ to cucurbit[8]uril and the formation of supramolecular self-assemblies: potential application in isolation of light lanthanides","CrystEngComm","2014","16","2","144","","10.1039/c3ce41769g","","","0.71073","MoKα","","0.1579","0.0893","","","0.2612","0.2945","","","","","","0.948","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213562","28.3363","0.0019","28.3363","0.0019","21.928","0.003","90","","90","","90","","17607","3","223","2","223","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C96 H241 Cl3.5 Lu N64 O104 -","- C96 H96 Cl4 Lu N64 O36 -","- C384 H384 Cl16 Lu4 N256 O144 -","4","0.25","","Cheng, Xiao-Jie; Ji, Ning-Ning; Zhao, Yi; Liang, Li-Li; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Zhu, Qian-Jiang; Tao, Zhu","[CdCl4]2− anion-induced coordination of Ln3+ to cucurbit[8]uril and the formation of supramolecular self-assemblies: potential application in isolation of light lanthanides","CrystEngComm","2014","16","2","144","","10.1039/c3ce41769g","","","0.71073","MoKα","","0.1176","0.0775","","","0.2289","0.2475","","","","","","1.027","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213725","27.908","0.005","27.908","0.005","6.521","0.005","90","0.005","90","0.005","90","0.005","5079","4","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C28 H32 N2 O2 -","- C28 H32 N2 O2 -","- C224 H256 N16 O16 -","8","0.5","","Zhang, Ruilong; Zhang, Qiong; Liu, Zhaodi; Yang, Longmei; Wu, Jieying; Zhou, Hongping; Yang, Jiaxiang; Tian, Yupeng","Two polymorphs and cocrystal of styryl-pyridine derivatives with tuned emission induced by Co2+ and Zn(phen)32+","CrystEngComm","2014","16","10","2039","","10.1039/c3ce42069h","","","0.71069","MoKα","","0.1679","0.0749","","","0.1921","0.2462","","","","","","1.141","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213792","24.03","0.003","24.03","0.003","15.0512","0.0019","90","","90","","90","","8691.2","1.9","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C68 H72 N8 Ni4 O16 -","- C68 H72 N8 Ni4 O16 -","- C272 H288 N32 Ni16 O64 -","4","0.25","","Karmakar, Sibasree; Khanra, Sumit","Polynuclear coordination compounds: a magnetostructural study of ferromagnetically coupled Ni4O4 cubane core motif","CrystEngComm","2014","16","12","2371","","10.1039/c3ce41125g","","","0.71073","MoKα","","0.0931","0.0488","","","0.1235","0.1385","","","","","","0.936","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213926","15.2902","0.001","15.2902","0.001","13.2563","0.0007","90","","90","","90","","3099.2","0.3","120","2","120","2","","","","","","","","5","I 41/a :2","-I 4ad","88","bis(3,4-diaminopyridinium)_sulfate_dihydrate","","","- C10 H20 N6 O6 S -","- C10 H20 N6 O6 S -","- C80 H160 N48 O48 S8 -","8","0.5","","Hursthouse, Michael B.; Montis, Riccardo; Niitsoo, Liisa; Sarson, Jonathan; Threlfall, Terence L.; Asiri, Abdullah Mohamed; Khan, Salman Ahmad; Obaid, Abdullah Yousef; Al-Harbi, Laila Mohammad","Anhydrates and/or hydrates in nitrate, sulphate and phosphate salts of 4-aminopyridine, (4-AP) and 3,4-diaminopyridine (3,4-DAP): the role of the water molecules in the hydrates","CrystEngComm","2014","16","11","2205","","10.1039/c3ce42471e","","","0.71073","MoKα","","0.1177","0.0622","","","0.154","0.1768","","","","","","1.024","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213937","28.369","0.004","28.369","0.004","14.436","0.003","90","","90","","90","","11618","3","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C80 H66 As8 Cu4 N16 O43 V14 -","- C80 H64 As8 Cu4 N16 O43 V14 -","- C320 H256 As32 Cu16 N64 O172 V56 -","4","0.25","","Guo, Hai-Yang; Li, Zhi-Fang; Zhao, De-Chuan; Hu, Yang-Yang; Xiao, Li-Na; Cui, Xiao-Bing; Guan, Jing-Qi; Xu, Ji-Qing","The synthesis and characterization of three organic‒inorganic hybrids based on different transition metal complexes and {As8V14O42(H2O)} clusters","CrystEngComm","2014","16","11","2251","","10.1039/c3ce42450b","","","0.71073","MoKα","","0.1513","0.0654","","","0.1817","0.2244","","","","","","1.004","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213939","15.118","0.002","15.118","0.002","38.962","0.008","90","","90","","90","","8905","2","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C36 H50 As8 N24 Ni2 O49 V14 -","- C36 H36 As8 N24 Ni2 O49 V14 -","- C144 H144 As32 N96 Ni8 O196 V56 -","4","0.25","","Guo, Hai-Yang; Li, Zhi-Fang; Zhao, De-Chuan; Hu, Yang-Yang; Xiao, Li-Na; Cui, Xiao-Bing; Guan, Jing-Qi; Xu, Ji-Qing","The synthesis and characterization of three organic‒inorganic hybrids based on different transition metal complexes and {As8V14O42(H2O)} clusters","CrystEngComm","2014","16","11","2251","","10.1039/c3ce42450b","","","0.71073","MoKα","","0.0516","0.0379","","","0.1029","0.1084","","","","","","1.036","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7214156","25.087","0.004","25.087","0.004","15.026","0.003","90","","90","","90","","9457","3","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H15 Co2 N3 O9 S -","- C16 H10 Co2 N3 O8 S -","- C256 H160 Co32 N48 O128 S16 -","16","1","","Huang, Chao; Ji, Feixiang; Liu, Lu; Li, Na; Li, Haofei; Wu, Jie; Hou, Hongwei; Fan, Yaoting","Seven dicarboxylate-based coordination polymers with structural varieties and different solvent resistance properties derived from the introduction of small organic linkers","CrystEngComm","2014","16","13","2615","","10.1039/c3ce42366b","","","0.71073","MoKα","","0.0468","0.041","","","0.1055","0.1095","","","","","","1.119","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214157","25.37","0.01","25.37","0.01","15.204","0.003","90","","90","","90","","9786","6","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H16 Co2 N4 O9 S -","- C16 H11 Co2 N4 O8 S -","- C256 H176 Co32 N64 O128 S16 -","16","1","","Huang, Chao; Ji, Feixiang; Liu, Lu; Li, Na; Li, Haofei; Wu, Jie; Hou, Hongwei; Fan, Yaoting","Seven dicarboxylate-based coordination polymers with structural varieties and different solvent resistance properties derived from the introduction of small organic linkers","CrystEngComm","2014","16","13","2615","","10.1039/c3ce42366b","","","0.71073","MoKα","","0.1506","0.1078","","","0.2408","0.2701","","","","","","1.149","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214160","24.344","0.003","24.344","0.003","15.067","0.003","90","","90","","90","","8929","2","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H15 Cu2 N3 O9 S -","- C16 H10 Cu2 N3 O8 S -","- C256 H160 Cu32 N48 O128 S16 -","16","1","","Huang, Chao; Ji, Feixiang; Liu, Lu; Li, Na; Li, Haofei; Wu, Jie; Hou, Hongwei; Fan, Yaoting","Seven dicarboxylate-based coordination polymers with structural varieties and different solvent resistance properties derived from the introduction of small organic linkers","CrystEngComm","2014","16","13","2615","","10.1039/c3ce42366b","","","0.71073","MoKα","","0.0814","0.0722","","","0.1833","0.1913","","","","","","1.039","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214220","13.5402","0.0004","13.5402","0.0004","17.444","0.0009","90","","90","","90","","3198.1","0.2","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C5 H8 Mn O5 -","- C5 H8 Mn O5 -","- C80 H128 Mn16 O80 -","16","1","","Déniz, Mariadel; Hernández-Rodríguez, Irene; Pasán, Jorge; Fabelo, Oscar; Cañadillas-Delgado, Laura; Vallejo, Julia; Julve, Miguel; Lloret, Francesc; Ruiz-Pérez, Catalina","Syntheses, crystal structures and magnetic properties of five new manganese(ii) complexes: influence of the conformation of different alkyl/aryl substituted malonate ligands on the crystal packing","CrystEngComm","2014","16","13","2766","","10.1039/c3ce42086h","","x-ray","1.54184","CuKα","","0.0271","0.0255","","","0.0658","0.067","","","","","","1.083","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214406","18.884","0.0017","18.884","0.0017","22.448","0.003","90","","90","","90","","8005.1","1.5","298","2","298","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C56 H72 Cl6 Er4 N8 O44 Zn -","- C56 H64 Cl6 Er4 N8 O44 Zn -","- C224 H256 Cl24 Er16 N32 O176 Zn4 -","4","0.25","","Li, Teng; Hong, Xu-Jia; Liu, Xiang; Chen, Rong; Zhan, Qing-Guang; Xu, Xuan; Cai, Yue-Peng","Construction of three pH-dependent luminescent metal‒organic frameworks with 3-(4-carboxyphen-yl)-1,3-benzoimidazole","CrystEngComm","2014","16","19","3883","","10.1039/c4ce00125g","","","0.71073","MoKα","","0.1133","0.0613","","","0.1418","0.169","","","","","","1.138","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214830","27.539","0.0009","27.539","0.0009","13.4753","0.0008","90","","90","","90","","10219.6","0.8","273","2","273","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C70 H112 Cl2 Cu8 N22 O28 S6 -","- C69.996 H112 Cl2 Cu8 N21.996 O28 S5.996 -","- C279.984 H448 Cl8 Cu32 N87.984 O112 S23.984 -","4","0.25","","Ding, Cai-Xia; Ni, Jia; Yang, Yu-Hua; Ng, Seik-Weng; Wang, Bing-Wu; Xie, Yong-Shu","Mono-, Tetra- and octanuclear transition metal complexes of in situ generated schiff base ligands containing up to 12 coordinating atoms: syntheses, structures and magnetism","CrystEngComm","2012","14","21","7312","","10.1039/c2ce25966d","","","0.71073","MoKα","","0.0934","0.079","","","0.2194","0.2401","","","","","","1.029","","","","has coordinates,has disorder","180479","2020-10-21","18:00:00",""
"7216702","22.267","0.003","22.267","0.003","23.162","0.003","90","","90","","90","","11484","3","298","2","298","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C40 H48 Cu4 I4 N16 O10 -","- C40 H48 Cu4 I4 N16 O10 -","- C320 H384 Cu32 I32 N128 O80 -","8","0.5","","Hong, Xu-Jia; Liu, Xiang; Zhang, Jing-Bo; Lin, Chu-Ling; Wu, Xiao; Ou, Yan-Jun; Yang, Jian; Jin, Hong-Guang; Cai, Yue-Peng","Two low-dimensional Schiff base copper(i/ii) complexes: synthesis, characterization and catalytic activity for degradation of organic dyes","CrystEngComm","2014","16","34","7926","","10.1039/C4CE01207K","","","0.71073","MoKα","","0.1293","0.0591","","","0.1323","0.1712","","","","","","1.012","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7217176","22.0734","0.001","22.0734","0.001","16.1233","0.0014","90","","90","","90","","7855.8","0.8","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H9 Cd Cl N3 O4 -","- C16 H9 Cd Cl N3 O4 -","- C256 H144 Cd16 Cl16 N48 O64 -","16","1","","Yue, Zhifang; Chen, Zhenna; Yao, Minjie; Wang, Haili; Li, Gang","Selective pyridine recognition by a imidazole dicarboxylate-based 3D cadmium(II) MOF","RSC Advances","2014","","","","","10.1039/C4RA04803B","","","0.71073","MoKα","","0.0563","0.0467","","","0.1275","0.1349","","","","","","1.111","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217613","39.118","0.003","39.118","0.003","12.8349","0.0011","90","","90","","90","","19640","3","296","2","296","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C49 H46 Cu F6 Fe N4 P -","- C49 H46 Cu F6 Fe N4 P -","- C784 H736 Cu16 F96 Fe16 N64 P16 -","16","1","","Crowley, James D.; Scottwell, Synove O.; McAdam, C. John; Shaffer, Karl J.","5-Ferrocenyl-2,2 -bipyridine Ligands: synthesis, palladium(II) and copper(I) complexes, optical and electrochemical properties.","RSC Advances","2014","","","","","10.1039/C4RA05333H","","","0.71073","MoKα","","0.0712","0.0552","","","0.1278","0.1331","","","","","","1.141","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7218670","9.733","0.004","9.733","0.004","74.51","0.02","90","","90","","90","","7058","5","333","2","333","2","","","","","","","","6","I 41/a :2","-I 4ad","88","bis(ethylenedithio)tetrathiafulvalenium_tetrabromomanganate(II)_dichlorobenzene_(4/1/1)","","","- C46 H36 Br4 Cl2 Mn S32 -","- C46 H36 Br4 Cl2 Mn S32 -","- C184 H144 Br16 Cl8 Mn4 S128 -","4","0.25","","Zhilyaeva, Elena I.; Shilov, Gennadii V.; Torunova, Svetlana A.; Flakina, Alexandra M.; Lyubovskii, Rustem B.; Pesotskii, Sergey I.; Aldoshin, Sergey M.; Lyubovskaya, Rimma N.","Phase transitions in θ-(ET)4MnBr4(C6H6−nCln) (n = 1, 2) driven by ordering in anion and/or cation layers","CrystEngComm","2014","16","43","10103","","10.1039/C4CE01440E","","","0.71073","MoKα","","0.2577","0.0474","","","0.0767","0.0875","","","","","","0.935","","","","has coordinates,has disorder","288536","2023-12-24","00:28:32",""
"7218672","9.6621","0.0002","9.6621","0.0002","74.3763","0.0015","90","","90","","90","","6943.5","0.2","260","2","260","2","","","","","","","","6","I 41/a :2","-I 4ad","88","bis(ethylenedithio)tetrathiafulvalenium_tetrabromomanganate(II)_chlorobenzene_(4/1/1)","","","- C46 H37 Br4 Cl Mn S32 -","- C46 H37 Br4 Cl Mn S32 -","- C184 H148 Br16 Cl4 Mn4 S128 -","4","0.25","","Zhilyaeva, Elena I.; Shilov, Gennadii V.; Torunova, Svetlana A.; Flakina, Alexandra M.; Lyubovskii, Rustem B.; Pesotskii, Sergey I.; Aldoshin, Sergey M.; Lyubovskaya, Rimma N.","Phase transitions in θ-(ET)4MnBr4(C6H6−nCln) (n = 1, 2) driven by ordering in anion and/or cation layers","CrystEngComm","2014","16","43","10103","","10.1039/C4CE01440E","","","0.71073","MoKα","","0.0769","0.0497","","","0.1294","0.1581","","","","","","0.925","","","","has coordinates,has disorder","288536","2023-12-24","00:28:33",""
"7218877","19.88","0.003","19.88","0.004","13.146","0.0015","90","","90","","90","","5195.5","1.4","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","Octachloroporphyrin","2,3,7,8,12,13,17,18-Octachloro-5,10,15,20-tetraphenylporphyrin","","- C48 H30 Cl8 N6 O2 -","- C48 H30 Cl8 N6 O2 -","- C192 H120 Cl32 N24 O8 -","4","0.25","","Chaudhri, Nivedita; Sankar, Muniappan","Colorimetric “Naked eye” detection of CN-, F-, CH3COO- and H2PO4- ions by highly nonplanar electron deficient perhaloporphyrins","RSC Adv.","2014","","","","","10.1039/C4RA11368C","","","0.71073","MoKα","","0.1281","0.1132","","","0.3293","0.3457","","","","","","1.179","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7219001","28.1859","0.0001","28.1859","0.0001","23.7177","0.0002","90","","90","","90","","18842.4","0.18","119.8","0.5","119.8","0.5","","","","","","","","8","I 41/a :2","-I 4ad","88","","(η^5^-cyclopentadienyl)-bis[4-(tetrahydro-1,4-oxazino)methyl]phosphine- bis(triphenylphosphine)-ruthenium(II) tetrafluoroborate","","- C51 H56 B F4 N2 O2 P3 Ru -","- C51 H56 B F4 N2 O2 P3 Ru -","- C816 H896 B16 F64 N32 O32 P48 Ru16 -","16","1","","Płotek, Michał; Starosta, Radosław; Komarnicka, Urszula K.; Skórska-Stania, Agnieszka; Stochel, Grazyna; Kyzioł, Agnieszka; Jezowska-Bojczuk, Malgorzata","Unexpected formation of [Ru(η5-C5H5)(PH{CH2N(CH2CH2)2O}2)(PPh3)2]BF4 - the first „piano-stool” ruthenium complex bearing secondary aminomethylphosphane ligand","RSC Adv.","2014","","","","","10.1039/C4RA13037E","","","0.71073","MoKα","","0.0374","0.0287","","","0.067","0.0726","","","","","","1.06","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7219207","10.2918","0.0001","10.2918","0.0001","33.1588","0.0008","90","","90","","90","","3512.22","0.1","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C25 H24 Co2 N16 O4 -","- C25 H24 Co2 N16 O4 -","- C100 H96 Co8 N64 O16 -","4","0.25","","Yu, Fan; Xiang, Mi; Li, Ai-hua; Zhang, Yu-min; Li, Bao","Structural diversities and magnetic properties of azide-containing coordination polymers based on flexible tetra-pyridinate ligands","CrystEngComm","2015","17","7","1556","","10.1039/C4CE02252A","","","1.54178","CuKα","","0.0607","0.0469","","","0.1651","0.1758","","","","","","1.104","","","","has coordinates","180523","2020-10-21","18:00:00",""
"7219229","5.244797","0.00003","5.244797","","11.3813","0.00013","90","","90","","90","","313.076","0.004","298","","298","","","","","","","","Scheelite","3","I 41/a :2","-I 4ad","88","Calcium tungstate","","","- Ca O4 W -","- Ca O4 W -","- Ca4 O16 W4 -","4","0.25","","Gonçalves, R. F.; Cavalcante, L. S.; Nogueira, I. C.; Longo, E.; Godinho, M. J.; Sczancoski, J. C.; Mastelaro, V. R.; Pinatti, I. M.; Rosa, I. L. V.; Marques, A. P. A.","Rietveld refinement, cluster modelling, growth mechanism and photoluminescence properties of CaWO4:Eu3+microcrystals","CrystEngComm","2015","17","7","1654","","10.1039/C4CE02279C","powder diffraction","x-ray","1.5405","CuKα","","0.05","0.0342","","","0.0666","","0.02583","","1.95","","","1.95","","","","has coordinates","264550","2021-04-26","17:55:41",""
"7219230","5.24701","0.00005","5.24701","","11.3846","0.00018","90","","90","","90","","313.431","0.006","298","","298","","","","","","","","Scheelite","4","I 41/a :2","-I 4ad","88","Calcium europium tungstate","","","- Ca0.99 Eu0.01 O4 W -","- Ca0.98967 Eu0.01059 O4 W -","- Ca3.95868 Eu0.04236 O16 W4 -","4","0.25","","Gonçalves, R. F.; Cavalcante, L. S.; Nogueira, I. C.; Longo, E.; Godinho, M. J.; Sczancoski, J. C.; Mastelaro, V. R.; Pinatti, I. M.; Rosa, I. L. V.; Marques, A. P. A.","Rietveld refinement, cluster modelling, growth mechanism and photoluminescence properties of CaWO4:Eu3+microcrystals","CrystEngComm","2015","17","7","1654","","10.1039/C4CE02279C","powder diffraction","x-ray","1.5405","CuKα","","0.0548","0.0326","","","0.0729","","0.04681","","2.24","","","2.24","","","","has coordinates","264550","2021-04-26","17:55:41",""
"7219231","5.24643","0.00006","5.24643","","11.38357","0.00021","90","","90","","90","","313.333","0.007","298","","298","","","","","","","","Scheelite","4","I 41/a :2","-I 4ad","88","Calcium europium tungstate","","","- Ca0.98 Eu0.02 O4 W -","- Ca0.9804 Eu0.0196 O4 W -","- Ca3.9216 Eu0.0784 O16 W4 -","4","0.25","","Gonçalves, R. F.; Cavalcante, L. S.; Nogueira, I. C.; Longo, E.; Godinho, M. J.; Sczancoski, J. C.; Mastelaro, V. R.; Pinatti, I. M.; Rosa, I. L. V.; Marques, A. P. A.","Rietveld refinement, cluster modelling, growth mechanism and photoluminescence properties of CaWO4:Eu3+microcrystals","CrystEngComm","2015","17","7","1654","","10.1039/C4CE02279C","powder diffraction","x-ray","1.5405","CuKα","","0.0591","0.0342","","","0.0799","","0.02956","","2.34","","","2.34","","","","has coordinates","264550","2021-04-26","17:55:41",""
"7219232","5.24682","0.00004","5.24682","","11.38143","0.00016","90","","90","","90","","313.321","0.005","298","","298","","","","","","","","Scheelite","4","I 41/a :2","-I 4ad","88","Calcium europium tungstate","","","- Ca0.96 Eu0.04 O4 W -","- Ca0.96289 Eu0.03711 O4 W -","- Ca3.85156 Eu0.14844 O16 W4 -","4","0.25","","Gonçalves, R. F.; Cavalcante, L. S.; Nogueira, I. C.; Longo, E.; Godinho, M. J.; Sczancoski, J. C.; Mastelaro, V. R.; Pinatti, I. M.; Rosa, I. L. V.; Marques, A. P. A.","Rietveld refinement, cluster modelling, growth mechanism and photoluminescence properties of CaWO4:Eu3+microcrystals","CrystEngComm","2015","17","7","1654","","10.1039/C4CE02279C","powder diffraction","x-ray","1.5405","CuKα","","0.0472","0.0322","","","0.0633","","0.0235","","1.97","","","1.97","","","","has coordinates","264550","2021-04-26","17:55:41",""
"7219823","16.939","0.0002","16.939","0.0002","33.5981","0.0006","90","","90","","90","","9640.3","0.2","100","1","100","1","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C20 H28 Cl N3 O7 Zn -","- C20 H28 Cl N3 O7 Zn -","- C320 H448 Cl16 N48 O112 Zn16 -","16","1","","Rodpun, Kiattipoom; Blackman, Allan G.; Gardiner, Michael G.; Tan, Eng Wui; Meledandri, Carla J.; Lucas, Nigel T.","Alkyl linker effects on the coordination topology of ditopic di(2-pyridylmethyl)amine carboxylate ligands with ZnIIand CuII: polymers vs. macrocycles","CrystEngComm","2015","17","15","2974","","10.1039/C5CE00375J","","","1.54184","CuKα","","0.0933","0.0863","","","0.2584","0.2686","","","","","","1.069","","","","has coordinates,has disorder","180529","2020-10-21","18:00:00",""
"7219842","28.2519","0.0003","28.2519","0.0003","12.3144","0.0003","90","","90","","90","","9829","0.3","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C26 H16 Cd3 N2 O12 -","- C26 H16 Cd3 N2 O12 -","- C416 H256 Cd48 N32 O192 -","16","1","","Yang, Li-Zi; Fang, Ran; Dou, Wei; Kirillov, Alexander M.; Xu, Cai-ling; Liu, Wei-Sheng","Structural diversity in new coordination polymers modulated by semirigid ether-linked pyridine-phthalate building block and ancillary ligands: syntheses, structures, and luminescence properties","CrystEngComm","2015","17","16","3117","","10.1039/C5CE00341E","","","1.54184","CuKα","","0.0519","0.0388","","","0.0878","0.0955","","","","","","1.048","","","","has coordinates","180529","2020-10-21","18:00:00",""
"7220188","19.0353","0.0006","19.0353","0.0006","15.4705","0.0007","90","","90","","90","","5605.6","0.4","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C36 H48 Cl4 Cu4 N12 O32 -","- C36 H48 Cl4 Cu4 N12 O32 -","- C144 H192 Cl16 Cu16 N48 O128 -","4","0.25","","Chattopadhyay, Shouvik; Das, Mithun; shaw, Bikash kumar; saha, Shyamal Kumar; Ghosh, Biswa Nath; Rissanen, Kari","Unusual magnetic response in π-stacked 66-dia net structure of [4+2] copper(II) cubane","RSC Adv.","2015","","","","","10.1039/C5RA07548C","","","0.71073","MoKα","","0.0681","0.0502","","","0.1274","0.1446","","","","","","1.053","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7220480","19.6845","0.0003","19.6845","0.0003","19.3124","0.0003","90","","90","","90","","7483.2","0.2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C17 H11 F6 N3 O5 -","- C17 H11 F6 N3 O5 -","- C272 H176 F96 N48 O80 -","16","1","","Bedekar, Ashutosh; Jain, Nilesh; Patel, Ravi","Modified Kagan’s Amide: Synthesis and Applications as Chiral Solvating Agent for Hydrogen-Bonding Based Chiral Discrimination in NMR","RSC Adv.","2015","","","","","10.1039/C5RA06959A","","","1.54184","CuKα","","0.0638","0.0546","","","0.1435","0.1495","","","","","","1.026","","","","has coordinates","136654","2020-10-21","18:00:00",""
"7220566","18.6107","0.0005","18.6107","0.0005","4.8022","0.0003","90","","90","","90","","1663.28","0.12","150","2","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C8 H20 Cu2 O16 -","- C8 H20 Cu2 O16 -","- C32 H80 Cu8 O64 -","4","0.25","","Díaz-Gallifa, P.; Fabelo, O.; Pasán, J.; Cañadillas-Delgado, L.; Ramírez, M. A.; Gallardo, A. G.; Ruiz-Pérez, C.","Synthesis and structural characterization of six Cu(ii)-based coordination polymers using the thermally tunable 1,2,3,4-cyclobutanetetracarboxylic acid","CrystEngComm","2015","17","27","5081","","10.1039/C5CE00326A","","","1.5418","CuKα","","0.0314","0.0299","","","0.0788","0.0805","","","","","","1.083","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7220734","13.77","0.002","13.77","0.002","59.621","0.009","90","","90","","90","","11305","3","296","2","296","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C21 H19 K N4 O12 Pb S2 -","- C21 H13 K N4 O12 Pb S2 -","- C336 H208 K16 N64 O192 Pb16 S32 -","16","1","","Zhang, Li; Zheng, Jia-Dan; Chen, Yi-Ting; Zheng, Sheng-Run; Fan, Jun; Zhang, Wei-Guang","Syntheses, structures, and properties of nine d10or p-block coordination polymers based on a ligand containing both terpyridyl and sulfo groups","CrystEngComm","2015","17","29","5538","","10.1039/C5CE00767D","","","0.71073","MoKα","","0.1494","0.0801","","","0.2108","0.2468","","","","","","1.044","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7220785","21.5654","0.0011","21.5654","0.0011","13.0149","0.0008","90","","90","","90","","6052.8","0.6","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C26 H28 Mn N4 O6 V2 -","- C26 H28 Mn N4 O6 V2 -","- C208 H224 Mn8 N32 O48 V16 -","8","0.5","","Li, Xiao; Yang, Liu; Qin, Chao; Liu, Fu-Hong; Zhao, Liang; Shao, Kui-Zhan; Su, Zhong-Min","POM-based inorganic-organic hybrid compounds: synthesis, structures, high-connected topologies and photodegradation of Organic dyes","RSC Adv.","2015","","","","","10.1039/C5RA09339B","","","0.71073","MoKα","","0.0551","0.0393","","","0.1089","0.1173","","","","","","1.061","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7220849","18.225","0.009","18.225","0.009","9.896","0.005","90","","90","","90","","3287","3","150","2","150","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C22 H18 N2 -","- C22 H18 N2 -","- C176 H144 N16 -","8","0.5","","Garg, K.; Ganapathi, E.; Rajakannu, P.; Ravikanth, M.","Stereochemical modulation of emission behaviour in E/Z isomers of diphenyldipyrroethene from aggregation induced emission to crystallization induced emission.","Physical chemistry chemical physics : PCCP","2015","17","29","19465","19473","10.1039/c5cp02400e","","","0.71075","MoKα","","0.102","0.1","","","0.1948","0.1958","","","","","","1.338","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7220851","5.29961","0.00011","5.29961","0.00011","11.70466","0.0003","90","","90","","90","","328.736","0.013","300","","300","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- Ca Ho0.05 La1.5 Mo4 O16 Yb0.45 -","- Ca Ho0.05 La1.5 Mo4 O16 Yb0.45 -","- Ca Ho0.05 La1.5 Mo4 O16 Yb0.45 -","1","0.0625","","Lim, Chang Sung; Aleksandrovsky, Aleksandr; Molokeev, Maxim; Oreshonkov, Aleksandr; Atuchin, Victor","The modulated structure and frequency upconversion properties of CaLa2(MoO4)4:Ho(3+)/Yb(3+) phosphors prepared by microwave synthesis.","Physical chemistry chemical physics : PCCP","2015","17","29","19278","19287","10.1039/c5cp03054d","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","2.26","1.652","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"7220852","5.30206","0.00013","5.30206","0.00013","11.71178","0.00037","90","","90","","90","","329.24","0.015","300","","300","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- Ca Ho0.05 La1.55 Mo4 O16 Yb0.4 -","- Ca Ho0.05 La1.55 Mo4 O16 Yb0.4 -","- Ca Ho0.05 La1.55 Mo4 O16 Yb0.4 -","1","0.0625","","Lim, Chang Sung; Aleksandrovsky, Aleksandr; Molokeev, Maxim; Oreshonkov, Aleksandr; Atuchin, Victor","The modulated structure and frequency upconversion properties of CaLa2(MoO4)4:Ho(3+)/Yb(3+) phosphors prepared by microwave synthesis.","Physical chemistry chemical physics : PCCP","2015","17","29","19278","19287","10.1039/c5cp03054d","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","2.55","1.716","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"7220853","5.29843","0.00013","5.29843","0.00013","11.71297","0.00037","90","","90","","90","","328.822","0.015","300","","300","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- Ca Ho0.05 La1.45 Mo4 O16 Yb0.5 -","- Ca Ho0.05 La1.45 Mo4 O16 Yb0.5 -","- Ca Ho0.05 La1.45 Mo4 O16 Yb0.5 -","1","0.0625","","Lim, Chang Sung; Aleksandrovsky, Aleksandr; Molokeev, Maxim; Oreshonkov, Aleksandr; Atuchin, Victor","The modulated structure and frequency upconversion properties of CaLa2(MoO4)4:Ho(3+)/Yb(3+) phosphors prepared by microwave synthesis.","Physical chemistry chemical physics : PCCP","2015","17","29","19278","19287","10.1039/c5cp03054d","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.65","1.607","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"7220854","5.33701","0.00026","5.33701","0.00026","11.82903","0.00062","90","","90","","90","","336.93","0.03","300","","300","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Ca La2 Mo4 O16 -","- Ca La2 Mo4 O16 -","- Ca La2 Mo4 O16 -","1","0.0625","","Lim, Chang Sung; Aleksandrovsky, Aleksandr; Molokeev, Maxim; Oreshonkov, Aleksandr; Atuchin, Victor","The modulated structure and frequency upconversion properties of CaLa2(MoO4)4:Ho(3+)/Yb(3+) phosphors prepared by microwave synthesis.","Physical chemistry chemical physics : PCCP","2015","17","29","19278","19287","10.1039/c5cp03054d","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","3.6","1.737","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"7220855","5.303003","0.000089","5.303003","0.000089","11.71619","0.00024","90","","90","","90","","329.481","0.01","300","","300","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- Ca Ho0.05 La1.6 Mo4 O16 Yb0.35 -","- Ca Ho0.05 La1.6 Mo4 O16 Yb0.35 -","- Ca Ho0.05 La1.6 Mo4 O16 Yb0.35 -","1","0.0625","","Lim, Chang Sung; Aleksandrovsky, Aleksandr; Molokeev, Maxim; Oreshonkov, Aleksandr; Atuchin, Victor","The modulated structure and frequency upconversion properties of CaLa2(MoO4)4:Ho(3+)/Yb(3+) phosphors prepared by microwave synthesis.","Physical chemistry chemical physics : PCCP","2015","17","29","19278","19287","10.1039/c5cp03054d","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","2.6","1.509","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"7221598","29.16","0.004","29.16","0.004","8.7046","0.0016","90","","90","","90","","7402","2","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C19 H22 N2 O3 S -","- C19 H22 N2 O3 S -","- C304 H352 N32 O48 S16 -","16","1","","Nandi, Ganesh C.; Kota, Sudhakar R.; Wakchaure, Prasad B.; Chinthakindi, Praveen K.; Govender, Thavendran; Kruger, Hendrick G.; Naicker, Tricia; Arvidsson, Per I.","Pd-catalyzed C‒N coupling of vinylbromides and sulfonimidamides: a facile synthesis of N′-vinylsulfonimidamides","RSC Adv.","2015","5","76","62084","","10.1039/C5RA10939F","","x-ray","0.71073","MoKα","","0.057","0.0478","","","0.1251","0.1324","","","","","","1.085","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7221683","38.2977","0.0005","38.2977","0.0005","22.9827","0.0004","90","","90","","90","","33709","0.9","110","","110","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C29 H38 N4 O17 -","- C29 H28 N4 O12 -","- C1160 H1120 N160 O480 -","40","2.5","","Mouchaham, Georges; Gualino, Marion; Roques, Nans; Duhayon, Carine; Brandès, Stéphane; Sutter, Jean-Pascal","Supramolecular open-framework architectures based on dicarboxylate H-bond acceptors and polytopic cations with three/four N‒H+donor units","CrystEngComm","2015","17","46","8906","","10.1039/C5CE01070E","","","1.5418","CuKα","","0.0803","0.0743","","0.0838","0.0811","0.0803","","","","","","1.0691","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7222627","6.4926","","6.4926","","13.22","","90","","90","","90","","557.274","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","N H4 (F (H F)4)1","","- F5 H8 N -","- F5 H8 N -","- F20 H32 N4 -","4","0.25","","Mootz, D.; Poll, W.","Fluoride und Fluorosaeuren, VI. Verbindungsbildung und Kristallstrukturen im System Ammoniak-Fluorwasserstoff","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986)","1984","39","","290","297","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222964","19.692","0.009","19.692","0.009","20.101","0.02","90","","90","","90","","7795","9","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C26 H40 Mn2 N14 O7 -","- C26 H40 Mn2 N14 O7 -","- C208 H320 Mn16 N112 O56 -","8","0.5","","xu, zhouqing; Li, Huijun; Wang, Yuan; Cai, Hongxin; Jia, Lei; Hou, Hongwei","Construction of Fe6, Fe8 and Mn8 Metallamacrocyclic Complexes and Magnetic Properties","RSC Adv.","2015","","","","","10.1039/C5RA18219K","","","0.71073","MoKα","","0.1266","0.0589","","","0.1232","0.1517","","","","","","0.994","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7222966","19.623","0.003","19.623","0.003","19.147","0.004","90","","90","","90","","7373","2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C9 H12 Fe N7 O3 -","- C9 H12 Fe N7 O3 -","- C144 H192 Fe16 N112 O48 -","16","1","","xu, zhouqing; Li, Huijun; Wang, Yuan; Cai, Hongxin; Jia, Lei; Hou, Hongwei","Construction of Fe6, Fe8 and Mn8 Metallamacrocyclic Complexes and Magnetic Properties","RSC Adv.","2015","","","","","10.1039/C5RA18219K","","","0.71073","MoKα","","0.0718","0.0591","","","0.1626","0.174","","","","","","1.019","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7223225","14.3031","0.0005","14.3031","0.0005","16.4279","0.0015","90","","90","","90","","3360.8","0.3","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C14 H6 Cd K2 N2 O8 -","- C14 H6 Cd K2 N2 O8 -","- C112 H48 Cd8 K16 N16 O64 -","8","0.5","","Zhou, Zhong-Yuan; Li, Qipeng; Han, Yun-Hu; Xing, Xiu-Shuang; Du, Shaowu","A highly connected (5,5,18)-c trinodal MOF with a 3D diamondoid inorganic connectivity: Tunable luminescence and white-light emission","RSC Adv.","2015","","","","","10.1039/C5RA20142J","","","0.71073","MoKα","","0.0599","0.0458","","","0.1457","0.1676","","","","","","1.143","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7223309","13.9941","0.0009","13.9941","0.0009","35.739","0.003","90","","90","","90","","6998.9","0.9","180","2","180","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C60 H60 N30 Na O16 Zn4 -","- C60 H56 N30 O16 Zn4 -","- C240 H224 N120 O64 Zn16 -","4","0.25","","Mahmoudi, Ghodrat; Bauzá, Antonio; Rodríguez-Diéguez, Antonio; Garczarek, Piotr; Kaminsky, Werner; Frontera, Antonio","Synthesis, X-ray characterization, DFT calculations and Hirshfeld surface analysis studies of carbohydrazone based on Zn(ii) complexes","CrystEngComm","2016","18","1","102","","10.1039/C5CE01915J","","","0.71073","MoKα","","0.0723","0.0483","","","0.1263","0.1356","","","","","","0.997","","","","has coordinates","175975","2020-10-21","18:00:00",""
"7225914","20.6551","0.0005","20.6551","0.0005","15.9903","0.0008","90","","90","","90","","6822","0.4","296","","296","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C21 H15 Cl N2 -","- C21 H15 Cl N2 -","- C336 H240 Cl16 N32 -","16","1","","Xue, Shuwen; Liu, Jiaming; Qing, Xushun; Wang, Cunde","Brönsted acid-mediated Annulations of 1-Cyanocyclopropane-1-carboxylates with Arylhydrazines: Efficient Strategy for Synthesis of 1,3,5-Trisubstituted Pyrazoles","RSC Adv.","2016","","","","","10.1039/C6RA14557D","","","0.71073","MoKα","","0.0477","0.0383","","","0.1039","0.1139","","","","","","1.073","","","","has coordinates","184440","2020-10-21","18:00:00",""
"7228166","29.1255","0.0009","29.1255","0.0009","14.6448","0.0005","90","","90","","90","","12423.1","0.7","293","2","293","2","","","","","","","","3","I 41/a :2","-I 4ad","88","pFl-Cb-H","","","- C27 H28 B10 -","- C27 H28 B10 -","- C432 H448 B160 -","16","1","","Wang, Zhaojin; Wang, Tianyu; Zhang, Chi; Humphrey, Mark G.","Efficient crystallization-induced emission in fluorenyl-tethered carboranes","Phys. Chem. Chem. Phys.","2017","","","","","10.1039/C7CP02118F","","","0.71073","MoKα","","0.0952","0.089","","","0.3055","0.3329","","","","","","0.826","","","","has coordinates","195909","2020-10-21","18:00:00",""
"7228573","15.943","0.0004","15.943","0.0004","14.8521","0.0005","90","","90","","90","","3775.1","0.18","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H20 B F24 Li O4 -","- C32 H20 B F24 Li O4 -","- C128 H80 B4 F96 Li4 O16 -","4","0.25","","Carreras, Lucas; Rovira, Laura; Vaquero, Mónica; Mon, Ignasi; Martin, Eddy; Benet-Buchholz, Jordi; Vidal-Ferran, Anton","Syntheses, characterisation and solid-state study of alkali and ammonium BArF salts","RSC Adv.","2017","7","52","32833","","10.1039/C7RA05928K","","","0.71073","MoKα","","0.062","0.0489","","","0.1294","0.1387","","","","","","1.055","","","","has coordinates,has disorder","198199","2020-10-21","18:00:00",""
"7228628","11.374","0.003","11.374","0.003","11.44","0.005","90","","90","","90","","1480","0.9","","","293","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Mo4 Na5 O16 Y -","- Mo4 Na5 O16 Y -","- Mo16 Na20 O64 Y4 -","4","0.25","","Stedman, Nicola J.; Cheetham, Anthony K.; Battle, Peter D.","Crystal structures of two sodium yttrium molybdates : NaY(MoO4)2 and Na5Y(MoO4)4","Journal of Materials Chemistry","1994","4","","707","711","","","x-ray","0.71069","MoKα","","","0.0314","","","0.0338","","","","","","","","","","","has coordinates","198360","2020-10-21","18:00:00",""
"7228629","5.1989","0.00005","5.1989","0.00005","11.3299","0.0001","90","","90","","90","","306.231","0.005","","","293","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Mo2 Na O8 Y -","- Mo2 Na O8 Y -","- Mo4 Na2 O16 Y2 -","2","0.125","","Stedman, Nicola J.; Cheetham, Anthony K.; Battle, Peter D.","Crystal structures of two sodium yttrium molybdates : NaY(MoO4)2 and Na5Y(MoO4)4","Journal of Materials Chemistry","1994","4","","707","711","","powder diffraction","x-ray","1.54184","CuKα","","","","","","","","","0.0549","","","","","","","","has coordinates","198361","2020-10-21","18:00:00",""
"7230862","24.0818","0.0008","24.0818","0.0008","13.5997","0.0009","90","","90","","90","","7886.9","0.6","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C38 H38 Cl Eu N4 O12 -","- C38 H30 Cl Eu N4 O12 -","- C304 H240 Cl8 Eu8 N32 O96 -","8","0.5","","Huang, Yong-Qing; Chen, Huai-Ying; Wang, Yang; Ren, Yong-He; Li, Zong-Ge; Li, Lu-Chao; Wang, Yan","A channel-structured Eu-based metal‒organic framework with a zwitterionic ligand for selectively sensing Fe3+ ions","RSC Advances","2018","8","38","21444","","10.1039/C8RA02809E","","","0.71073","MoKα","","0.0412","0.0306","","","0.0815","0.087","","","","","","1.059","","","","has coordinates","208300","2020-10-21","18:00:00",""
"7231934","18.745","0.007","18.745","0.007","16.688","0.006","90","","90","","90","","5864","4","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C64 H68 N4 O12 -","- C64 H68 N4 O12 -","- C256 H272 N16 O48 -","4","0.25","","Xiao, Zufeng; Yang, Weiping; Yan, Fengyi; Ji, Lingbo; Li, Wei; Wang, Wei","Assembly of calix[4]arene carboxylic acid derivatives by hydrogen bonding","CrystEngComm","2019","21","3","439","","10.1039/C8CE01655K","","","0.71073","MoKα","","0.0621","0.0468","","","0.1394","0.1486","","","","","","1.106","","","","has coordinates","223738","2020-10-21","18:00:00",""
"7234425","8.785","0.002","8.785","0.002","57.646","0.013","90","","90","","90","","4448.9","1.7","110","2","110.15","","","","","","","","","6","I 41/a :2","-I 4ad","88","Co(pyterpy)2(PF6)2","Cobalt(II) bis-(4?-(4???-pyridyl)- 2,2?:6?,2??-terpyridine) hexafluorophosphate","","- C40 H28 Co F12 N8 P2 -","- C40 H28 Co F12 N8 P2 -","- C160 H112 Co4 F48 N32 P8 -","4","0.25","","Xuan Zhang; Haomiao Xie; Maria Ballesteros-Rivas; Zhao-Xi Wang; Kim R. Dunbar","Structural distortions of the spin-crossover material [Co(pyterpy)2](TCNQ)2 mediated by supramolecular interactions","Journal of Materials Chemistry C","2015","3","","9292","9298","10.1039/C5TC01851J","","","0.71073","MoKα","","0.1153","0.0991","","","0.3183","0.3402","","","","","","1.509","","","","has coordinates,has disorder","219132","2020-10-21","18:00:00",""
"7234426","8.715","0.002","8.715","0.002","57.026","0.016","90","","90","","90","","4331.2","1.9","150.15","","150.15","","","","","","","","","6","I 41/a :2","-I 4ad","88","Co(pyterpy)2(PF6)2","Cobalt(II) bis-(4?-(4???-pyridyl)- 2,2?:6?,2??-terpyridine) hexafluorophosphate","","- C40 H28 Co F12 N8 P2 -","- C40 H28 Co F12 N8 P2 -","- C160 H112 Co4 F48 N32 P8 -","4","0.25","","Xuan Zhang; Haomiao Xie; Maria Ballesteros-Rivas; Zhao-Xi Wang; Kim R. Dunbar","Structural distortions of the spin-crossover material [Co(pyterpy)2](TCNQ)2 mediated by supramolecular interactions","Journal of Materials Chemistry C","2015","3","","9292","9298","10.1039/C5TC01851J","","","0.71073","MoKα","","0.1175","0.0997","","","0.3001","0.3178","","","","","","1.153","","","","has coordinates,has disorder","219132","2020-10-21","18:00:00",""
"7234427","8.73","0.004","8.73","0.004","57","0.02","90","","90","","90","","4344","3","180.15","","180.15","","","","","","","","","6","I 41/a :2","-I 4ad","88","Co(pyterpy)2(PF6)2","Cobalt(II) bis-(4?-(4???-pyridyl)- 2,2?:6?,2??-terpyridine) hexafluorophosphate","","- C40 H28 Co F12 N8 P2 -","- C40 H28 Co F12 N8 P2 -","- C160 H112 Co4 F48 N32 P8 -","4","0.25","","Xuan Zhang; Haomiao Xie; Maria Ballesteros-Rivas; Zhao-Xi Wang; Kim R. Dunbar","Structural distortions of the spin-crossover material [Co(pyterpy)2](TCNQ)2 mediated by supramolecular interactions","Journal of Materials Chemistry C","2015","3","","9292","9298","10.1039/C5TC01851J","","","0.71073","MoKα","","0.1663","0.1442","","","0.4238","0.4372","","","","","","1.858","","","","has coordinates,has disorder","219132","2020-10-21","18:00:00",""
"7234428","8.888","0.012","8.888","0.012","57.91","0.08","90","","90","","90","","4575","11","300.15","","300.15","","","","","","","","","6","I 41/a :2","-I 4ad","88","Co(pyterpy)2(PF6)2","Cobalt(II) bis-(4?-(4???-pyridyl)- 2,2?:6?,2??-terpyridine) hexafluorophosphate","","- C40 H28 Co F12 N8 P2 -","- C40 H28 Co F12 N8 P2 -","- C160 H112 Co4 F48 N32 P8 -","4","0.25","","Xuan Zhang; Haomiao Xie; Maria Ballesteros-Rivas; Zhao-Xi Wang; Kim R. Dunbar","Structural distortions of the spin-crossover material [Co(pyterpy)2](TCNQ)2 mediated by supramolecular interactions","Journal of Materials Chemistry C","2015","3","","9292","9298","10.1039/C5TC01851J","","","0.71073","MoKα","","0.1894","0.1643","","","0.4576","0.4708","","","","","","1.928","","","","has coordinates,has disorder","219132","2020-10-21","18:00:00",""
"7234637","23.5825","0.0014","23.5825","0.0014","6.2166","0.0005","90","","90","","90","","3457.3","0.4","296","2","296","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C10 H9 N3 -","- C10 H9 N3 -","- C160 H144 N48 -","16","1","","Ajith R. Mallia; Ramarani Sethy; Vinayak Bhat; Mahesh Hariharan","Crystallization induced enhanced emission in conformational polymorphs of a rotationally flexible molecule","Journal of Materials Chemistry C","2016","4","","2931","2935","10.1039/C5TC03188E","","","0.71073","MoKα","","0.0511","0.0418","","","0.1206","0.1375","","","","","","1.144","","","","has coordinates","219364","2020-10-21","18:00:00",""
"7234981","17.9013","0.0003","17.9013","0.0003","42.9649","0.0008","90","","90","","90","","13768.4","0.4","93","","93","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C88 H56 Fe2 N8 O -","- C88 H56 Fe2 N8 O -","- C704 H448 Fe16 N64 O8 -","8","0.5","","Sakakibara, Erika; Shisaka, Yuma; Onoda, Hiroki; Koga, Daiki; Xu, Ning; Ono, Toshikazu; Hisaeda, Yoshio; Sugimoto, Hiroshi; Shiro, Yoshitsugu; Watanabe, Yoshihito; Shoji, Osami","Highly malleable haem-binding site of the haemoprotein HasA permits stable accommodation of bulky tetraphenylporphycenes","RSC Advances","2019","9","32","18697","","10.1039/C9RA02872B","","x-ray","0.71073","MoKα","","0.0798","0.0546","","","0.1466","0.1745","","","","","","1.082","","","","has coordinates","223454","2020-10-21","18:00:00",""
"7234996","11.7099","0.0016","11.7099","0.0016","27.227","0.004","90","","90","","90","","3733.4","0.9","299.92","","299.92","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C19 H8 N0.5 O12 U -","- C19 H8 N0.5 O12 U -","- C152 H64 N4 O96 U8 -","8","0.5","","Dufaye, Maxime; Martin, Nicolas P.; Duval, Sylvain; Volkringer, Christophe; Ikeda-Ohno, Atsushi; Loiseau, Thierry","Time-controlled synthesis of the 3D coordination polymer U(1,2,3-Hbtc)2 followed by the formation of molecular poly-oxo cluster {U14} containing hemimellitate uranium(iv)","RSC Advances","2019","9","40","22795","","10.1039/C9RA03707A","","x-ray","0.71073","MoKα","","0.0407","0.0208","","","0.0422","0.0471","","","","","","1.024","","","","has coordinates","223460","2020-10-21","18:00:00",""
"7235607","16.6545","0.0016","16.6545","0.0016","16.3362","0.0018","90","","90","","90","","4531.2","0.8","113","2","113","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C10 H9 Cu N3 O3 -","- C10 H9 Cu N3 O3 -","- C160 H144 Cu16 N48 O48 -","16","1","","Hawes, Chris S.; Kruger, Paul E.","Preparation of open and closed forms of the lvt network with Cu(ii) complexes of structurally related 1,2-diazole ligands","RSC Advances","2014","4","30","15770","","10.1039/C4RA02147A","","","0.71073","MoKα","","0.0876","0.0455","","","0.0931","0.1097","","","","","","1.019","","","","has coordinates","233172","2020-10-21","18:00:00",""
"7235608","18.0584","0.0008","18.0584","0.0008","18.3413","0.0011","90","","90","","90","","5981.2","0.5","113","2","113","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C9 H11 Cu N3 O3 -","- C9 H11 Cu N3 O3 -","- C144 H176 Cu16 N48 O48 -","16","1","","Hawes, Chris S.; Kruger, Paul E.","Preparation of open and closed forms of the lvt network with Cu(ii) complexes of structurally related 1,2-diazole ligands","RSC Advances","2014","4","30","15770","","10.1039/C4RA02147A","","","0.71073","MoKα","","0.0702","0.0651","","","0.1589","0.162","","","","","","1.206","","","","has coordinates","233172","2020-10-21","18:00:00",""
"7235755","13.8054","0.0014","13.8054","0.0014","27.53","0.005","90","","90","","90","","5246.9","1.2","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C12 H12 N28 O2 Pb2 -","- C12 H12 N28 O2 Pb2 -","- C96 H96 N224 O16 Pb16 -","8","0.5","","Gao, Wenjuan; Liu, Xiangyu; Su, Zhiyong; Zhang, Sheng; Yang, Qi; Wei, Qing; Chen, Sanping; Xie, Gang; Yang, Xuwu; Gao, Shengli","High-energy-density materials with remarkable thermostability and insensitivity: syntheses, structures and physicochemical properties of Pb(ii) compounds with 3-(tetrazol-5-yl) triazole","Journal of Materials Chemistry A","2014","2","30","11958","","10.1039/C4TA01746C","","","0.71073","MoKα","","0.0368","0.0298","","","0.0611","0.0633","","","","","","0.903","","","","has coordinates","233296","2020-10-21","18:00:00",""
"7236054","30.271","0.0004","30.271","0.0004","8.2855","0.0003","90","","90","","90","","7592.3","0.3","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C13 H8 N O5 Tb -","- C13 H8 N O5 Tb -","- C208 H128 N16 O80 Tb16 -","16","1","","Qin, Jianhua; Ma, Bing; Liu, Xiao-Fei; Lu, Hong-Lin; Dong, Xi-Yan; Zang, Shuang-Quan; Hou, Hongwei","Aqueous- and vapor-phase detection of nitroaromatic explosives by a water-stable fluorescent microporous MOF directed by an ionic liquid","Journal of Materials Chemistry A","2015","3","24","12690","","10.1039/C5TA00322A","","","0.71073","MoKα","","0.0338","0.0253","","","0.0593","0.0613","","","","","","1.079","","","","has coordinates","233880","2020-10-21","18:00:00",""
"7236333","23.3588","0.0003","23.3588","0.0003","31.3531","0.001","90","","90","","90","","17107.3","0.6","103","2","103","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C54 H36 Co3 N42 O0 S6 -","- C54 H36 Co3 N42 S6 -","- C432 H288 Co24 N336 S48 -","8","0.5","","Liang, Linfeng; Chen, Qihui; Jiang, Feilong; Yuan, Daqiang; Qian, Jinjie; Lv, Guangxun; Xue, Hui; Liu, Luyao; Jiang, Hai-Long; Hong, Maochun","In situ large-scale construction of sulfur-functionalized metal‒organic framework and its efficient removal of Hg(ii) from water","Journal of Materials Chemistry A","2016","4","40","15370","","10.1039/C6TA04927C","","","1.54184","CuKα","","0.0983","0.0839","","","0.2475","0.2598","","","","","","1.067","","","","has coordinates","235411","2020-10-21","18:00:00",""
"7236348","34.7078","0.0006","34.7078","0.0006","18.0586","0.0003","90","","90","","90","","21754","0.6","100","2","100","2","","","","","","","synthesis as described","6","I 41/a :2","-I 4ad","88","","","","- C80 H23 Cl Ir N O2 -","- C80 H23 Cl Ir N O2 -","- C1280 H368 Cl16 Ir16 N16 O32 -","16","1","","María Girón, Rosa; Marco-Martínez, Juan; Bellani, Sebastiano; Insuasty, Alberto; Comas Rojas, Hansel; Tullii, Gabriele; Antognazza, Maria Rosa; Filippone, Salvatore; Martín, Nazario","Synthesis of modified fullerenes for oxygen reduction reactions","Journal of Materials Chemistry A","2016","4","37","14284","","10.1039/C6TA06573B","","x-ray","1.54184","CuKα","","0.0835","0.0461","","","0.1022","0.1129","","","","","","0.918","","","","has coordinates","235434","2020-10-21","18:00:00",""
"7236525","29.1076","0.0013","29.1076","0.0013","23.5668","0.0019","90","","90","","90","","19967","2","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C24 H36 Cu5 In30 N4 S56 -","- C24 Cu4.9996 In30.0004 N4 S56 -","- C96 Cu19.9984 In120.002 N16 S224 -","4","0.25","","Li, Zhao-Qi; Mo, Chong-Jiao; Guo, Yao; Xu, Nan-Nan; Zhu, Qin-Yu; Dai, Jie","Discrete supertetrahedral CuInS nanoclusters and their application in fabrication of cluster-sensitized TiO2 photoelectrodes","Journal of Materials Chemistry A","2017","5","18","8519","","10.1039/C7TA00247E","","","0.71073","MoKα","","0.1647","0.0739","","","0.1276","0.1582","","","","","","1.166","","","","has coordinates","236274","2020-10-21","18:00:00",""
"7237955","14.9363","0.001","14.9363","0.001","39.332","0.006","90","","90","","90","","8774.7","1.6","296.15","","296.15","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C45 H50 O10 -","- C45 H50 O10 -","- C360 H400 O80 -","8","0.5","","Chen, Jin-Fa; Meng, Guoyun; Zhu, Qian; Zhang, Songhe; Chen, Pangkuan","Pillar[5]arenes: a new class of AIEgen macrocycles used for luminescence sensing of Fe3+ ions","Journal of Materials Chemistry C","2019","7","38","11747","","10.1039/C9TC03831K","","","0.71073","MoKα","","0.1333","0.0603","","","0.1693","0.2291","","","","","","1.001","","","","has coordinates","238785","2020-10-21","18:00:00",""
"7238110","11.733","0.002","11.733","0.002","20.664","0.004","90","","90","","90","","2844.7","0.9","294","","","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C18 H26 Cl2 Fe N14 O6 -","- C18 H14 Cl2 Fe N14 O6 -","- C72 H56 Cl8 Fe4 N56 O24 -","4","0.25","","Scudder, Marcia L.; Craig, Donald C.; Goodwin, Harold A.","Hydrogen bonding influences on the properties of heavily hydrated chloride salts of iron(ii) and ruthenium(ii) complexes of 2,6-bis(pyrazol-3-yl)pyridine, 2,6-bis(1,2,4-triazol-3-yl)pyridine and 2,2′∶6′,2″-terpyridine","CrystEngComm","2005","7","107","642","","10.1039/b511825e","","","0.71073","MoKα","","","0.071","","","","0.105","","","","","","1.7","","","","has coordinates","244072","2020-10-21","18:00:00",""
"7238370","23.033","0.01","23.033","0.01","15.607","0.003","90","","90","","90","","8280","5","150","2","150","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C56 H61 Mn Mo8 N16 O44 P V6 -","- C56 H56 Mn Mo8 N16 O44 P V6 -","- C224 H224 Mn4 Mo32 N64 O176 P4 V24 -","4","0.25","","Ding, Yan; Meng, Jing-Xin; Chen, Wei-Lin; Wang, En-Bo","Controllable assembly of four new POM-based supramolecular compounds by altering the POM secondary building units from pseudo-Keggin to classical Keggin","CrystEngComm","2011","13","7","2687","","10.1039/c0ce00967a","","","0.71073","MoKα","","0.0855","0.0609","","","0.1631","0.178","","","","","","1.07","","","","has coordinates","244130","2020-10-21","18:00:00",""
"7238371","22.921","0.003","22.921","0.003","15.642","0.003","90","","90","","90","","8218","2","150","2","150","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C56 H60 Mo9 N16 O44 P V5 Zn -","- C56 H56 Mo9 N16 O44 P V5 Zn -","- C224 H224 Mo36 N64 O176 P4 V20 Zn4 -","4","0.25","","Ding, Yan; Meng, Jing-Xin; Chen, Wei-Lin; Wang, En-Bo","Controllable assembly of four new POM-based supramolecular compounds by altering the POM secondary building units from pseudo-Keggin to classical Keggin","CrystEngComm","2011","13","7","2687","","10.1039/c0ce00967a","","","0.71073","MoKα","","0.0392","0.0332","","","0.0839","0.0861","","","","","","1.05","","","","has coordinates,has disorder","244130","2020-10-21","18:00:00",""
"7238372","22.878","0.009","22.878","0.009","15.853","0.003","90","","90","","90","","8298","5","150","2","150","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C56 H64 Cu Mo9 N16 O46 P V5 -","- C56 H56 Cu Mo9 N16 O46 P V5 -","- C224 H224 Cu4 Mo36 N64 O184 P4 V20 -","4","0.25","","Ding, Yan; Meng, Jing-Xin; Chen, Wei-Lin; Wang, En-Bo","Controllable assembly of four new POM-based supramolecular compounds by altering the POM secondary building units from pseudo-Keggin to classical Keggin","CrystEngComm","2011","13","7","2687","","10.1039/c0ce00967a","","","0.71073","MoKα","","0.0818","0.0534","","","0.1234","0.1369","","","","","","1.046","","","","has coordinates","244130","2020-10-21","18:00:00",""
"7238767","20.4779","0.0015","20.4779","0.0015","34.934","0.003","90","","90","","90","","14649","2","133","2","133","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C74 H60 Au4 F6 O8 P4 S2 -","- C74 H60 Au4 F6 O8 P4 S2 -","- C592 H480 Au32 F48 O64 P32 S16 -","8","0.5","","Tang, Yu; Yu, Biao","Identification of (phosphine)gold(i) hydrates and their equilibria in wet solutions","RSC Advances","2012","2","33","12686","","10.1039/c2ra22282e","","","0.71073","MoKα","","0.0843","0.0547","","","0.1462","0.1713","","","","","","1.057","","","","has coordinates,has disorder","244339","2020-10-21","18:00:00",""
"7239285","19.7107","0.0009","19.7107","0.0009","11.0593","0.001","90","","90","","90","","4296.7","0.5","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C9 H10 N2 O4 Zn -","- C9 H10 N2 O4 Zn -","- C144 H160 N32 O64 Zn16 -","16","1","","Chen, Yanmei; Gao, Qian; Liu, Yonglu; Cao, Yanyuan; Gao, Dandan; Liu, Jinna; Zhao, Jingjing; Li, Yahong; Liu, Wei; Li, Wu","Synthesis, crystal structures and luminescent properties of CdIIand ZnIIcomplexes assembled by 4-aminophenylhydroxamic acid","RSC Adv.","2014","4","1","147","","10.1039/C3RA44489A","","","0.71073","MoKα","","0.0369","0.034","","","0.1058","0.1082","","","","","","1.133","","","","has coordinates","244635","2020-10-21","18:00:00",""
"7239286","19.7648","0.0003","19.7648","0.0003","11.0481","0.0004","90","","90","","90","","4315.91","0.18","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C37 H44 N8 O17 Zn4 -","- C37 H40 N8 O17 Zn4 -","- C148 H160 N32 O68 Zn16 -","4","0.25","","Chen, Yanmei; Gao, Qian; Liu, Yonglu; Cao, Yanyuan; Gao, Dandan; Liu, Jinna; Zhao, Jingjing; Li, Yahong; Liu, Wei; Li, Wu","Synthesis, crystal structures and luminescent properties of CdIIand ZnIIcomplexes assembled by 4-aminophenylhydroxamic acid","RSC Adv.","2014","4","1","147","","10.1039/C3RA44489A","","","0.71073","MoKα","","0.0386","0.0322","","","0.0947","0.1005","","","","","","1.052","","","","has coordinates,has disorder","244635","2020-10-21","18:00:00",""
"7239716","20.3378","0.001","20.3378","0.001","18.3367","0.0011","90","","90","","90","","7584.5","0.7","100.01","0.1","100.01","0.1","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C21 H22 N2 O2 -","- C21 H22 N2 O2 -","- C336 H352 N32 O32 -","16","1","","Li, Jianxiao; Yu, Junsheng; Xiong, Wenfang; Tang, Hao; Hu, Miao; Wu, Wanqing; Jiang, Huanfeng","A palladium-catalyzed oxidative aminocarbonylation reaction of alkynone O-methyloximes with amines and CO in PEG-400","Green Chemistry","2020","22","2","465","470","10.1039/C9GC03562A","","x-ray","0.71073","MoKα","","0.0805","0.0598","","","0.141","0.1522","","","","","","1.063","","","","has coordinates","257594","2020-10-21","18:00:00",""
"7239733","25.15","0.003","25.15","0.003","14.827","0.0019","90","","90","","90","","9378","2","296","2","296","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C120 H96 O24 -","- C120 H96 O24 -","- C480 H384 O96 -","4","0.25","","Xiao, Zufeng; Yang, Weiping; Luo, Jia; Guo, Rong; Zeng, Rong; Ji, Lingbo; Li, Wei; Wang, Wei","Weak intermolecular interaction directed assembly of calix[4]arene derivatives","CrystEngComm","2019","21","46","7114","","10.1039/C9CE01286A","","","0.71073","MoKα","","0.1387","0.0768","","","0.1994","0.2529","","","","","","1.015","","","","has coordinates","246603","2020-10-21","18:00:00",""
"7240441","20.2031","0.0008","20.2031","0.0008","13.2367","0.0007","90","","90","","90","","5402.8","0.4","293","2","293.15","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C36 H30 N2 -","- C36 H30 N2 -","- C288 H240 N16 -","8","0.5","","Zhang, Hua; Zhan, Xiao-Yu; Dong, Yu; Yang, Jian; He, Shuai; Shi, Zhi-Chuan; Zhang, Xiao-Mei; Wang, Ji-Yu","Dehydration in water: frustrated Lewis pairs directly catalyzed allylization of electron-rich arenes and allyl alcohols","RSC Advances","2020","10","29","16942","16948","10.1039/D0RA02912B","","x-ray","0.71073","MoKα","","0.1507","0.0756","","","0.2006","0.2523","","","","","","1.069","","","","has coordinates","257958","2020-10-21","18:00:00",""
"7240759","16.882","0.002","16.882","0.002","16.323","0.002","90","","90","","90","","4652.1","1","100","","100","","","","","","","","see text","3","I 41/a :2","-I 4ad","88","","","","- C40 H84 Si5 -","- C40 H84 Si5 -","- C160 H336 Si20 -","4","0.25","","Herz, Fabian A. D.; Nobis, Matthias; Wendel, Daniel; Pahl, Philipp; Altmann, Philipp J.; Tillmann, Jan; Weidner, Richard; Inoue, Shigeyoshi; Rieger, Bernhard","Application of multifunctional silylenes and siliranes as universal crosslinkers for metal-free curing of silicones","Green Chemistry","2020","22","14","4489","4497","10.1039/D0GC00272K","","x-ray","0.71073","MoKα","","0.0496","0.0431","","","0.1071","0.1125","","","","","","1.035","","","","has coordinates","257610","2020-10-21","18:00:00",""
"7241205","27.1581","0.0011","27.1581","0.0011","10.8428","0.0005","90","","90","","90","","7997.2","0.6","150","2","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C22 H14 O5 Pb2 -","- C22 H14 O5 Pb2 -","- C352 H224 O80 Pb32 -","16","1","","Hammer, Arden C.; Jia, Xiwen; Zeller, Matthias; Coughlin, Ezra John; Zhang, Weiguo; Oertel, Catherine M.","Ligand Geometry Directs the Packing and Symmetry of One-Dimensional Helical Motifs in Lead Oxide Naphthoates and Biphenylcarboxylates","CrystEngComm","2020","","","","","10.1039/D0CE01150A","","","0.71073","MoKα","","0.0441","0.0314","","","0.0621","0.0696","","","","","","1.142","","","","has coordinates","256335","2020-10-21","18:00:00",""
"7241742","9.7369","0.0003","9.7369","0.0003","76.074","0.002","90","","90","","90","","7212.4","0.4","220","1","220","1","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C46 H37 Cd Cl I4 S32 -","- C46 H37 Cd Cl I4 S32 -","- C184 H148 Cd4 Cl4 I16 S128 -","4","0.25","","Shilov, Gennadii V.; Zhilyaeva, Elena I.; Flakina, Alexandra M.; Aldoshin, Sergey M.; Konarev, Dmitri V.; Lyubovskii, Rustem B.; Lyubovskaya, Rimma N.","Phase transformations of iodine-containing dual-layered conductor θ-(ET)4CdI4(PhCl) upon cooling","CrystEngComm","2020","22","46","8054","8062","10.1039/D0CE01375G","","","0.7107","MoKα","","0.0743","0.0619","","","0.1144","0.1199","","","","","","1.178","","","","has coordinates,has disorder","259733","2020-12-10","03:37:08",""
"7241762","29.63","0.002","29.63","0.002","8.9973","0.0007","90","","90","","90","","7899.1","1","150","2","149.98","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C40 H36 Cd2 N8 O8 -","- C40 H36 Cd2 N8 O8 -","- C320 H288 Cd16 N64 O64 -","8","0.5","","Tómasson, Daníel Arnar; Ghosh, Dipankar; Kurup, M. R. Prathapachandra; Mulvee, Matthew T.; Damodaran, Krishna K.","Evaluating the role of a urea-like motif in enhancing the thermal and mechanical strength of supramolecular gels","CrystEngComm","2021","23","3","617","628","10.1039/D0CE01194K","","","0.71073","MoKα","","0.0449","0.0355","","","0.0859","0.0888","","","","","","1.095","","","","has coordinates","261634","2021-02-04","23:05:20",""
"7242128","25.3668","0.0002","25.3668","0.0002","15.1922","0.0002","90","","90","","90","","9775.79","0.17","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C14 H8 Eu N O7 -","- C14 H8 Eu N O7 -","- C224 H128 Eu16 N16 O112 -","16","1","","Dong, Jian-Peng; Li, Bo; Jin, Yu-Jie; Wang, Li-Ya","Efficient detection of Fe(iii) and chromate ions in water using two robust lanthanide metal‒organic frameworks","CrystEngComm","2021","23","7","1677","1683","10.1039/D0CE01802C","","","1.54178","CuKα","","0.0503","0.0473","","","0.1809","0.1843","","","","","","1.086","","","","has coordinates","262589","2021-03-05","01:49:05",""
"7242129","25.3649","0.0001","25.3649","0.0001","15.2716","0.0001","90","","90","","90","","9825.41","0.08","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C14 H8 N O7 Tb -","- C14 H8 N O7 Tb -","- C224 H128 N16 O112 Tb16 -","16","1","","Dong, Jian-Peng; Li, Bo; Jin, Yu-Jie; Wang, Li-Ya","Efficient detection of Fe(iii) and chromate ions in water using two robust lanthanide metal‒organic frameworks","CrystEngComm","2021","23","7","1677","1683","10.1039/D0CE01802C","","","1.54178","CuKα","","0.0642","0.0607","","","0.2499","0.2579","","","","","","1.105","","","","has coordinates","262589","2021-03-05","01:49:05",""
"7242151","20.2979","0.0009","20.2979","0.0009","39.0458","0.0018","90","","90","","90","","16087.1","1.3","150","2","150","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C44 H26 Cl2 N6 Ni -","- C44 H26 Cl2 N6 Ni -","- C704 H416 Cl32 N96 Ni16 -","16","1","","Braun, Jason D.; Lozada, Issiah B.; Shepit, Michael; van Lierop, Johan; Herbert, David E.","Pseudo-octahedral nickel(ii) complexes of strongly absorbing benzannulated pincer-type amido ligands: ligand-based redox and non-Aufbau electronic behaviour","RSC Advances","2021","11","6","3547","3555","10.1039/D0RA10761A","","","0.71073","MoKα","","0.0791","0.0592","","","0.1284","0.139","","","","","","1.04","","","","has coordinates","261082","2021-01-20","05:44:50",""
"7243461","9.7458","0.0003","9.7458","0.0003","74.416","0.002","90","","90","","90","","7068.1","0.4","340","1","340","0.1","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C46 H36 Br4 Cl2 S32 Zn -","- C46 H36 Br4 Cl2 S32 Zn -","- C184 H144 Br16 Cl8 S128 Zn4 -","4","0.25","","Shilov, Gennady V.; Zhilyaeva, Elena I.; Aldoshin, Sergey M.; Flakina, Alexandra M.; Lyubovskii, Rustem B.; Pesotskii, Sergei I.; Lyubovskaya, Rimma N.","Evolution of crystal structure of dual layered molecular conductor (ET)4ZnBr4(C6H4Cl2) with temperature","CrystEngComm","2021","23","37","6620","6625","10.1039/D1CE00902H","","","0.7107","MoKα","","0.1497","0.0747","","","0.1741","0.2294","","","","","","0.93","","","","has coordinates,has disorder","269671","2021-10-06","14:49:34",""
"7243696","15.9927","0.0004","15.9927","0.0004","12.1188","0.0004","90","","90","","90","","3099.58","0.15","101","","101","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C8 H8 O2 Te0.5 -","- C8 H8 O2 Te0.5 -","- C128 H128 O32 Te8 -","16","1","","Shibuya, Yuga; Toyoda, Anna; Ohmura, Shiori; Higashikawa, Go; Koguchi, Shinichi","One-pot synthesis, structural analysis, and oxidation applications of a series of diaryltellurium dicarboxylates","RSC Advances","2021","11","52","32837","32840","10.1039/D1RA06150J","","","0.71073","MoKα","","0.0502","0.0399","","","0.0958","0.0997","","","","","","0.992","","","","has coordinates","269815","2021-10-07","01:34:34",""
"7244786","41.7805","0.0002","41.7805","0.0002","17.562","0.0002","90","","90","","90","","30656.4","0.4","100","2","100","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C122 H157 Br2 Co2.44 Li5.56 N17 O10 -","- C106 H131 Br2 Co2.438 Li5.562 N9 O10 -","- C848 H1048 Br16 Co19.504 Li44.496 N72 O80 -","8","0.5","","Ignaszak, Anna; Patterson, Nigel; O'Brien, Connor; True, Allison; Elsegood, Mark R. J.; Prior, Timothy J.; Redshaw, Carl","Heterometallic cobalt(ii) calix[6 and 8]arenes: synthesis, structure and electrochemical activity","RSC Advances","2022","12","19","11672","11685","10.1039/D2RA01009G","","","0.71073","MoKα","","0.1479","0.0978","","","0.2938","0.3475","","","","","","1.027","","","","has coordinates,has disorder","274546","2022-04-15","01:21:18",""
"7244787","41.6832","0.0005","41.6832","0.0005","17.4818","0.0003","90","","90","","90","","30374.4","0.7","100","2","100","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C123.58 H157.38 Br1.58 Cl2.62 Co2.81 Li5.19 N17.79 O10 -","- C99.584 H121.376 Br1.584 Cl2.624 Co2.806 Li5.194 N5.792 O10 -","- C796.672 H971.008 Br12.672 Cl20.992 Co22.448 Li41.552 N46.336 O80 -","8","0.5","","Ignaszak, Anna; Patterson, Nigel; O'Brien, Connor; True, Allison; Elsegood, Mark R. J.; Prior, Timothy J.; Redshaw, Carl","Heterometallic cobalt(ii) calix[6 and 8]arenes: synthesis, structure and electrochemical activity","RSC Advances","2022","12","19","11672","11685","10.1039/D2RA01009G","","","0.71075","MoKα","","0.1571","0.0968","","","0.2934","0.3319","","","","","","1.046","","","","has coordinates,has disorder","274546","2022-04-15","01:21:19",""
"7245883","17.3463","0.0003","17.3463","0.0003","19.8722","0.0005","90","","90","","90","","5979.4","0.2","140","2","140","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C52 H36 Cu4 I8 N4 O12 -","- C52 H36 Cu4 I8 N4 O12 -","- C208 H144 Cu16 I32 N16 O48 -","4","0.25","","Bondarenko, Mikhail A.; Abramov, Pavel A.; Korolkov, Ilya V.; Bogomyakov, Artem S.; Sokolov, Maxim N.; Adonin, Sergey A.","Cu(ii) 3,5-diiodosalicylate complexes: precursor-dependent formation of mono-, di-, tri- and tetranuclear compounds and 1D coordination polymers","CrystEngComm","2023","25","1","130","136","10.1039/D2CE01393B","","x-ray","0.71073","MoKα","","0.0679","0.0617","","","0.1165","0.1188","","","","","","1.16","","","","has coordinates","281404","2023-03-04","18:07:43",""
"7245884","17.7967","0.0006","17.7967","0.0006","19.2988","0.0009","90","","90","","90","","6112.4","0.4","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C52 H36 Cu4 I8 N4 O12 -","- C52 H36 Cu4 I8 N4 O12 -","- C208 H144 Cu16 I32 N16 O48 -","4","0.25","","Bondarenko, Mikhail A.; Abramov, Pavel A.; Korolkov, Ilya V.; Bogomyakov, Artem S.; Sokolov, Maxim N.; Adonin, Sergey A.","Cu(ii) 3,5-diiodosalicylate complexes: precursor-dependent formation of mono-, di-, tri- and tetranuclear compounds and 1D coordination polymers","CrystEngComm","2023","25","1","130","136","10.1039/D2CE01393B","","","0.71073","MoKα","","0.0403","0.0326","","","0.0834","0.0882","","","","","","1.023","","","","has coordinates","281404","2023-03-04","18:07:43",""
"7245887","16.9289","0.0004","16.9289","0.0004","19.3081","0.0006","90","","90","","90","","5533.5","0.3","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C48 H28 Cu4 I8 N4 O12 -","- C48 H28 Cu4 I8 N4 O12 -","- C192 H112 Cu16 I32 N16 O48 -","4","0.25","","Bondarenko, Mikhail A.; Abramov, Pavel A.; Korolkov, Ilya V.; Bogomyakov, Artem S.; Sokolov, Maxim N.; Adonin, Sergey A.","Cu(ii) 3,5-diiodosalicylate complexes: precursor-dependent formation of mono-, di-, tri- and tetranuclear compounds and 1D coordination polymers","CrystEngComm","2023","25","1","130","136","10.1039/D2CE01393B","","x-ray","0.71073","MoKα","","0.0294","0.0256","","","0.0581","0.06","","","","","","1.077","","","","has coordinates","281404","2023-03-04","18:07:43",""
"7245890","17.7012","0.0004","17.7012","0.0004","20.5023","0.0008","90","","90","","90","","6424","0.3","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C56 H44 Cu4 I8 N4 O12 -","- C56 H44 Cu4 I8 N4 O12 -","- C224 H176 Cu16 I32 N16 O48 -","4","0.25","","Bondarenko, Mikhail A.; Abramov, Pavel A.; Korolkov, Ilya V.; Bogomyakov, Artem S.; Sokolov, Maxim N.; Adonin, Sergey A.","Cu(ii) 3,5-diiodosalicylate complexes: precursor-dependent formation of mono-, di-, tri- and tetranuclear compounds and 1D coordination polymers","CrystEngComm","2023","25","1","130","136","10.1039/D2CE01393B","","","0.71073","MoKα","","0.0477","0.0345","","","0.0813","0.089","","","","","","1.178","","","","has coordinates","281404","2023-03-04","18:07:43",""
"7246587","9.197","0.0004","9.197","0.0004","14.6568","0.0007","90","","90","","90","","1239.74","0.1","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C H4 N2 O2 -","- C H4 N2 O2 -","- C16 H64 N32 O32 -","16","1","","Rai, Sunil K.; Tothadi, Srinu; Arhangelskis, Mihails; George, Christy P.; Gonnade, Rajesh G.; Nangia, Ashwini K.","Polymorph II of hydroxyurea 150 years after its first synthesis","CrystEngComm","2023","25","18","2712","2716","10.1039/D3CE00163F","","","0.71073","MoKα","","0.0353","0.0321","","","0.0988","0.1201","","","","","","1.252","","","","has coordinates","284261","2023-06-05","04:24:05",""
"7246859","22.9964","0.001","22.9964","0.001","14.1407","0.0017","90","","90","","90","","7478.1","1","298","2","298","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C22 H20 N4 O -","- C22 H20 N4 O -","- C352 H320 N64 O16 -","16","1","","Arias-Gómez, Andres; Macías, Mario A.; Portilla, Jaime","Synthesis of structural analogues of Reversan by ester aminolysis: an access to pyrazolo[1,5-a]pyrimidines from chalcones","RSC Advances","2023","13","24","16377","16386","10.1039/D3RA02553E","","","1.54184","CuKα","","0.0562","0.0506","","","0.1371","0.1453","","","","","","1.041","","","","has coordinates","284116","2023-06-01","01:07:04",""
"7246887","17.0985","0.0006","17.0985","0.0006","42.1074","0.0017","90","","90","","90","","12310.5","0.8","200","2","200","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C26 H28 Cl2 Co N4 -","- C26 H28 Cl2 Co N4 -","- C416 H448 Cl32 Co16 N64 -","16","1","","Tella, Adedibu C.; Owalude, Samson O.; Ameen, Olanrewaju A.; Clayton, Hadley S.; Yusuph, Quadrat; Dembaremba, Tendai O.; Hosten, Eric C.; Ogunlaja, Adeniyi S.","Synthesis, crystal structures and DFT studies of Co(ii) and Zn(ii) coordination polymers of terephthalate and 4,4′-trimethylenedipyridyl ligands for removal of dibenzothiophene from a model fuel oil","CrystEngComm","2023","25","28","3998","4010","10.1039/D3CE00236E","","","0.71073","MoKα","","0.0979","0.0725","","","0.2139","0.2397","","","","","","1.061","","","","has coordinates","286086","2023-09-05","19:35:15",""
"7247550","15.6371","0.0001","15.6371","0.0001","17.646","0.0002","90","","90","","90","","4314.78","0.06","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","6-bromo-1,1-dimethyl-2,1,3-benzoxasilaborol-3(1H)-ol","","- C8 H10 B Br O2 Si -","- C8 H10 B Br O2 Si -","- C128 H160 B16 Br16 O32 Si16 -","16","1","","Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz","Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles","CrystEngComm","2023","25","45","6329","6342","10.1039/D3CE00880K","","x-ray","0.71073","MoKα","","0.0371","0.0239","","","0.0533","0.0583","","","","","","1.046","","","","has coordinates","288806","2024-01-06","08:05:23",""
"7247551","15.507","0.0001","15.507","0.0001","17.3326","0.0002","90","","90","","90","","4167.92","0.06","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","1,1-dimethyl-7-chloro-3-hydroxybenzo[c][1,2,3]siloxaborole","","- C8 H10 B Cl O2 Si -","- C8 H10 B Cl O2 Si -","- C128 H160 B16 Cl16 O32 Si16 -","16","1","","Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz","Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles","CrystEngComm","2023","25","45","6329","6342","10.1039/D3CE00880K","","","1.54178","CuKα","","0.0307","0.0304","","","0.0865","0.0868","","","","","","1.095","","","","has coordinates","288806","2024-01-06","08:05:24",""
"7247552","15.5827","0.0001","15.5827","0.0001","17.2392","0.0003","90","","90","","90","","4186.03","0.08","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C9 H11 B O3 Si -","- C9 H11 B O3 Si -","- C144 H176 B16 O48 Si16 -","16","1","","Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz","Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles","CrystEngComm","2023","25","45","6329","6342","10.1039/D3CE00880K","","x-ray","0.71073","MoKα","","0.0787","0.0527","","","0.1256","0.1427","","","","","","1.023","","","","has coordinates,has disorder","288806","2024-01-06","08:05:24",""
"7247560","15.8197","0.0002","15.8197","0.0002","18.3035","0.0005","90","","90","","90","","4580.69","0.15","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","1,1-dimethyl-7-(trifluoromethyl)-3-hydroxybenzo[c][1,2,3]siloxaborole","","- C9 H10 B F3 O2 Si -","- C9 H10 B F3 O2 Si -","- C144 H160 B16 F48 O32 Si16 -","16","1","","Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz","Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles","CrystEngComm","2023","25","45","6329","6342","10.1039/D3CE00880K","","x-ray","0.71073","MoKα","","0.0446","0.037","","","0.09","0.0953","","","","","","1.055","","","","has coordinates","288806","2024-01-06","08:05:34",""
"7247562","15.3391","0.0001","15.3391","0.0001","16.9322","0.0003","90","","90","","90","","3983.94","0.08","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","1,1-dimethyl-7-fluoro-2,1,3-benzoxasilaborol-3(1H)-ol","","- C8 H10 B F O2 Si -","- C8 H10 B F O2 Si -","- C128 H160 B16 F16 O32 Si16 -","16","1","","Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz","Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles","CrystEngComm","2023","25","45","6329","6342","10.1039/D3CE00880K","","","0.71073","MoKα","","0.0672","0.0374","","","0.0866","0.0996","","","","","","1.026","","","","has coordinates","288806","2024-01-06","08:05:34",""
"7247587","25.9513","0.0011","25.9513","0.0011","9.8863","0.0007","90","","90","","90","","6658.1","0.6","273.15","","273.15","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H48 N10 S6 Sb2 Zn2 -","- C16 H48 N10 S6 Sb2 Zn2 -","- C128 H384 N80 S48 Sb16 Zn16 -","8","0.5","","Zhang, Lirong; Zhao, Huiling; Liu, Xin; Teri, Gele; Baiyin, Menghe","Syntheses, crystal structure, and photoelectric properties of two Zn-based chalcogenidoantimonates Zn-Sb-Q (Q = S, Se).","Physical chemistry chemical physics : PCCP","2023","25","43","29709","29717","10.1039/d3cp04074g","","","0.71073","MoKα","","0.0577","0.0472","","","0.1145","0.1207","","","","","","1.09","","","","has coordinates","288905","2024-01-06","09:53:28",""
"7248037","15.7011","0.0014","15.7011","0.0014","29.337","0.003","90","","90","","90","","7232.3","1.2","103","2","103","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C44 H36 N6 O5 -","- C44 H36 N6 O5 -","- C352 H288 N48 O40 -","8","0.5","","Patil, Baliram R.; Nichinde, Chandrakant B.; Chaudhari, Suryakant S.; Krishna, Gamidi Rama; Kinage, Anil K.","Organocatalyzed [4 + 2] cycloaddition of α,β-unsaturated ketones and isatylidene malononitrile: accessing spiro[3-arylcyclohexanone]oxindole derivatives","RSC Advances","2024","14","5","2873","2877","10.1039/D3RA07652K","","","0.71073","MoKα","","0.0459","0.0374","","","0.0906","0.0967","","","","","","1.016","","","","has coordinates","289135","2024-01-18","02:48:46",""
"7248256","14.2868","0.0002","14.2868","0.0002","24.4236","0.0008","90","","90","","90","","4985.17","0.19","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C42 H54 Mo2.7 N6 Re3.3 S8 -","- C42 H54 Mo2.7 N6 Re3.3 S8 -","- C168 H216 Mo10.8 N24 Re13.2 S32 -","4","0.25","","Lappi, Tatiana I.; Gaifulin, Yakov M.; Sukhikh, Taisiya S.; Gaifulina, Viktoria K.; Yanshole, Vadim V.; Cordier, Stephane; Naumov, Nikolay G.","Molecular heterometallic clusters [Re6−xMoxS8L6] (x = 2–3, L = py, etpy, tbp): negligible influence of the x value on the crystal structures","CrystEngComm","2024","26","12","1720","1729","10.1039/D3CE01229H","","","0.71073","MoKα","","0.0301","0.0189","","","0.0363","0.039","","","","","","1.06","","","","has coordinates,has disorder","290908","2024-04-04","23:12:33",""
"7248260","14.2677","0.0011","14.2677","0.0011","24.473","0.004","90","","90","","90","","4981.9","1","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C42 H54 Mo3 N6 Re3 S8 -","- C42 H54 Mo2.9998 N6 Re3.0002 S8 -","- C168 H216 Mo11.9992 N24 Re12.0008 S32 -","4","0.25","","Lappi, Tatiana I.; Gaifulin, Yakov M.; Sukhikh, Taisiya S.; Gaifulina, Viktoria K.; Yanshole, Vadim V.; Cordier, Stephane; Naumov, Nikolay G.","Molecular heterometallic clusters [Re6−xMoxS8L6] (x = 2–3, L = py, etpy, tbp): negligible influence of the x value on the crystal structures","CrystEngComm","2024","26","12","1720","1729","10.1039/D3CE01229H","","","0.71073","MoKα","","0.0417","0.0245","","","0.0456","0.0516","","","","","","1.033","","","","has coordinates,has disorder","290908","2024-04-04","23:12:33",""
"7248264","14.2615","0.0004","14.2615","0.0004","24.4091","0.001","90","","90","","90","","4964.6","0.3","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C42 H54 Mo2 N6 Re4 S8 -","- C42 H54 Mo2 N6 Re4 S8 -","- C168 H216 Mo8 N24 Re16 S32 -","4","0.25","","Lappi, Tatiana I.; Gaifulin, Yakov M.; Sukhikh, Taisiya S.; Gaifulina, Viktoria K.; Yanshole, Vadim V.; Cordier, Stephane; Naumov, Nikolay G.","Molecular heterometallic clusters [Re6−xMoxS8L6] (x = 2–3, L = py, etpy, tbp): negligible influence of the x value on the crystal structures","CrystEngComm","2024","26","12","1720","1729","10.1039/D3CE01229H","","","0.71073","MoKα","","0.0414","0.0218","","","0.04","0.0445","","","","","","1.055","","","","has coordinates,has disorder","290908","2024-04-04","23:12:33",""
"7700885","13.35","0.005","13.35","0.005","13.662","0.01","90","","90","","90","","2435","2","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Cs Li O6 P2 -","- Cs Li O6 P2 -","- Cs16 Li16 O96 P32 -","16","1","","Sun, Jun; Wu, Hongping; Mutailipu, Miriding; Yang, Zhihua; Pan, Shilie","Structural insights into three phosphates with distinct polyanionic configurations.","Dalton transactions (Cambridge, England : 2003)","2019","48","35","13406","13412","10.1039/c9dt02842k","","","0.71073","MoKα","","0.0334","0.0257","","","0.052","0.0545","","","","","","1.111","","","","has coordinates","224494","2020-10-21","18:00:00",""
"7701491","28.1585","0.0017","28.1585","0.0017","13.456","0.0016","90","","90","","90","","10669.3","1.6","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24 H26 Ca N4 O9 -","- C21 H19 Ca N3 O8 -","- C336 H304 Ca16 N48 O128 -","16","1","","You, Ming-Hua; Li, Meng-Hua; Li, Hao-Hong; Chen, Yong; Lin, Mei-Jin","The impact of metal cations on photochemical properties of hybrid heterostructures with infinite alkaline-earth metal oxide clusters","Dalton Transactions","2019","","","","","10.1039/C9DT04104D","","","0.71073","MoKα","","0.1356","0.0702","","","0.154","0.1773","","","","","","0.992","","","","has coordinates","223277","2020-10-21","18:00:00",""
"7701492","28.614","0.004","28.614","0.004","13.749","0.003","90","","90","","90","","11257","3","293.15","","293.15","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24 H26 N4 O9 Sr -","- C21 H19 N3 O8 Sr -","- C336 H304 N48 O128 Sr16 -","16","1","","You, Ming-Hua; Li, Meng-Hua; Li, Hao-Hong; Chen, Yong; Lin, Mei-Jin","The impact of metal cations on photochemical properties of hybrid heterostructures with infinite alkaline-earth metal oxide clusters","Dalton Transactions","2019","","","","","10.1039/C9DT04104D","","","0.71073","MoKα","","0.0869","0.0563","","","0.1491","0.1652","","","","","","1.029","","","","has coordinates","223277","2020-10-21","18:00:00",""
"7701523","16.2618","0.0003","16.2618","0.0003","35.9463","0.0016","90","","90","","90","","9505.9","0.5","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C52 H72 N2 Ni O4 -","- C52 H72 N2 Ni O4 -","- C416 H576 N16 Ni8 O32 -","8","0.5","","Bubnov, Michael P.; Cherkasov, Vladimir K.; Teplova, Irina A.; Druzhkov, Nickolay O.; Grishin, Ivan D.; Baranov, Evgenii V.; Bogomyakov, Artem S.; Abakumov, Gleb A.","Novel dioxolene nickel complexes with sterically hindered diazabutadienes. Coupling of aza-ligands coordinated to nickel.","Dalton transactions (Cambridge, England : 2003)","2019","48","28","10516","10525","10.1039/c9dt01309a","","","0.71073","MoKα","","0.0417","0.0336","","","0.0815","0.0863","","","","","","1.01","","","","has coordinates,has disorder","223295","2020-10-21","18:00:00",""
"7701652","18.7656","0.0003","18.7656","0.0003","32.6336","0.0005","90","","90","","90","","11491.8","0.3","120","2","120","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C30 H46 B N P2 -","- C30 H46 B N P2 -","- C480 H736 B16 N16 P32 -","16","1","","Ordyszewska, Anna; Szynkiewicz, Natalia; Perzanowski, Emil; Chojnacki, Jarosław; Wiśniewska, Aleksandra; Grubba, Rafał","Structural and spectroscopic analysis of a new family of monomeric diphosphinoboranes.","Dalton transactions (Cambridge, England : 2003)","2019","48","33","12482","12495","10.1039/c9dt02195g","","","0.71073","MoKα","","0.0813","0.0635","","","0.1581","0.1726","","","","","","1.04","","","","has coordinates","223326","2020-10-21","18:00:00",""
"7701653","13.984","0.002","13.984","0.002","37.261","0.006","90","","90","","90","","7286.5","1.9","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C66 H78 N18 O14 Pd4 S4 -","- C66 H78 N18 O14 Pd4 S4 -","- C264 H312 N72 O56 Pd16 S16 -","4","0.25","","Kalaiarasi, G.; Dharani, S.; Lynch, V. M.; Prabhakaran, R.","para metallation of 3-acetyl-chromen-2-one Schiff bases in tetranuclear palladacycles: focus on their biomolecular interaction and in vitro cytotoxicity.","Dalton transactions (Cambridge, England : 2003)","2019","48","33","12496","12511","10.1039/c9dt02663k","","","0.71073","MoKα","","0.0827","0.0573","","","0.115","0.1244","","","","","","1.055","","","","has coordinates,has disorder","223327","2020-10-21","18:00:00",""
"7701654","14.391","0.0017","14.391","0.0017","36.358","0.004","90","","90","","90","","7529.8","1.5","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C52 H44 N12 O8 Pd4 S4 -","- C52 H44 N12 O8 Pd4 S4 -","- C208 H176 N48 O32 Pd16 S16 -","4","0.25","","Kalaiarasi, G.; Dharani, S.; Lynch, V. M.; Prabhakaran, R.","para metallation of 3-acetyl-chromen-2-one Schiff bases in tetranuclear palladacycles: focus on their biomolecular interaction and in vitro cytotoxicity.","Dalton transactions (Cambridge, England : 2003)","2019","48","33","12496","12511","10.1039/c9dt02663k","","","0.71073","MoKα","","0.0847","0.066","","","0.106","0.112","","","","","","1.066","","","","has coordinates","223327","2020-10-21","18:00:00",""
"7701665","21.202","0.005","21.202","0.005","31.436","0.008","90","","90","","90","","14131","6","90.15","","90.15","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C26 H44 N4 O6 P2 Ti -","- C26 H46 N4 O6 P2 Ti -","- C416 H736 N64 O96 P32 Ti16 -","16","1","","Perry, Mitchell R.; Gilmour, Damon J.; Schafer, Laurel L.","Mono, bis, and tris(phosphoramidate) titanium complexes: synthesis, structure, and reactivity investigations.","Dalton transactions (Cambridge, England : 2003)","2019","48","26","9782","9790","10.1039/c9dt00911f","","","0.71073","MoKα","","0.0708","0.0517","","","0.1227","0.1358","","","","","","1.021","","","","has coordinates,has disorder","223329","2020-10-21","18:00:00",""
"7701687","23.7152","0.0008","23.7152","0.0008","31.4568","0.0012","90","","90","","90","","17691.6","1.1","100","","100","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C103 H116 As4 N4 Pb2 -","- C96 H108 As4 N4 Pb2 -","- C768 H864 As32 N32 Pb16 -","8","0.5","","Chen, Xiao; Gamer, Michael T.; Roesky, Peter W.","Synthesis and structural characterization of arsinoamides - early transition metal (Zr and Hf) and main group metal (Al, In, Sn, and Pb) complexes.","Dalton transactions (Cambridge, England : 2003)","2019","48","40","15207","15211","10.1039/c9dt03472b","","","0.71073","MoKα","","0.0969","0.0582","","","0.1391","0.162","","","","","","1.036","","","","has coordinates","223335","2020-10-21","18:00:00",""
"7701688","23.6642","0.0005","23.6642","0.0005","31.7406","0.0008","90","","90","","90","","17774.6","0.7","100","","100","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C101 H120 As4 N4 Sn2 -","- C101 H120 As4 N4 Sn2 -","- C808 H960 As32 N32 Sn16 -","8","0.5","","Chen, Xiao; Gamer, Michael T.; Roesky, Peter W.","Synthesis and structural characterization of arsinoamides - early transition metal (Zr and Hf) and main group metal (Al, In, Sn, and Pb) complexes.","Dalton transactions (Cambridge, England : 2003)","2019","48","40","15207","15211","10.1039/c9dt03472b","","","0.71073","MoKα","","0.1052","0.0539","","","0.1158","0.1352","","","","","","0.985","","","","has coordinates,has disorder","223335","2020-10-21","18:00:00",""
"7701710","42.2093","0.0012","42.2093","0.0012","13.867","0.0005","90","","90","","90","","24705.8","1.3","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C62.5 H89 B2 Ge N7 O2 -","- C62.5 H89 B2 Ge N7 O2 -","- C1000 H1424 B32 Ge16 N112 O32 -","16","1","","Kristinsdóttir, Lilja; Oldroyd, Nicola L.; Grabiner, Rachel; Knights, Alastair W.; Heilmann, Andreas; Protchenko, Andrey V.; Niu, Haoyu; Kolychev, Eugene L.; Campos, Jesús; Hicks, Jamie; Christensen, Kirsten E.; Aldridge, Simon","Synthetic, structural and reaction chemistry of N-heterocyclic germylene and stannylene compounds featuring N-boryl substituents.","Dalton transactions (Cambridge, England : 2003)","2019","48","31","11951","11960","10.1039/c9dt02449b","","","1.54184","CuKα","","0.0733","0.052","","","0.1384","0.1527","","","","","","1.04","","","","has coordinates,has disorder","223342","2020-10-21","18:00:00",""
"7701819","16.4591","0.0003","16.4591","0.0003","25.0804","0.0006","90","","90","","90","","6794.3","0.2","120","2","120","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Catena-[2-amino-4,6-(pyrazol-1-yl)pyrimidine]-di-isoselenocyanato iron(II)","","- C12 H9 Fe N9 Se2 -","- C12 H9 Fe N9 Se2 -","- C192 H144 Fe16 N144 Se32 -","16","1","","Capel Berdiell, Izar; Farmiloe, Sarah E.; Kulmaczewski, Rafal; Halcrow, Malcolm","Molecular Squares, Coordination Polymers and Mononuclear Complexes Supported by 2,4-Dipyrazolyl-6H-1,3,5-triazine and 4,6-Dipyrazolylpyrimidine Ligands","Dalton Transactions","2019","","","","","10.1039/C9DT04003J","","","1.54184","CuKα","","0.0671","0.0462","","","0.1146","0.1276","","","","","","1.012","","","","has coordinates","223398","2020-10-21","18:00:00",""
"7701821","16.1912","0.0006","16.1912","0.0006","25.146","0.003","90","","90","","90","","6592.1","0.9","120","2","120","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Catena-[2-methyl-4,6-(pyrazol-1-yl)pyrimidine]-di-isothiocyanato iron(II)","","- C13 H10 Fe N8 S2 -","- C13 H10 Fe N8 S2 -","- C208 H160 Fe16 N128 S32 -","16","1","","Capel Berdiell, Izar; Farmiloe, Sarah E.; Kulmaczewski, Rafal; Halcrow, Malcolm","Molecular Squares, Coordination Polymers and Mononuclear Complexes Supported by 2,4-Dipyrazolyl-6H-1,3,5-triazine and 4,6-Dipyrazolylpyrimidine Ligands","Dalton Transactions","2019","","","","","10.1039/C9DT04003J","","","1.54184","CuKα","","0.0633","0.0558","","","0.1506","0.1565","","","","","","1.076","","","","has coordinates","223398","2020-10-21","18:00:00",""
"7701824","16.0404","0.0002","16.0404","0.0002","25.1086","0.0003","90","","90","","90","","6460.3","0.14","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Catena-[2-amino-4,6-(pyrazol-1-yl)pyrimidine]-di-isothiocyanato iron(II)","","- C12 H9 Fe N9 S2 -","- C12 H9 Fe N9 S2 -","- C192 H144 Fe16 N144 S32 -","16","1","","Capel Berdiell, Izar; Farmiloe, Sarah E.; Kulmaczewski, Rafal; Halcrow, Malcolm","Molecular Squares, Coordination Polymers and Mononuclear Complexes Supported by 2,4-Dipyrazolyl-6H-1,3,5-triazine and 4,6-Dipyrazolylpyrimidine Ligands","Dalton Transactions","2019","","","","","10.1039/C9DT04003J","","","0.6889","synchrotron","","0.1067","0.0558","","","0.1533","0.1753","","","","","","0.904","","","","has coordinates","223398","2020-10-21","18:00:00",""
"7702104","9.9381","0.0002","9.9381","0.0002","26.2651","0.0011","90","","90","","90","","2594.09","0.13","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C5 H12 Cl4 Nb Se2 -","- C5 H12 Cl4 Nb Se2 -","- C40 H96 Cl32 Nb8 Se16 -","8","0.5","","Chang, Yao-Pang; Levason, William; Light, Mark E.; Reid, Gillian","Niobium tetrachloride complexes with thio-, seleno- and telluro-ether coordination - synthesis and structures.","Dalton transactions (Cambridge, England : 2003)","2016","45","41","16262","16274","10.1039/c6dt02979e","","","0.71073","MoKα","","0.0302","0.0281","","","0.0689","0.0697","","","","","","1.049","","","","has coordinates","234753","2020-10-21","18:00:00",""
"7702258","24.6811","0.0007","24.6811","0.0007","19.4321","0.0007","90","","90","","90","","11837.2","0.6","150","2","150","2","","","","","","","","9","I 41/a :2","-I 4ad","88","","","","- C56 H60 Br2 Cl6 Fe2 N2 O2 P2 Pd -","- C56 H60 Br2 Cl6 Fe2 N2 O2 P2 Pd -","- C448 H480 Br16 Cl48 Fe16 N16 O16 P16 Pd8 -","8","0.5","","Horký, Filip; Škoch, Karel; Císařová, Ivana; Štěpnička, Petr","Versatile coordination and C-H activation of a multi-donor phosphinoferrocene carboxamide ligand in Pd(ii) complexes.","Dalton transactions (Cambridge, England : 2003)","2019","48","43","16412","16425","10.1039/c9dt03646f","","","0.71073","MoKα","","0.0927","0.0515","","","0.1208","0.1413","","","","","","1.016","","","","has coordinates","237903","2020-10-21","18:00:00",""
"7702687","15.2801","0.001","15.2801","0.001","45.333","0.007","90","","90","","90","","10584.4","1.9","144","2","144","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C25 H23 B Mn N6 O3 Tl -","- C25 H17 B Mn N6 O3 Tl -","- C400 H272 B16 Mn16 N96 O48 Tl16 -","16","1","","Guo, ShengLi; Bats, Jan W.; Bolte, Michael; Wagner, Matthias","Tl(i) complexes of cymantrene-based tris(1-pyrazolyl)borates: polymers and macrocycles","Journal of the Chemical Society, Dalton Transactions","2001","","24","3572","","10.1039/b105692c","","","0.71073","MoKα","","0.1703","0.0873","","","0.1997","0.2182","","","","","","1.825","","","","has coordinates,has disorder","243951","2020-10-21","18:00:00",""
"7702754","11.578","0.001","11.578","0.001","25.391","0.004","90","","90","","90","","3403.7","0.7","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","'Oxonium bis(chloranilate)yttrate.solvate'","","- C20 H35 Cl4 O17 Y -","- C12 Cl4 O12.44 Y -","- C48 Cl16 O49.76 Y4 -","4","0.25","","Abrahams, Brendan F.; Coleiro, Joseph; Ha, Karen; Hoskins, Bernard F.; Orchard, Simon D.; Robson, Richard","Dihydroxybenzoquinone and chloranilic acid derivatives of rare earth metals","Journal of the Chemical Society, Dalton Transactions","2002","","8","1586","","10.1039/b109296k","","","1.5418","CuKα","","0.1392","0.0808","","0.2721","0.2025","","","","1.047","1.126","1.126","","","","","has coordinates","243998","2020-10-21","18:00:00",""
"7702861","28.213","0.0017","28.213","0.0017","30.107","0.003","90","","90","","90","","23964","3","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C45 H65 N11 O16 Tb2 -","- C45 H63 N11 O16 Tb2 -","- C720 H1008 N176 O256 Tb32 -","16","1","","Avecilla, Fernando; Platas-Iglesias, Carlos; Rodríguez-Cortiñas, Raquel; Guillemot, Geoffroy; Bünzli, Jean-Claude G.; Brondino, Carlos D.; Geraldes, Carlos F. G. C.; Blas, Andrés de; Rodríguez-Blas, Teresa","Structural characterisation, EPR and magnetic properties of f‒f and f‒d lanthanide(iii) phenolic cryptates","Journal of the Chemical Society, Dalton Transactions","2002","","24","4658","","10.1039/b206615g","","","0.71073","MoKα","","0.0978","0.0608","","","0.1662","0.2017","","","","","","1.094","","","","has coordinates,has disorder","244052","2020-10-21","18:00:00",""
"7702879","19.5123","0.0011","19.5123","0.0011","11.9438","0.0007","90","","90","","90","","4547.4","0.4","213","2","213","2","","","","","","","","5","I 41/a :2","-I 4ad","88","Molybdenum(VI) oxide complex with 5-(4-(1,2,4-triazol-4- yl)phenyl)tetrazole","Molybdenum(VI) oxide complex with 5-[4-(1,2,4-triazol-4-yl)phenyl]tetrazole","","- C9 H7 Mo N7 O3 -","- C9 H7 Mo N7 O3 -","- C144 H112 Mo16 N112 O48 -","16","1","","Lysenko, Andrey B.; Senchyk, Ganna A.; Lincke, Jörg; Lässig, Daniel; Fokin, Andrey A.; Butova, Ekaterina D.; Schreiner, Peter R.; Krautscheid, Harald; Domasevitch, Konstantin V.","Metal oxide-organic frameworks (MOOFs), a new series of coordination hybrids constructed from molybdenum(VI) oxide and bitopic 1,2,4-triazole linkers.","Dalton transactions (Cambridge, England : 2003)","2010","39","17","4223","4231","10.1039/b922732f","","","0.71073","MoKα","","0.0343","0.0273","","","0.0701","0.0727","","","","","","1.029","","","","has coordinates","244083","2020-10-21","18:00:00",""
"7702952","21.6406","0.0017","21.6406","0.0017","15.3192","0.0015","90","","90","","90","","7174.2","1.1","100","","100","","","","","","","","","6","I 41/a :2","-I 4ad","88","","tetra-(μ^3^-iodo)-tetrakis(10-(o-methoxyphenyl)phenoxarsine)copper(I)","","- C19 H15 As Cu I O2 -","- C19 H15 As Cu I O2 -","- C304 H240 As16 Cu16 I16 O32 -","16","1","","Galimova, Milyausha F.; Zueva, Ekaterina M.; Dobrynin, Alexey B.; Samigullina, Aida I.; Musin, Rustem R.; Musina, Elvira I.; Karasik, Andrey A.","Cu<sub>4</sub>I<sub>4</sub>-cubane clusters based on 10-(aryl)phenoxarsines and their luminescence.","Dalton transactions (Cambridge, England : 2003)","2020","49","2","482","491","10.1039/c9dt04122b","","","0.71073","MoKα","","0.0843","0.046","","","0.1089","0.1411","","","","","","1.039","","","","has coordinates","247730","2020-10-21","18:00:00",""
"7703358","31.7219","0.0012","31.7219","0.0012","15.9319","0.0007","90","","90","","90","","16031.9","1.1","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C66 H70 O36 P2 Ti6 Zn2 -","- C66 H70 O36 P2 Ti6 Zn2 -","- C528 H560 O288 P16 Ti48 Zn16 -","8","0.5","","Zhang, Kai; Lin, Ping; Du, Shao-Wu","Facile and scalable synthesis of Ti<sub>6</sub>Mn<sub>2</sub> oxo-cluster nanocrystals with flower-like morphology and excellent photocatalytic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","8","2444","2451","10.1039/c9dt04886c","","","0.71073","MoKα","","0.0777","0.0734","","","0.1973","0.2005","","","","","","1.171","","","","has coordinates,has disorder","248911","2020-10-21","18:00:00",""
"7703793","32.8106","0.0006","32.8106","0.0006","31.0827","0.0009","90","","90","","90","","33461.6","1.3","173","","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C92 H91 Cl2 Co N3 -","- C92 H91 Cl2 Co N3 -","- C1472 H1456 Cl32 Co16 N48 -","16","1","","Han, Mingyang; Zhang, Qiuyue; Oleynik, Ivan I.; Suo, Hongyi; Solan, Gregory A.; Oleynik, Irina V.; Ma, Yanping; Liang, Tongling; Sun, Wen-Hua","High molecular weight polyethylenes of narrow dispersity promoted using bis(arylimino)cyclohepta[b]pyridine-cobalt catalysts ortho-substituted with benzhydryl & cycloalkyl groups.","Dalton transactions (Cambridge, England : 2003)","2020","49","15","4774","4784","10.1039/d0dt00576b","","","0.71073","MoKα","","0.203","0.1079","","","0.2453","0.3005","","","","","","1.029","","","","has coordinates,has disorder","251666","2020-10-21","18:00:00",""
"7703981","28.6963","0.0003","28.6963","0.0003","33.2864","0.0006","90","","90","","90","","27410.6","0.6","223","2","223.15","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C63 H102 La N3 O6.5 -","- C63 H102 La N3 O6.5 -","- C1008 H1632 La16 N48 O104 -","16","1","","Shao, Jingjing; Zhou, Hairong; Wang, Yaorong; Luo, Yunjie; Yao, Yingming","Lanthanum complexes stabilized by a pentadentate Schiff-base ligand: synthesis, characterization, and reactivity in statistical copolymerization of ε-caprolactone and l-lactide.","Dalton transactions (Cambridge, England : 2003)","2020","49","18","5842","5850","10.1039/d0dt00179a","","","0.71073","MoKα","","0.0724","0.0464","","","0.1174","0.1392","","","","","","1.104","","","","has coordinates,has disorder","252813","2020-10-21","18:00:00",""
"7704327","36.8408","0.0013","36.8408","0.0013","14.839","0.001","90","","90","","90","","20140.2","1.7","150","2","150","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C196 H186 Cl4 Dy4 N40 O13 S8 -","- C136 H118 Cl4 Dy4 N28 O13 S8 -","- C544 H472 Cl16 Dy16 N112 O52 S32 -","4","0.25","","Salinas-Uber, Jorge; Barrios, Leoní A; Roubeau, Olivier; Aromí, Guillem","Two [Ln<sub>4</sub>] molecular rings folded as compact tetrahedra.","Dalton transactions (Cambridge, England : 2003)","2020","49","21","7182","7188","10.1039/d0dt01259a","","","0.71073","MoKα","","0.1113","0.0798","","","0.1783","0.1946","","","","","","1.058","","","","has coordinates,has disorder","252841","2020-10-21","18:00:00",""
"7704328","36.883","0.0014","36.883","0.0014","14.7878","0.0007","90","","90","","90","","20116.7","1.4","100","2","100","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C178 H174 Cl4 N36 O15 S8 Tb4 -","- C168 H148 Cl4 N34 O15 S8 Tb4 -","- C672 H592 Cl16 N136 O60 S32 Tb16 -","4","0.25","","Salinas-Uber, Jorge; Barrios, Leoní A; Roubeau, Olivier; Aromí, Guillem","Two [Ln<sub>4</sub>] molecular rings folded as compact tetrahedra.","Dalton transactions (Cambridge, England : 2003)","2020","49","21","7182","7188","10.1039/d0dt01259a","","","0.7749","synchrotron","","0.0913","0.0722","","","0.1849","0.2065","","","","","","1.04","","","","has coordinates,has disorder","252841","2020-10-21","18:00:00",""
"7704452","11.5433","0.0004","11.5433","0.0004","11.4136","0.0004","90","","90","","90","","1520.84","0.09","299","2","299","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","pentasodium bismuth tetratungstate","","- Bi Na5 O16 W4 -","- Bi Na5 O16 W4 -","- Bi4 Na20 O64 W16 -","4","0.25","","Hämmer, Matthias; Janka, Oliver; Bönnighausen, Judith; Klenner, Steffen; Pöttgen, Rainer; Höppe, Henning A","On the phosphors Na<sub>5</sub>M(WO<sub>4</sub>)<sub>4</sub> (M = Y, La-Nd, Sm-Lu, Bi) - crystal structures, thermal decomposition, and optical and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8209","8225","10.1039/d0dt00782j","","","0.71073","MoKα","","0.025","0.0181","","","0.0297","0.0307","","","","","","1.069","","","","has coordinates","253859","2020-10-21","18:00:00",""
"7704453","11.5765","0.0002","11.5765","0.0002","11.4797","0.0002","90","","90","","90","","1538.46","0.05","300","2","300","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","pentasodium praseodymium tetratungstate","","- Na5 O16 Pr W4 -","- Na5 O16 Pr W4 -","- Na20 O64 Pr4 W16 -","4","0.25","","Hämmer, Matthias; Janka, Oliver; Bönnighausen, Judith; Klenner, Steffen; Pöttgen, Rainer; Höppe, Henning A","On the phosphors Na<sub>5</sub>M(WO<sub>4</sub>)<sub>4</sub> (M = Y, La-Nd, Sm-Lu, Bi) - crystal structures, thermal decomposition, and optical and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8209","8225","10.1039/d0dt00782j","","","0.71073","MoKα","","0.024","0.018","","","0.0289","0.0298","","","","","","1.076","","","","has coordinates","253859","2020-10-21","18:00:00",""
"7704454","11.469","0.0005","11.469","0.0005","11.3791","0.0006","90","","90","","90","","1496.78","0.12","300","2","300","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","pentasodium terbium tetratungstate","","- Na5 O16 Tb W4 -","- Na5 O16 Tb W4 -","- Na20 O64 Tb4 W16 -","4","0.25","","Hämmer, Matthias; Janka, Oliver; Bönnighausen, Judith; Klenner, Steffen; Pöttgen, Rainer; Höppe, Henning A","On the phosphors Na<sub>5</sub>M(WO<sub>4</sub>)<sub>4</sub> (M = Y, La-Nd, Sm-Lu, Bi) - crystal structures, thermal decomposition, and optical and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8209","8225","10.1039/d0dt00782j","","","0.71073","MoKα","","0.0282","0.0207","","","0.039","0.04","","","","","","1.095","","","","has coordinates","253859","2020-10-21","18:00:00",""
"7704455","11.4681","0.0004","11.4681","0.0004","11.3759","0.0004","90","","90","","90","","1496.13","0.09","300","2","300","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- Eu0.51 Na5 O16 W4 Y0.49 -","- Eu0.511 Na5 O16 W4 Y0.489 -","- Eu2.044 Na20 O64 W16 Y1.956 -","4","0.25","","Hämmer, Matthias; Janka, Oliver; Bönnighausen, Judith; Klenner, Steffen; Pöttgen, Rainer; Höppe, Henning A","On the phosphors Na<sub>5</sub>M(WO<sub>4</sub>)<sub>4</sub> (M = Y, La-Nd, Sm-Lu, Bi) - crystal structures, thermal decomposition, and optical and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8209","8225","10.1039/d0dt00782j","","","0.71073","MoKα","","0.0271","0.019","","","0.0312","0.0325","","","","","","1.054","","","","has coordinates,has disorder","253859","2020-10-21","18:00:00",""
"7704456","11.4602","0.0002","11.4602","0.0002","11.3678","0.0003","90","","90","","90","","1493","0.05","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- Na5 O16 Tb0.51 W4 Y0.49 -","- Na5 O16 Tb0.514 W4 Y0.486 -","- Na20 O64 Tb2.056 W16 Y1.944 -","4","0.25","","Hämmer, Matthias; Janka, Oliver; Bönnighausen, Judith; Klenner, Steffen; Pöttgen, Rainer; Höppe, Henning A","On the phosphors Na<sub>5</sub>M(WO<sub>4</sub>)<sub>4</sub> (M = Y, La-Nd, Sm-Lu, Bi) - crystal structures, thermal decomposition, and optical and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8209","8225","10.1039/d0dt00782j","","","0.71073","MoKα","","0.021","0.0167","","","0.0305","0.0311","","","","","","1.113","","","","has coordinates,has disorder","253859","2020-10-21","18:00:00",""
"7704457","5.2624","0.0001","5.2624","0.0001","11.4078","0.0003","90","","90","","90","","315.915","0.012","298","2","298","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Eu Na O8 W2 -","- Eu0.964 Na1.036 O8 W2 -","- Eu1.928 Na2.072 O16 W4 -","2","0.125","","Hämmer, Matthias; Janka, Oliver; Bönnighausen, Judith; Klenner, Steffen; Pöttgen, Rainer; Höppe, Henning A","On the phosphors Na<sub>5</sub>M(WO<sub>4</sub>)<sub>4</sub> (M = Y, La-Nd, Sm-Lu, Bi) - crystal structures, thermal decomposition, and optical and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8209","8225","10.1039/d0dt00782j","","","0.71073","MoKα","","0.018","0.0143","","","0.0329","0.034","","","","","","1.12","","","","has coordinates,has disorder","253859","2020-10-21","18:00:00",""
"7704458","11.3965","0.001","11.3965","0.001","11.2932","0.0011","90","","90","","90","","1466.8","0.2","297","2","297","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","pentasodium ytterbium tetratungstate","","- Na5 O16 W4 Yb -","- Na5 O16 W4 Yb -","- Na20 O64 W16 Yb4 -","4","0.25","","Hämmer, Matthias; Janka, Oliver; Bönnighausen, Judith; Klenner, Steffen; Pöttgen, Rainer; Höppe, Henning A","On the phosphors Na<sub>5</sub>M(WO<sub>4</sub>)<sub>4</sub> (M = Y, La-Nd, Sm-Lu, Bi) - crystal structures, thermal decomposition, and optical and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8209","8225","10.1039/d0dt00782j","","","0.71073","MoKα","","0.03","0.0208","","","0.0376","0.0391","","","","","","1.049","","","","has coordinates","253859","2020-10-21","18:00:00",""
"7704459","11.5161","0.0004","11.5161","0.0004","11.4231","0.0004","90","","90","","90","","1514.94","0.09","298","2","298","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","pentasodium samarium tetratungstate","","- Na5 O16 Sm W4 -","- Na5 O16 Sm W4 -","- Na20 O64 Sm4 W16 -","4","0.25","","Hämmer, Matthias; Janka, Oliver; Bönnighausen, Judith; Klenner, Steffen; Pöttgen, Rainer; Höppe, Henning A","On the phosphors Na<sub>5</sub>M(WO<sub>4</sub>)<sub>4</sub> (M = Y, La-Nd, Sm-Lu, Bi) - crystal structures, thermal decomposition, and optical and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8209","8225","10.1039/d0dt00782j","","","0.71073","MoKα","","0.023","0.0174","","","0.0313","0.0321","","","","","","1.038","","","","has coordinates","253859","2020-10-21","18:00:00",""
"7704460","11.4998","0.0004","11.4998","0.0004","11.4061","0.0004","90","","90","","90","","1508.4","0.09","301","2","301","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","pentasodium europium tetratungstate","","- Eu Na5 O16 W4 -","- Eu Na5 O16 W4 -","- Eu4 Na20 O64 W16 -","4","0.25","","Hämmer, Matthias; Janka, Oliver; Bönnighausen, Judith; Klenner, Steffen; Pöttgen, Rainer; Höppe, Henning A","On the phosphors Na<sub>5</sub>M(WO<sub>4</sub>)<sub>4</sub> (M = Y, La-Nd, Sm-Lu, Bi) - crystal structures, thermal decomposition, and optical and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8209","8225","10.1039/d0dt00782j","","","0.71073","MoKα","","0.0258","0.0181","","","0.0347","0.0356","","","","","","1.025","","","","has coordinates","253859","2020-10-21","18:00:00",""
"7704461","11.4796","0.0004","11.4796","0.0004","11.3779","0.0004","90","","90","","90","","1499.39","0.09","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","pentasodium gadolinium tetratungstate","","- Gd Na5 O16 W4 -","- Gd Na5 O16 W4 -","- Gd4 Na20 O64 W16 -","4","0.25","","Hämmer, Matthias; Janka, Oliver; Bönnighausen, Judith; Klenner, Steffen; Pöttgen, Rainer; Höppe, Henning A","On the phosphors Na<sub>5</sub>M(WO<sub>4</sub>)<sub>4</sub> (M = Y, La-Nd, Sm-Lu, Bi) - crystal structures, thermal decomposition, and optical and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8209","8225","10.1039/d0dt00782j","","","0.71073","MoKα","","0.0243","0.0182","","","0.0341","0.0349","","","","","","1.081","","","","has coordinates","253859","2020-10-21","18:00:00",""
"7704462","11.3999","0.0006","11.3999","0.0006","11.2985","0.0006","90","","90","","90","","1468.33","0.13","299","2","299","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","pentasodium thulium tetratungstate","","- Na5 O16 Tm W4 -","- Na5 O16 Tm W4 -","- Na20 O64 Tm4 W16 -","4","0.25","","Hämmer, Matthias; Janka, Oliver; Bönnighausen, Judith; Klenner, Steffen; Pöttgen, Rainer; Höppe, Henning A","On the phosphors Na<sub>5</sub>M(WO<sub>4</sub>)<sub>4</sub> (M = Y, La-Nd, Sm-Lu, Bi) - crystal structures, thermal decomposition, and optical and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8209","8225","10.1039/d0dt00782j","","","0.71073","MoKα","","0.0266","0.0195","","","0.0352","0.0363","","","","","","1.076","","","","has coordinates","253859","2020-10-21","18:00:00",""
"7704463","11.4399","0.0004","11.4399","0.0004","11.3469","0.0005","90","","90","","90","","1484.98","0.1","298","2","298","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","pentasodium holmium tetratungstate","","- Ho Na5 O16 W4 -","- Ho Na5 O16 W4 -","- Ho4 Na20 O64 W16 -","4","0.25","","Hämmer, Matthias; Janka, Oliver; Bönnighausen, Judith; Klenner, Steffen; Pöttgen, Rainer; Höppe, Henning A","On the phosphors Na<sub>5</sub>M(WO<sub>4</sub>)<sub>4</sub> (M = Y, La-Nd, Sm-Lu, Bi) - crystal structures, thermal decomposition, and optical and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8209","8225","10.1039/d0dt00782j","","","0.71073","MoKα","","0.0252","0.0188","","","0.0344","0.0354","","","","","","1.086","","","","has coordinates","253859","2020-10-21","18:00:00",""
"7704464","11.38701","0.00012","11.38701","0.00012","11.28231","0.00013","90","","90","","90","","1462.91","0.03","300","3","300","3","","","","","","","","4","I 41/a :2","-I 4ad","88","","pentasodium lutetium tetratungstate","Na5Lu(WO4)4","- Lu Na5 O16 W4 -","- Lu Na5 O16 W4 -","- Lu4 Na20 O64 W16 -","4","0.25","","Hämmer, Matthias; Janka, Oliver; Bönnighausen, Judith; Klenner, Steffen; Pöttgen, Rainer; Höppe, Henning A","On the phosphors Na<sub>5</sub>M(WO<sub>4</sub>)<sub>4</sub> (M = Y, La-Nd, Sm-Lu, Bi) - crystal structures, thermal decomposition, and optical and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8209","8225","10.1039/d0dt00782j","powder diffraction","","1.54184","CuKα","","","","","","","","","0.0163","","","","","","","","has coordinates","253859","2020-10-21","18:00:00",""
"7704465","11.5857","0.0003","11.5857","0.0003","11.5247","0.0004","90","","90","","90","","1546.94","0.08","301","2","301","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","pentasodium cerium tetratungstate","","- Ce Na5 O16 W4 -","- Ce Na5 O16 W4 -","- Ce4 Na20 O64 W16 -","4","0.25","","Hämmer, Matthias; Janka, Oliver; Bönnighausen, Judith; Klenner, Steffen; Pöttgen, Rainer; Höppe, Henning A","On the phosphors Na<sub>5</sub>M(WO<sub>4</sub>)<sub>4</sub> (M = Y, La-Nd, Sm-Lu, Bi) - crystal structures, thermal decomposition, and optical and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8209","8225","10.1039/d0dt00782j","","","0.71073","MoKα","","0.0321","0.0302","","","0.0714","0.0719","","","","","","1.342","","","","has coordinates","253859","2020-10-21","18:00:00",""
"7704466","11.63319","0.00011","11.63319","0.00011","11.54299","0.00013","90","","90","","90","","1562.13","0.03","300","3","300","3","","","","","","","","4","I 41/a :2","-I 4ad","88","","pentasodium lanthanum tetratungstate","Na5La(WO4)4","- La Na5 O16 W4 -","- La Na5 O16 W4 -","- La4 Na20 O64 W16 -","4","0.25","","Hämmer, Matthias; Janka, Oliver; Bönnighausen, Judith; Klenner, Steffen; Pöttgen, Rainer; Höppe, Henning A","On the phosphors Na<sub>5</sub>M(WO<sub>4</sub>)<sub>4</sub> (M = Y, La-Nd, Sm-Lu, Bi) - crystal structures, thermal decomposition, and optical and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8209","8225","10.1039/d0dt00782j","powder diffraction","","1.54184","CuKα","","","","","","","","","0.0223","","","","","","","","has coordinates","253859","2020-10-21","18:00:00",""
"7704467","11.5589","0.0004","11.5589","0.0004","11.4722","0.0004","90","","90","","90","","1532.78","0.09","295","2","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","pentasodium neodymium tetratungstate","","- Na5 Nd O16 W4 -","- Na5 Nd O16 W4 -","- Na20 Nd4 O64 W16 -","4","0.25","","Hämmer, Matthias; Janka, Oliver; Bönnighausen, Judith; Klenner, Steffen; Pöttgen, Rainer; Höppe, Henning A","On the phosphors Na<sub>5</sub>M(WO<sub>4</sub>)<sub>4</sub> (M = Y, La-Nd, Sm-Lu, Bi) - crystal structures, thermal decomposition, and optical and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8209","8225","10.1039/d0dt00782j","","","0.71073","MoKα","","0.0322","0.0216","","","0.0351","0.0362","","","","","","1.038","","","","has coordinates","253859","2020-10-21","18:00:00",""
"7704468","11.45626","0.00015","11.45626","0.00015","11.35742","0.00017","90","","90","","90","","1490.61","0.04","300","3","300","3","","","","","","","","4","I 41/a :2","-I 4ad","88","","pentasodium dysprosium tetratungstate","Na5Dy(WO4)4","- Dy Na5 O16 W4 -","- Dy Na5 O16 W4 -","- Dy4 Na20 O64 W16 -","4","0.25","","Hämmer, Matthias; Janka, Oliver; Bönnighausen, Judith; Klenner, Steffen; Pöttgen, Rainer; Höppe, Henning A","On the phosphors Na<sub>5</sub>M(WO<sub>4</sub>)<sub>4</sub> (M = Y, La-Nd, Sm-Lu, Bi) - crystal structures, thermal decomposition, and optical and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8209","8225","10.1039/d0dt00782j","powder diffraction","","1.54184","CuKα","","","","","","","","","0.0152","","","","","","","","has coordinates","253859","2020-10-21","18:00:00",""
"7704469","11.43616","0.00011","11.43616","0.00011","11.34047","0.00012","90","","90","","90","","1483.17","0.03","300","3","300","3","","","","","","","","4","I 41/a :2","-I 4ad","88","","pentasodium yttrium tetratungstate","Na5Y(WO4)4","- Na5 O16 W4 Y -","- Na5 O16 W4 Y -","- Na20 O64 W16 Y4 -","4","0.25","","Hämmer, Matthias; Janka, Oliver; Bönnighausen, Judith; Klenner, Steffen; Pöttgen, Rainer; Höppe, Henning A","On the phosphors Na<sub>5</sub>M(WO<sub>4</sub>)<sub>4</sub> (M = Y, La-Nd, Sm-Lu, Bi) - crystal structures, thermal decomposition, and optical and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8209","8225","10.1039/d0dt00782j","powder diffraction","","1.54184","CuKα","","","","","","","","","0.0169","","","","","","","","has coordinates","253859","2020-10-21","18:00:00",""
"7704470","11.42573","0.00013","11.42573","0.00013","11.32408","0.00014","90","","90","","90","","1478.33","0.03","300","3","300","3","","","","","","","","4","I 41/a :2","-I 4ad","88","","pentasodium erbium tetratungstate","Na5Er(WO4)4","- Er Na5 O16 W4 -","- Er Na5 O16 W4 -","- Er4 Na20 O64 W16 -","4","0.25","","Hämmer, Matthias; Janka, Oliver; Bönnighausen, Judith; Klenner, Steffen; Pöttgen, Rainer; Höppe, Henning A","On the phosphors Na<sub>5</sub>M(WO<sub>4</sub>)<sub>4</sub> (M = Y, La-Nd, Sm-Lu, Bi) - crystal structures, thermal decomposition, and optical and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8209","8225","10.1039/d0dt00782j","powder diffraction","","1.54184","CuKα","","","","","","","","","0.016","","","","","","","","has coordinates","253859","2020-10-21","18:00:00",""
"7704603","41.5083","0.0004","41.5083","0.0004","5.5816","0.0001","90","","90","","90","","9616.8","0.2","129","7","129","7","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C27 H24 N8 S -","- C27 H24 N8 S -","- C432 H384 N128 S16 -","16","1","","Pantalon Juraj, Natalija; Krklec, Marko; Novosel, Tiana; Perić, Berislav; Vianello, Robert; Raić-Malić, Silvana; Kirin, Srećko I","Copper(ii) and zinc(ii) complexes of mono- and bis-1,2,3-triazole-substituted heterocyclic ligands.","Dalton transactions (Cambridge, England : 2003)","2020","49","26","9002","9015","10.1039/d0dt01244k","","","1.54184","CuKα","","0.0638","0.051","","","0.1286","0.1366","","","","","","1.05","","","","has coordinates,has disorder","254984","2020-10-21","18:00:00",""
"7704672","17.3694","0.0014","17.3694","0.0014","43.223","0.006","90","","90","","90","","13040","2","150","2","150","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C156 H126 B4 Co4 N30 -","- C156 H126 B4 Co4 N30 -","- C624 H504 B16 Co16 N120 -","4","0.25","","Guo, Zhilin; Deng, Yi-Fei; Zhang, Yipei; Pikramenou, Zoe; Zhang, Yuan-Zhu","Two azido-bridged [2×2] cobalt(ii) grids featuring single-molecule magnet behaviour.","Dalton transactions (Cambridge, England : 2003)","2020","49","27","9218","9222","10.1039/d0dt01461c","","","0.71073","MoKα","","0.0616","0.0356","","","0.069","0.0761","","","","","","1.032","","","","has coordinates,has disorder","254971","2020-10-21","18:00:00",""
"7704900","40.7539","0.0019","40.7539","0.0019","20.1854","0.0009","90","","90","","90","","33526","3","150","","150","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C83.5 H104 Dy2 N4 O15.5 -","- C83.5 H104 Dy2 N4 O15.5 -","- C1336 H1664 Dy32 N64 O248 -","16","1","","Ke, Hongshan; Yang, Yongsheng; Wei, Wen; Jiang, Youdong; Zhang, Yi-Quan; Xie, Gang; Chen, Sanping","Synergistic effect of mixed ligands on the anisotropy axis of two dinuclear dysprosium complexes.","Dalton transactions (Cambridge, England : 2003)","2020","49","30","10594","10602","10.1039/d0dt02139c","","","0.71073","MoKα","","0.0872","0.0505","","","0.1004","0.1163","","","","","","1.068","","","","has coordinates,has disorder","257529","2020-10-21","18:00:00",""
"7705351","23.2432","0.0012","23.2432","0.0012","11.913","0.0007","90","","90","","90","","6436","0.6","140","2","140","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24 H39.94 Cu N4 O12.96 -","- C24 H39.936 Cu N4 O12.968 -","- C192 H319.488 Cu8 N32 O103.744 -","8","0.5","","Menzel, Saskia; Millan, Simon; Höfert, Simon-Patrick; Nuhnen, Alexander; Gökpinar, Serkan; Schmitz, Alexa; Janiak, Christoph","Increase of network hydrophilicity from sql to lvt supramolecular isomers of Cu-MOFs with the bifunctional 4-(3,5-dimethyl-1<i>H</i>-pyrazol-4-yl)benzoate linker.","Dalton transactions (Cambridge, England : 2003)","2020","49","36","12854","12864","10.1039/d0dt02642e","","","0.71073","MoKα","","0.042","0.0395","","","0.1088","0.1103","","","","","","1.138","","","","has coordinates,has disorder","257540","2020-10-21","18:00:00",""
"7705393","22.352","0.003","22.352","0.003","33.005","0.007","90","","90","","90","","16490","5","200","","200","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C44.5 H56 Cu N2 O2 -","- C44.5 H56 Cu N2 O2 -","- C712 H896 Cu16 N32 O32 -","16","1","","Kunert, R.; Philouze, C.; Berthiol, F.; Jarjayes, O.; Storr, T.; Thomas, F.","Distorted copper(ii) radicals with sterically hindered salens: electronic structure and aerobic oxidation of alcohols.","Dalton transactions (Cambridge, England : 2003)","2020","49","37","12990","13002","10.1039/d0dt02524k","","x-ray","0.71073","MoKα","","0.1204","0.0593","","","0.1434","0.172","","","","","","1.08","","","","has coordinates,has disorder","257507","2020-10-21","18:00:00",""
"7705568","16.793","0.0007","16.793","0.0007","27.809","0.003","90","","90","","90","","7842.3","1","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C66 H62 Cl8 N6 O14 P4 Zn5 -","- C66 H62 Cl8 N6 O14 P4 Zn5 -","- C264 H248 Cl32 N24 O56 P16 Zn20 -","4","0.25","","Liu, Ai-Ju; Han, Yue; Xu, Fei; Han, Song-De; Pan, Jie; Wang, Guo-Ming","Coordinate bond- and hydrogen bond-assisted electron transfer strategy towards the generation of photochromic metal phosphites.","Dalton transactions (Cambridge, England : 2003)","2020","49","41","14598","14604","10.1039/d0dt03010d","","","0.71073","MoKα","","0.0839","0.0485","","","0.1319","0.145","","","","","","1.043","","","","has coordinates,has disorder","258789","2020-11-06","11:57:37",""
"7705579","30.3039","0.0003","30.3039","0.0003","8.2725","0.0001","90","","90","","90","","7596.85","0.14","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C13 H7 Eu N O5 -","- C13 H7 Eu N O5 -","- C208 H112 Eu16 N16 O80 -","16","1","","Li, Bo; Jiang, Yu-Ying; Sun, Ya-Ya; Wang, Yan-Jiang; Han, Min-Le; Wu, Ya-Pan; Ma, Lu-Fang; Li, Dong-Sheng","The highly selective detecting of antibiotics and support of noble metal catalysts by a multifunctional Eu-MOF.","Dalton transactions (Cambridge, England : 2003)","2020","49","42","14854","14862","10.1039/d0dt03176c","","x-ray","1.54184","CuKα","","0.0352","0.0335","","","0.0863","0.0872","","","","","","1.061","","","","has coordinates","258806","2020-11-06","12:02:39",""
"7705974","34.3409","0.0004","34.3409","0.0004","11.7036","0.0001","90","","90","","90","","13802","0.3","200","2","200","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C40 H32 N12 Rh2 -","- C40 H32 N12 Rh2 -","- C640 H512 N192 Rh32 -","16","1","","Cheng, Ming-Chuan; Lee, Gene-Hsiang; Lin, Tien-Sung; Liu, Yu-Chiao; Chiang, Ming-Hsi; Peng, Shie-Ming","A new series of heteronuclear metal strings, MRhRh(dpa)<sub>4</sub>Cl<sub>2</sub> and MRhRhM(dpa)<sub>4</sub>X<sub>2</sub>, from the reactions of Rh<sub>2</sub>(dpa)<sub>4</sub> with metal ions of group 7 to group 12.","Dalton transactions (Cambridge, England : 2003)","2021","50","2","520","534","10.1039/d0dt03311a","","","0.71073","MoKα","","0.0666","0.0348","","","0.0749","0.0846","","","","","","0.968","","","","has coordinates","261674","2021-02-04","23:15:06",""
"7706360","17.179","0.003","17.179","","36.881","0.013","90","","90","","90","","10884","4","100","2","100","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C14 H40 B2 Cl2 N2 P4 Pt2 -","- C14 H40 B2 Cl2 N2 P4 Pt2 -","- C224 H640 B32 Cl32 N32 P64 Pt32 -","16","1","","Brunecker, Carina; Arrowsmith, Merle; Müssig, Jonas H; Böhnke, Julian; Stoy, Andreas; Heß, Merlin; Hofmann, Alexander; Lenczyk, Carsten; Lichtenberg, Crispin; Ramler, Jacqueline; Rempel, Anna; Braunschweig, Holger","Synthesis and characterisation of boranediyl- and diboranediyl-bridged diplatinum A-frame complexes.","Dalton transactions (Cambridge, England : 2003)","2021","50","10","3506","3515","10.1039/d0dt03855e","","","0.71073","MoKα","","0.0515","0.0295","","","0.052","0.0562","","","","","","1.022","","","","has coordinates","263751","2021-04-05","14:46:35",""
"7707020","16.628","0.005","16.628","0.005","17.139","0.01","90","","90","","90","","4739","3","296","2","296.15","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Ba4 F3 Ga S4 -","- Ba4 F3 Ga S4 -","- Ba64 F48 Ga16 S64 -","16","1","","Gao, Hongbo; Chen, Ruijiao; Zhang, Kewang; Abudurusuli, Ailijiang; Lai, Kangrong; Li, Junjie","Synthesis, characterization and theoretical investigation of a new chalcohalide, Ba<sub>4</sub>GaS<sub>4</sub>F<sub>3</sub>.","Dalton transactions (Cambridge, England : 2003)","2021","50","18","6315","6320","10.1039/d1dt00800e","","","0.71073","MoKα","","0.0291","0.0218","","","0.0385","0.0409","","","","","","1.036","","","","has coordinates","266087","2021-06-05","18:53:54",""
"7707158","32.3409","0.0004","32.3409","0.0004","8.6837","0.0002","90","","90","","90","","9082.6","0.3","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C124 H68 Fe2 N20 P -","- C124 H68 Fe2 N20 P -","- C496 H272 Fe8 N80 P4 -","4","0.25","","Yamaguchi, Masayuki; Iwamura, Sayaka; Mine, Kosuke; Murakawa, Hiroshi; Hanasaki, Noriaki; Matsuda, Masaki","An electrically conducting molecular crystal composed of a magnetic iron(iii) complex (S = 1/2) with a large aromatic ligand, 1,2-naphthlalocyanine (C<sub>4h</sub> isomer): towards the development of molecular spintronics.","Dalton transactions (Cambridge, England : 2003)","2021","50","17","5789","5794","10.1039/d1dt00588j","","","0.71073","MoKα","","0.0624","0.0448","","","0.1385","0.15","","","","","","1.079","","","","has coordinates","265998","2021-06-05","18:30:15",""
"7707238","12.7358","0.0002","12.7358","0.0002","69.4576","0.0016","90","","90","","90","","11266.1","0.4","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C58 H78 B2 N4 O Sn -","- C58 H78 B2 N4 O Sn -","- C464 H624 B16 N32 O8 Sn8 -","8","0.5","","Protchenko, Andrey V.; Fuentes, M Ángeles; Hicks, Jamie; McManus, Caitilín; Tirfoin, Rémi; Aldridge, Simon","Reactions of a diborylstannylene with CO<sub>2</sub> and N<sub>2</sub>O: diboration of carbon dioxide by a main group bis(boryl) complex.","Dalton transactions (Cambridge, England : 2003)","2021","50","26","9059","9067","10.1039/d1dt01216a","","","1.54184","CuKα","","0.0815","0.0781","","","0.1725","0.1745","","","","","","1.138","","","","has coordinates,has disorder","268771","2021-09-06","11:14:30",""
"7707583","14.6311","0.0005","14.6311","0.0005","42.767","0.0016","90","","90","","90","","9155.1","0.6","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C64 H104 I4 N4 O32 Ru8 -","- C64 H104 I4 N4 O32 Ru8 -","- C256 H416 I16 N16 O128 Ru32 -","4","0.25","","Cesari, Cristiana; Bortoluzzi, Marco; Femoni, Cristina; Iapalucci, Maria Carmela; Zacchini, Stefano","One-pot atmospheric pressure synthesis of [H<sub>3</sub>Ru<sub>4</sub>(CO)<sub>12</sub>]<sup/>.","Dalton transactions (Cambridge, England : 2003)","2021","50","27","9610","9622","10.1039/d1dt01517f","","","0.71073","MoKα","","0.1118","0.1081","","","0.2137","0.2152","","","","","","1.375","","","","has coordinates,has disorder","268730","2021-09-06","11:01:49",""
"7707929","5.3398","0.00022","5.3398","","11.4765","0.0006","90","","90","","90","","327.23","0.02","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Nb Nd O4 -","- Nb Nd O4 -","- Nb4 Nd4 O16 -","4","0.25","","Saura-Múzquiz, Matilde; Mullens, Bryce G.; Maynard-Casely, Helen E; Kennedy, Brendan J.","Neutron diffraction study of the monoclinic - tetragonal phase transition in NdNbO<sub>4</sub> and NdTaO<sub>4</sub>.","Dalton transactions (Cambridge, England : 2003)","2021","50","33","11485","11497","10.1039/d1dt01981c","powder diffraction","neutron","1.5413","","","","","","","","","0.09777","","1.27","","","","","","","has coordinates","268751","2021-09-06","11:08:27",""
"7707930","5.36222","0.00028","5.36222","","11.5249","0.0007","90","","90","","90","","331.38","0.03","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Nd O4 Ta -","- Nd O4 Ta -","- Nd4 O16 Ta4 -","4","0.25","","Saura-Múzquiz, Matilde; Mullens, Bryce G.; Maynard-Casely, Helen E; Kennedy, Brendan J.","Neutron diffraction study of the monoclinic - tetragonal phase transition in NdNbO<sub>4</sub> and NdTaO<sub>4</sub>.","Dalton transactions (Cambridge, England : 2003)","2021","50","33","11485","11497","10.1039/d1dt01981c","powder diffraction","neutron","1.5393","","","","","","","","","0.10643","","1.09","","","","","","","has coordinates","268751","2021-09-06","11:08:27",""
"7708188","17.2401","0.0003","17.2401","0.0003","42.898","0.001","90","","90","","90","","12750.2","0.4","100","2","100","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C156 H126 B4 Fe4 N30 -","- C156 H126 B4 Fe4 N30 -","- C624 H504 B16 Fe16 N120 -","4","0.25","","Guo, Zhilin; You, Maolin; Deng, Yi-Fei; Liu, Qiang; Meng, Yin-Shan; Pikramenou, Zoe; Zhang, Yuan-Zhu","An azido-bridged [FeII4] grid-like molecule showing spin crossover behaviour","Dalton Transactions","2021","","","","","10.1039/D1DT01908B","","","1.54178","CuKα","","0.0459","0.0369","","","0.0965","0.1011","","","","","","1.068","","","","has coordinates,has disorder","268487","2021-09-05","22:50:52",""
"7708189","17.4466","0.0003","17.4466","0.0003","43.6969","0.0013","90","","90","","90","","13300.6","0.5","300","2","300","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C156 H126 B4 Fe4 N30 -","- C156 H126 B4 Fe4 N30 -","- C624 H504 B16 Fe16 N120 -","4","0.25","","Guo, Zhilin; You, Maolin; Deng, Yi-Fei; Liu, Qiang; Meng, Yin-Shan; Pikramenou, Zoe; Zhang, Yuan-Zhu","An azido-bridged [FeII4] grid-like molecule showing spin crossover behaviour","Dalton Transactions","2021","","","","","10.1039/D1DT01908B","","","1.54178","CuKα","","0.0782","0.0493","","","0.1301","0.1478","","","","","","1.025","","","","has coordinates,has disorder","268487","2021-09-05","22:50:54",""
"7708190","17.2652","0.0008","17.2652","0.0008","43.062","0.003","90","","90","","90","","12836.2","1.2","150","2","150","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C156 H126 B4 Fe4 N30 -","- C156 H126 B4 Fe4 N30 -","- C624 H504 B16 Fe16 N120 -","4","0.25","","Guo, Zhilin; You, Maolin; Deng, Yi-Fei; Liu, Qiang; Meng, Yin-Shan; Pikramenou, Zoe; Zhang, Yuan-Zhu","An azido-bridged [FeII4] grid-like molecule showing spin crossover behaviour","Dalton Transactions","2021","","","","","10.1039/D1DT01908B","","","1.54178","CuKα","","0.1027","0.066","","","0.1706","0.1994","","","","","","0.996","","","","has coordinates,has disorder","268487","2021-09-05","22:50:54",""
"7708191","17.3036","0.0003","17.3036","0.0003","43.1803","0.001","90","","90","","90","","12928.8","0.4","200","2","200","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C156 H126 B4 Fe4 N30 -","- C156 H126 B4 Fe4 N30 -","- C624 H504 B16 Fe16 N120 -","4","0.25","","Guo, Zhilin; You, Maolin; Deng, Yi-Fei; Liu, Qiang; Meng, Yin-Shan; Pikramenou, Zoe; Zhang, Yuan-Zhu","An azido-bridged [FeII4] grid-like molecule showing spin crossover behaviour","Dalton Transactions","2021","","","","","10.1039/D1DT01908B","","","1.54178","CuKα","","0.0466","0.0355","","","0.0904","0.0958","","","","","","1.057","","","","has coordinates,has disorder","268487","2021-09-05","22:50:54",""
"7708205","25.4392","0.0013","25.4392","0.0013","12.2009","0.0005","90","","90","","90","","7895.8","0.7","296","2","296","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","tetra-(μ3-iodo)-tetrakis(10-(4-chlorophenyl)-5,10-dihydro-5-methyl-phenarsazine)copper(I)","","- C76 H60 As4 Cl4 Cu4 I4 N4 -","- C76 H60 As4 Cl4 Cu4 I4 N4 -","- C304 H240 As16 Cl16 Cu16 I16 N16 -","4","0.25","","Galimova, Milyausha F.; Zueva, Ekaterina M.; Dobrynin, Alexey B.; Kolesnikov, Ilya E.; Musin, Rustem R.; Musina, Elvira I.; Karasik, Andrey A.","Luminescent Cu<sub>4</sub>I<sub>4</sub>-cubane clusters based on <i>N</i>-methyl-5,10-dihydrophenarsazines.","Dalton transactions (Cambridge, England : 2003)","2021","","","","","10.1039/d1dt02344f","","","0.71073","MoKα","","0.076","0.0418","","","0.1151","0.1647","","","","","","1.009","","","","has coordinates","268985","2021-09-06","23:06:24",""
"7708206","25.383","0.002","25.383","0.002","12.2628","0.0009","90","","90","","90","","7900.9","1.1","296","2","296","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","tetra-(μ3-iodo)-tetrakis(10-(4-bromophenyl)-5,10-dihydro-5-methyl-phenarsazine)copper(I)","","- C152 H120 As8 Br8 Cu8 I8 N8 -","- C152 H120 As8 Br8 Cu8 I8 N8 -","- C304 H240 As16 Br16 Cu16 I16 N16 -","2","0.125","","Galimova, Milyausha F.; Zueva, Ekaterina M.; Dobrynin, Alexey B.; Kolesnikov, Ilya E.; Musin, Rustem R.; Musina, Elvira I.; Karasik, Andrey A.","Luminescent Cu<sub>4</sub>I<sub>4</sub>-cubane clusters based on <i>N</i>-methyl-5,10-dihydrophenarsazines.","Dalton transactions (Cambridge, England : 2003)","2021","","","","","10.1039/d1dt02344f","","","0.71073","MoKα","","0.0719","0.0466","","","0.1356","0.1617","","","","","","0.995","","","","has coordinates","268985","2021-09-06","23:06:24",""
"7708470","17.1656","0.001","17.1656","0.001","6.704","0.0007","90","","90","","90","","1975.4","0.3","113","2","113","2","","","","","","","","3","I 41/a :2","-I 4ad","88","2,2-diazidomethyl-5,5-bitetrazole","2,2-diazidomethyl-5,5-bitetrazole","","- C4 H4 N14 -","- C4 H4 N14 -","- C32 H32 N112 -","8","0.5","","Klapötke, Thomas M.; Kofen, Moritz; Stierstorfer, Jörg","N-Functionalisation of 5,5′-bistetrazole providing 2,2′-di(azidomethyl)bistetrazole: a melt-castable metal-free green primary explosive","Dalton Transactions","2021","","","","","10.1039/D1DT02731J","","x-ray","0.71073","MoKα","","0.0752","0.0441","","","0.0862","0.0976","","","","","","1.035","","","","has coordinates","269383","2021-09-29","23:12:02",""
"7708579","18.4197","0.0004","18.4197","0.0004","36.1009","0.0013","90","","90","","90","","12248.5","0.6","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C39 H24 Cl I Ir N3 O -","- C39 H24 Cl I Ir N3 O -","- C624 H384 Cl16 I16 Ir16 N48 O16 -","16","1","","Yang, Yan; Wang, Cheng-Ming; Pan, Feng-Hua; Qin, Qi-Pin; Xie, Qiu-Ji; Chen, Qing; Liang, Hong","Synthesis and biological evaluation of mixed-ligands cyclometalated iridium(III)-quinoline complexes","Dalton Transactions","2021","","","","","10.1039/D1DT02416G","","x-ray","0.71073","MoKα","","0.1426","0.07","","","0.1678","0.2063","","","","","","1.037","","","","has coordinates","270037","2021-10-19","23:16:46",""
"7708580","18.1807","0.0005","18.1807","0.0005","36.8214","0.0013","90","","90","","90","","12170.9","0.6","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C39 H24 Br2 Ir N3 O -","- C39 H24 Br2 Ir N3 O -","- C624 H384 Br32 Ir16 N48 O16 -","16","1","","Yang, Yan; Wang, Cheng-Ming; Pan, Feng-Hua; Qin, Qi-Pin; Xie, Qiu-Ji; Chen, Qing; Liang, Hong","Synthesis and biological evaluation of mixed-ligands cyclometalated iridium(III)-quinoline complexes","Dalton Transactions","2021","","","","","10.1039/D1DT02416G","","x-ray","0.71073","MoKα","","0.1073","0.053","","","0.1182","0.1397","","","","","","1.041","","","","has coordinates","270037","2021-10-19","23:16:47",""
"7708619","13.8079","0.0007","13.8079","","36.167","0.002","90","","90","","90","","6895.5","0.5","150","2","150","2","","","","","","","synthesis as described","7","I 41/a :2","-I 4ad","88","","","","- C21 H15 F2 Fe N O2 S -","- C21 H15 F2 Fe N O2 S -","- C336 H240 F32 Fe16 N16 O32 S16 -","16","1","","Erb, William; Roisnel, Thierry","The chemistry of ferrocenesulfonyl fluoride revealed","Dalton Transactions","2021","","","","","10.1039/D1DT03492H","","x-ray","0.71073","MoKα","","0.0703","0.054","","","0.109","0.1189","","","","","","1.078","","","","has coordinates,has disorder","270122","2021-10-28","23:40:52",""
"7709278","27.335","0.001","27.335","0.001","12.7837","0.0009","90","","90","","90","","9552","0.8","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C200 H208 N16 Na8 O8 P8 -","- C200 H208 N16 Na8 O8 P8 -","- C400 H416 N32 Na16 O16 P16 -","2","0.125","","Zhao, Minggang; Xue, Tingting; He, Ru-Ru; Ma, Jianping; Zheng, Wenjun","Ion-bearing stairs: alkali metal complexes of 1,2-diaza-4-phospholides.","Dalton transactions (Cambridge, England : 2003)","2022","51","4","1634","1645","10.1039/d1dt03601g","","x-ray","0.71073","MoKα","","0.0976","0.0785","","","0.2344","0.2576","","","","","","1.037","","","","has coordinates","272694","2022-02-04","19:48:13",""
"7709626","20.8003","0.0002","20.8003","0.0002","26.713","0.0005","90","","90","","90","","11557.4","0.3","99.9","0.8","99.9","0.8","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C16 H20 Mo12 N24 O28 -","- C16 H20 Mo12 N24 O28 -","- C64 H80 Mo48 N96 O112 -","4","0.25","","Deng, Lan; Lin, Rong-Yan; Zhou, Zhao-Hui","Isolated molybdenum-based microporous POMs for selective adsorption of gases","Dalton Transactions","2022","","","","","10.1039/D2DT00134A","","x-ray","1.54184","CuKα","","0.0526","0.0439","","","0.1259","0.1312","","","","","","1.04","","","","has coordinates","273197","2022-03-01","23:55:13",""
"7709734","34.235","0.005","34.235","0.005","20.889","0.004","90","","90","","90","","24483","7","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C54 H48 N18 Ni2 S4 -","- C54 H48 N18 Ni2 S4 -","- C864 H768 N288 Ni32 S64 -","16","1","","Dobrov, Anatolie; Darvasiová, Denisa; Zalibera, Michal; Bučinský, Lukáš; Jelemenská, Ingrid; Rapta, Peter; Shova, Sergiu; Dumitrescu, Dan G.; Andrade, Marta A.; Martins, Luísa M. D. R. S.; Pombeiro, Armando J. L.; Arion, Vladimir B.","Diastereomeric dinickel(ii) complexes with non-innocent bis(octaazamacrocyclic) ligands: isomerization, spectroelectrochemistry, DFT calculations and use in catalytic oxidation of cyclohexane","Dalton Transactions","2022","","","","","10.1039/D2DT00154C","","","0.7","MoKα","","0.0643","0.0543","","","0.1631","0.1736","","","","","","1.032","","","","has coordinates,has disorder","273630","2022-03-11","00:11:11",""
"7710198","17.3975","0.0018","17.3975","0.0018","31.318","0.004","90","","90","","90","","9479.1","1.8","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C18 H26.5 Cl2 N5 O8.5 Zn -","- C18 H26 Cl2 N5 O8.25 Zn -","- C288 H416 Cl32 N80 O132 Zn16 -","16","1","","Garau, Alessandra; Picci, Giacomo; Bencini, Andrea; Caltagirone, Claudia; Conti, Luca; Paoli, Paola; Lippolis, Vito; Romano, Giammarco Maria; Rossi, Patrizia; Scorciapino, Mariano A.","Glyphosate sensing in aqueous solutions by fluorescent zinc(II) complexes of [9]aneN3-based receptors","Dalton Transactions","2022","","","","","10.1039/D2DT00738J","","","1.54178","CuKα","","0.1347","0.1049","","","0.2813","0.3117","","","","","","1.088","","","","has coordinates,has disorder","275084","2022-05-05","22:49:30",""
"7710280","38.2925","0.0007","38.2925","0.0007","16.4164","0.0004","90","","90","","90","","24071.6","0.9","153","2","153","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C45 H25 Eu N4 O13 -","- C45 H25 Eu N4 O13 -","- C720 H400 Eu16 N64 O208 -","16","1","","Liu, Teng; Shen, Xianfu; Liu, Zhengfen; Zhang, Feng; Liu, Jian-Jun","An electron-deficient MOF as an efficient electron-transfer catalyst for selective oxidative carbon–carbon coupling of 2,6-di-tert-butylphenol","Dalton Transactions","2022","","","","","10.1039/D2DT00869F","","","0.71073","MoKα","","0.0761","0.0508","","","0.1264","0.136","","","","","","1.031","","","","has coordinates","275464","2022-05-16","23:00:01",""
"7710374","15.85","0.003","15.85","0.003","18.016","0.003","90","","90","","90","","4526","1.4","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C40 H56 Mg4 O20 -","- C40 H56 Mg4 O20 -","- C160 H224 Mg16 O80 -","4","0.25","","Petrus, Rafał; Lis, Tadeusz; Kowaliński, Adrian","Use of heterometallic magnesium-alkali metal aryloxides in ring-opening polymerization of cyclic esters","Dalton Transactions","2022","","","","","10.1039/D2DT00731B","","","0.71073","MoKα","","0.0916","0.0775","","","0.198","0.2126","","","","","","1.09","","","","has coordinates","275696","2022-05-30","22:58:51",""
"7710570","15.7666","0.0003","15.7666","0.0003","10.3145","0.0002","90","","90","","90","","2564.04","0.09","100.01","0.1","100.01","0.1","","","","","","","","3","I 41/a :2","-I 4ad","88","Os1-Et","tetrakis(2-ethylphenyl)osmium(IV)","","- C32 H36 Os -","- C32 H36 Os -","- C128 H144 Os4 -","4","0.25","","Parr, Joseph Michael; Olivar, Clarissa; Saal, Thomas; Haiges, Ralf; Inkpen , Michael Stephen","Pushing steric limits in osmium(IV) tetraaryl complexes","Dalton Transactions","2022","","","","","10.1039/D2DT01706G","","x-ray","0.71073","MoKα","","0.0228","0.0185","","","0.0384","0.0396","","","","","","1.082","","","","has coordinates","276210","2022-06-23","23:14:32",""
"7712193","26.758","0.002","26.758","0.002","29.967","0.002","90","","90","","90","","21456","3","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C116 H251 Cu27 N12 O2 S24 -","- C108 H231 Cu27 N12 S24 -","- C432 H924 Cu108 N48 S96 -","4","0.25","","Silalahi, Rhone P Brocha; Liao, Jian-Hong; Tseng, Yu-Fang; Chiu, Tzu-Hao; Kahlal, Samia; Saillard, Jean-Yves; Liu, C. W.","Unusual core engineering on a copper hydride nanoball.","Dalton transactions (Cambridge, England : 2003)","2023","52","7","2106","2114","10.1039/d2dt03449b","","","0.71073","MoKα","","0.1206","0.0614","","","0.1512","0.1962","","","","","","1.025","","","","has coordinates","283315","2023-05-05","02:22:31",""
"7712332","12.568","0.003","12.568","0.003","25.478","0.012","90","","90","","90","","4024","2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C9 H15 Br5 Mn N6 -","- C9 H15 Br5 Mn N6 -","- C72 H120 Br40 Mn8 N48 -","8","0.5","","Jung, Mi Hee","Long-Lived Spin-Triplet Excitons in Manganese Complexes for Room-Temperature Phosphorescence","Dalton Transactions","2023","","","","","10.1039/D2DT03831E","","","0.71073","synchrotron","","0.0622","0.0589","","","0.1748","0.1785","","","","","","1.082","","","","has coordinates","281006","2023-02-20","10:18:04",""
"7712334","12.413","0.003","12.413","0.003","25.463","0.012","90","","90","","90","","3923","2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C9 H15 Br5 Mn N6 -","- C9 H15 Br5 Mn N6 -","- C72 H120 Br40 Mn8 N48 -","8","0.5","","Jung, Mi Hee","Long-Lived Spin-Triplet Excitons in Manganese Complexes for Room-Temperature Phosphorescence","Dalton Transactions","2023","","","","","10.1039/D2DT03831E","","","0.71073","synchrotron","","0.0797","0.0784","","","0.2182","0.2204","","","","","","1.092","","","","has coordinates","281006","2023-02-20","10:18:04",""
"7712467","19.5833","0.0003","19.5833","0.0003","12.0916","0.0003","90","","90","","90","","4637.2","0.15","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C44 H64 N8 Zn4 -","- C44 H64 N8 Zn4 -","- C176 H256 N32 Zn16 -","4","0.25","","Terlecki, Michał; Justyniak, Iwona; Leszczyński, Michał K.; Bernatowicz, Piotr; Lewiński, Janusz","Factors controlling the structure of alkylzinc amidinates: on the role of N-substituents","Dalton Transactions","2023","52","9","2712","2721","10.1039/D2DT03722J","","","0.71073","MoKα","","0.036","0.0286","","","0.0651","0.0682","","","","","","1.064","","","","has coordinates","282621","2023-04-13","12:20:55",""
"7712549","46.9293","0.001","46.9293","0.001","8.3649","0.0002","90","","90","","90","","18422.5","0.7","105","","105","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C47 H27 Cl3 F14 N2 P Re -","- C47 H27 Cl3 F14 N2 P Re -","- C752 H432 Cl48 F224 N32 P16 Re16 -","16","1","","Claude, Guilhem; Kulitzki, Erika; Hagenbach, Adelheid; Roca Jungfer, Maximilian; Figueroa, Joshua S.; Abram, Ulrich","Phenylimido Complexes of Rhenium: Fluorine Substituents Provide Protection, Reactivity and Solubility","Dalton Transactions","2023","","","","","10.1039/D3DT00446E","","","1.54178","CuKα","","0.0332","0.0287","","","0.0703","0.0734","","","","","","1.03","","","","has coordinates,has disorder","281755","2023-03-08","23:57:48",""
"7712847","17.4174","0.0002","17.4174","0.0002","18.9309","0.0003","90","","90","","90","","5742.99","0.13","173.01","0.1","173.01","0.1","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C70 H46 Ag4 N10 -","- C70 H46 Ag4 N10 -","- C280 H184 Ag16 N40 -","4","0.25","","Xiao, Wang-Chuan; Nie, Qing-Bin; Luo, Geng-Geng","Secondary hierarchical complexity in double-stranded cluster helicates covered by NNNNN type pincer ligands","Dalton Transactions","2023","","","","","10.1039/D3DT00912B","","x-ray","1.54184","CuKα","","0.0326","0.0282","","","0.0683","0.0718","","","","","","1.081","","","","has coordinates","282784","2023-04-20","22:55:02",""
"7713149","13.126","0.003","13.126","0.003","15.379","0.005","90","","90","","90","","2649.7","1.2","273.15","","273.15","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- B3 Na P2 S10 -","- B3 Na P2 S10 -","- B24 Na8 P16 S80 -","8","0.5","","Huang, Yi; Chu, Dongdong; Yun, Yihan; Xie, Wenlong; Li, Guangmao; Zhang, Yong","From BPS4 to AB3P2S10 (A = Na, K): Cations Inducing Dimension Reduction and Bandgap Enlargement","Dalton Transactions","2023","","","","","10.1039/D3DT01337E","","","0.71073","MoKα","","0.0499","0.0341","","","0.0751","0.0867","","","","","","1.071","","","","has coordinates","283991","2023-05-24","22:52:35",""
"7713150","13.0262","0.0008","13.0262","0.0008","16.5387","0.0017","90","","90","","90","","2806.3","0.4","273.15","","273.15","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- B3 K P2 S10 -","- B3 K P2 S10 -","- B24 K8 P16 S80 -","8","0.5","","Huang, Yi; Chu, Dongdong; Yun, Yihan; Xie, Wenlong; Li, Guangmao; Zhang, Yong","From BPS4 to AB3P2S10 (A = Na, K): Cations Inducing Dimension Reduction and Bandgap Enlargement","Dalton Transactions","2023","","","","","10.1039/D3DT01337E","","","0.71073","MoKα","","0.071","0.0465","","","0.123","0.1391","","","","","","1.06","","","","has coordinates","283991","2023-05-24","22:52:36",""
"7713194","19.7947","0.0004","19.7947","0.0004","35.7471","0.0008","90","","90","","90","","14006.8","0.5","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","Rb3GaF6","","","- F6 Ga Rb3 -","- F6 Ga Rb3 -","- F480 Ga80 Rb240 -","80","5","","Morrison, Gregory; Masachchi, Lakshani W.; Tisdale, Hunter B.; Chang, Tieyan; Jones, Virginia G.; Zamorano, K. Pilar; Breton, Logan S.; Smith, Mark D.; Chen, Yu-Sheng; Zur Loye, Hans-Conrad","Polymorphism in A3MF6 (A = Rb, Cs; M = Al, Ga) Grown using Mixed Halide Fluxes","Dalton Transactions","2023","","","","","10.1039/D3DT00352C","","","","","","","","","","","","","","","","","","","","","has coordinates","284075","2023-05-30","22:56:17",""
"7713283","29.341","0.002","29.341","0.002","10.4047","0.0014","90","","90","","90","","8957.3","1.5","100.15","","100.15","","","","","","","","","5","I 41/a :2","-I 4ad","88","","1","","- C23 H31 N2 O3 V -","- C23 H31 N2 O3 V -","- C368 H496 N32 O48 V16 -","16","1","","Wu, Ruiyao; Niu, Zhen; Xia, Zhu; He, Jianyun; Bai, Chenxi","Vanadium complexes bearing 8-anilide-5,6,7-trihydroquinoline ligands for ethylene (co-)polymerization.","Dalton transactions (Cambridge, England : 2003)","2023","52","25","8636","8644","10.1039/d3dt01065a","","","0.71073","MoKα","","0.0419","0.0325","","","0.0797","0.0847","","","","","","1.058","","","","has coordinates","284620","2023-06-29","10:59:11",""
"7713403","36.5804","0.0009","36.5804","0.0009","15.8953","0.0005","90","","90","","90","","21269.9","1","150","2","150","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C35.5 H58.4 Cu2 F6.6 N4 O12.5 P2 -","- C35.5 H58.4 Cu2 F6.6 N4 O12.5 P2 -","- C568 H934.4 Cu32 F105.6 N64 O200 P32 -","16","1","","Koucký, Filip; Kotek, Jan; Císařová, Ivana; Havlíčková, Jana; Kubíček, Vojtěch; Hermann, Petr","Transition metal complexes of cyclam with two 2,2,2-trifluoroethylphosphinate pendant arms as probes for <sup>19</sup>F magnetic resonance imaging.","Dalton transactions (Cambridge, England : 2003)","2023","","","","","10.1039/d3dt01420g","","","0.71073","MoKα","","0.0698","0.0493","","","0.1366","0.1473","","","","","","1.106","","","","has coordinates,has disorder","284796","2023-07-04","23:11:31",""
"7714423","20.3803","0.0002","20.3803","0.0002","9.0334","0.0002","90","","90","","90","","3752.08","0.1","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C32 H60 O8 P4 Pd -","- C32 H60 O8 P4 Pd -","- C128 H240 O32 P16 Pd4 -","4","0.25","","Nobbs, James David; Tay, Dillon; Yeap, Yoon Hui; Tiong, Yong-Lun; Ye, Suming; Aitipamula, Srinivasulu; Wang, Cun; Cheong, Choon Boon; van Meurs, Martin","Dioxaphosphabicyclooctanes: small caged phosphines from tris(hydroxymethyl)phosphine","Dalton Transactions","2023","","","","","10.1039/D3DT02577B","","x-ray","1.54184","CuKα","","0.0439","0.0419","","","0.1118","0.114","","","","","","1.094","","","","has coordinates,has disorder","287481","2023-11-08","00:04:54",""
"7714758","23.6576","0.0004","23.6576","0.0004","42.1881","0.0009","90","","90","","90","","23611.9","0.8","150","2","150","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C41.67 H25.33 Cl4.67 F4 Mn0.67 N6.67 O0 Sb0.67 -","- C41.6667 H25.6667 Cl4.66667 F4 Mn0.666667 N6.66667 Sb0.666667 -","- C1000 H616 Cl112 F96 Mn16 N160 Sb16 -","24","1.5","","McKearney, Declan; MacDonald, Kyle; Kim, Min Suk; Williams, Vance E.; Leznoff, Daniel B.","Tuning the visible colour of octahedral manganese(III) phthalocyanines <i>via</i> axial ligand exchange.","Dalton transactions (Cambridge, England : 2003)","2024","53","3","938","948","10.1039/d3dt03518b","","","1.54178","CuKα","","0.0912","0.0768","","","0.224","0.2449","","","","","","1.017","","","","has coordinates","289555","2024-02-04","12:12:21",""
"7715632","25.9465","0.0005","25.9465","0.0005","18.3068","0.0004","90","","90","","90","","12324.5","0.4","113","","113","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C36 H42 N2 O2 Pt -","- C36 H42 N2 O2 Pt -","- C576 H672 N32 O32 Pt16 -","16","1","","Ikeshita, Masahiro; Ma, Shing Cho; Muller, Gilles; Naota, Takeshi","Linker-dependent control of the chiroptical properties of polymethylene-vaulted trans-bis[(β-iminomethyl)naphthoxy]platinum(II) complexes","Dalton Transactions","2024","","","","","10.1039/D4DT00273C","","","0.71073","MoKα","","0.0932","0.0741","","","0.1883","0.1971","","","","","","1.16","","","","has coordinates","290764","2024-04-03","22:55:56",""
"7715833","21.475","0.0003","21.475","0.0003","9.4576","0.0007","90","","90","","90","","4361.6","0.3","100","","100","","","","370000","","","","","6","I 41/a :2","-I 4ad","88","","catena-[tetrakis(m2-Cyano)-octakis(1H-pyrazole-N2)-tetracyano-di-iron(ii)-niobium(iv) tetrahydrate]","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Handzlik, Gabriela; Dziubek, Kamil F.; Hanfland, Michael; Pinkowicz, Dawid","Simultaneous manipulation of iron(II) spin crossover and LIESST behaviour using pressure, temperature and light.","Dalton transactions (Cambridge, England : 2003)","2024","","","","","10.1039/d4dt00509k","","x-ray","0.41008","synchrotron","","0.0424","0.0379","","","0.0923","0.0956","","","","","","1.081","","","","has coordinates","291371","2024-04-26","22:50:49",""
"7715834","21.4722","0.0003","21.4722","0.0003","9.4522","0.0008","90","","90","","90","","4358","0.4","5","","5","","","","280000","","","","","6","I 41/a :2","-I 4ad","88","","catena-[tetrakis(m2-Cyano)-octakis(1H-pyrazole-N2)-tetracyano-di-iron(ii)-niobium(iv) tetrahydrate]","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Handzlik, Gabriela; Dziubek, Kamil F.; Hanfland, Michael; Pinkowicz, Dawid","Simultaneous manipulation of iron(II) spin crossover and LIESST behaviour using pressure, temperature and light.","Dalton transactions (Cambridge, England : 2003)","2024","","","","","10.1039/d4dt00509k","","x-ray","0.41008","synchrotron","","0.0418","0.0351","","","0.0892","0.093","","","","","","1.048","","","","has coordinates","291371","2024-04-26","22:50:50",""
"7715835","21.4595","0.0004","21.4595","0.0004","9.4491","0.001","90","","90","","90","","4351.4","0.5","5","","5","","","","280000","","","","","6","I 41/a :2","-I 4ad","88","","catena-[tetrakis(m2-Cyano)-octakis(1H-pyrazole-N2)-tetracyano-di-iron(ii)-niobium(iv) tetrahydrate]","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Handzlik, Gabriela; Dziubek, Kamil F.; Hanfland, Michael; Pinkowicz, Dawid","Simultaneous manipulation of iron(II) spin crossover and LIESST behaviour using pressure, temperature and light.","Dalton transactions (Cambridge, England : 2003)","2024","","","","","10.1039/d4dt00509k","","x-ray","0.41008","synchrotron","","0.042","0.037","","","0.0968","0.1001","","","","","","1.06","","","","has coordinates","291371","2024-04-26","22:50:50",""
"7715836","21.418","0.0003","21.418","0.0003","9.4229","0.0008","90","","90","","90","","4322.6","0.4","100","","100","","","","510000","","","","","6","I 41/a :2","-I 4ad","88","","catena-[tetrakis(m2-Cyano)-octakis(1H-pyrazole-N2)-tetracyano-di-iron(ii)-niobium(iv) tetrahydrate]","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Handzlik, Gabriela; Dziubek, Kamil F.; Hanfland, Michael; Pinkowicz, Dawid","Simultaneous manipulation of iron(II) spin crossover and LIESST behaviour using pressure, temperature and light.","Dalton transactions (Cambridge, England : 2003)","2024","","","","","10.1039/d4dt00509k","","x-ray","0.41008","synchrotron","","0.0393","0.0346","","","0.0886","0.0917","","","","","","1.065","","","","has coordinates","291371","2024-04-26","22:50:50",""
"7715837","21.605","0.0004","21.605","0.0004","9.5533","0.0018","90","","90","","90","","4459.3","0.8","100","","100","","","","80000","","","","","6","I 41/a :2","-I 4ad","88","","catena-[tetrakis(m2-Cyano)-octakis(1H-pyrazole-N2)-tetracyano-di-iron(ii)-niobium(iv) tetrahydrate]","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Handzlik, Gabriela; Dziubek, Kamil F.; Hanfland, Michael; Pinkowicz, Dawid","Simultaneous manipulation of iron(II) spin crossover and LIESST behaviour using pressure, temperature and light.","Dalton transactions (Cambridge, England : 2003)","2024","","","","","10.1039/d4dt00509k","","x-ray","0.41008","synchrotron","","0.0499","0.0401","","","0.0912","0.096","","","","","","0.999","","","","has coordinates","291371","2024-04-26","22:50:50",""
"7715838","21.0746","0.0007","21.0746","0.0007","9.3334","0.0015","90","","90","","90","","4145.3","0.7","5","","5","","","","870000","","","","","6","I 41/a :2","-I 4ad","88","","catena-[tetrakis(m2-Cyano)-octakis(1H-pyrazole-N2)-tetracyano-di-iron(ii)-niobium(iv) tetrahydrate]","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Handzlik, Gabriela; Dziubek, Kamil F.; Hanfland, Michael; Pinkowicz, Dawid","Simultaneous manipulation of iron(II) spin crossover and LIESST behaviour using pressure, temperature and light.","Dalton transactions (Cambridge, England : 2003)","2024","","","","","10.1039/d4dt00509k","","x-ray","0.41008","synchrotron","","0.0665","0.0417","","","0.0895","0.0984","","","","","","0.961","","","","has coordinates","291371","2024-04-26","22:50:50",""
"7715839","20.9186","0.0013","20.9186","0.0013","9.372","0.003","90","","90","","90","","4101.1","1.4","5","","5","","","","870000","","","","","6","I 41/a :2","-I 4ad","88","","catena-[tetrakis(m2-Cyano)-octakis(1H-pyrazole-N2)-tetracyano-di-iron(ii)-niobium(iv) tetrahydrate]","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Handzlik, Gabriela; Dziubek, Kamil F.; Hanfland, Michael; Pinkowicz, Dawid","Simultaneous manipulation of iron(II) spin crossover and LIESST behaviour using pressure, temperature and light.","Dalton transactions (Cambridge, England : 2003)","2024","","","","","10.1039/d4dt00509k","","x-ray","0.41008","synchrotron","","0.0911","0.0491","","","0.0984","0.1131","","","","","","0.939","","","","has coordinates","291371","2024-04-26","22:50:50",""
"7715840","20.9206","0.0017","20.9206","0.0017","9.371","0.003","90","","90","","90","","4101.4","1.4","5","","5","","","","870000","","","","","6","I 41/a :2","-I 4ad","88","","catena-[tetrakis(m2-Cyano)-octakis(1H-pyrazole-N2)-tetracyano-di-iron(ii)-niobium(iv) tetrahydrate]","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Handzlik, Gabriela; Dziubek, Kamil F.; Hanfland, Michael; Pinkowicz, Dawid","Simultaneous manipulation of iron(II) spin crossover and LIESST behaviour using pressure, temperature and light.","Dalton transactions (Cambridge, England : 2003)","2024","","","","","10.1039/d4dt00509k","","x-ray","0.41008","synchrotron","","0.1058","0.064","","","0.1721","0.2054","","","","","","0.943","","","","has coordinates","291371","2024-04-26","22:50:51",""
"7715841","21.4558","0.0004","21.4558","0.0004","9.4642","0.0013","90","","90","","90","","4356.9","0.6","100","","100","","","","380000","","","","","6","I 41/a :2","-I 4ad","88","","catena-[tetrakis(m2-Cyano)-octakis(1H-pyrazole-N2)-tetracyano-di-iron(ii)-niobium(iv) tetrahydrate]","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Handzlik, Gabriela; Dziubek, Kamil F.; Hanfland, Michael; Pinkowicz, Dawid","Simultaneous manipulation of iron(II) spin crossover and LIESST behaviour using pressure, temperature and light.","Dalton transactions (Cambridge, England : 2003)","2024","","","","","10.1039/d4dt00509k","","x-ray","0.41008","synchrotron","","0.0559","0.0435","","","0.106","0.1123","","","","","","1.03","","","","has coordinates","291371","2024-04-26","22:50:51",""
"7715842","21.168","0.0007","21.168","0.0007","9.3545","0.0017","90","","90","","90","","4191.6","0.8","5","","5","","","","820000","","","","","6","I 41/a :2","-I 4ad","88","","catena-[tetrakis(m2-Cyano)-octakis(1H-pyrazole-N2)-tetracyano-di-iron(ii)-niobium(iv) tetrahydrate]","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Handzlik, Gabriela; Dziubek, Kamil F.; Hanfland, Michael; Pinkowicz, Dawid","Simultaneous manipulation of iron(II) spin crossover and LIESST behaviour using pressure, temperature and light.","Dalton transactions (Cambridge, England : 2003)","2024","","","","","10.1039/d4dt00509k","","x-ray","0.41008","synchrotron","","0.0869","0.0612","","","0.154","0.1657","","","","","","1.103","","","","has coordinates","291371","2024-04-26","22:50:51",""
"7715843","21.0773","0.0006","21.0773","0.0006","9.3291","0.0013","90","","90","","90","","4144.5","0.6","5","","5","","","","870000","","","","","6","I 41/a :2","-I 4ad","88","","catena-[tetrakis(m2-Cyano)-octakis(1H-pyrazole-N2)-tetracyano-di-iron(ii)-niobium(iv) tetrahydrate]","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Handzlik, Gabriela; Dziubek, Kamil F.; Hanfland, Michael; Pinkowicz, Dawid","Simultaneous manipulation of iron(II) spin crossover and LIESST behaviour using pressure, temperature and light.","Dalton transactions (Cambridge, England : 2003)","2024","","","","","10.1039/d4dt00509k","","x-ray","0.41008","synchrotron","","0.0671","0.0445","","","0.0949","0.103","","","","","","0.97","","","","has coordinates","291371","2024-04-26","22:50:51",""
"7715844","20.6618","0.0004","20.6618","0.0004","9.2789","0.0009","90","","90","","90","","3961.3","0.4","100","","100","","","","1530000","","","","","6","I 41/a :2","-I 4ad","88","","catena-[tetrakis(m2-Cyano)-octakis(1H-pyrazole-N2)-tetracyano-di-iron(ii)-niobium(iv) tetrahydrate]","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Handzlik, Gabriela; Dziubek, Kamil F.; Hanfland, Michael; Pinkowicz, Dawid","Simultaneous manipulation of iron(II) spin crossover and LIESST behaviour using pressure, temperature and light.","Dalton transactions (Cambridge, England : 2003)","2024","","","","","10.1039/d4dt00509k","","x-ray","0.41008","synchrotron","","0.1068","0.0959","","","0.2959","0.327","","","","","","1.049","","","","has coordinates","291371","2024-04-26","22:50:51",""
"7715845","21.091","0.001","21.091","0.001","9.378","0.002","90","","90","","90","","4171.6","0.9","5","","5","","","","820000","","","","","6","I 41/a :2","-I 4ad","88","","catena-[tetrakis(m2-Cyano)-octakis(1H-pyrazole-N2)-tetracyano-di-iron(ii)-niobium(iv) tetrahydrate]","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Handzlik, Gabriela; Dziubek, Kamil F.; Hanfland, Michael; Pinkowicz, Dawid","Simultaneous manipulation of iron(II) spin crossover and LIESST behaviour using pressure, temperature and light.","Dalton transactions (Cambridge, England : 2003)","2024","","","","","10.1039/d4dt00509k","","x-ray","0.41008","synchrotron","","0.0979","0.0655","","","0.1836","0.2052","","","","","","1.011","","","","has coordinates","291371","2024-04-26","22:50:51",""
"7715846","20.7181","0.0006","20.7181","0.0006","9.3075","0.0013","90","","90","","90","","3995.1","0.6","100","","100","","","","1360000","","","","","6","I 41/a :2","-I 4ad","88","","catena-[tetrakis(m2-Cyano)-octakis(1H-pyrazole-N2)-tetracyano-di-iron(ii)-niobium(iv) tetrahydrate]","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Handzlik, Gabriela; Dziubek, Kamil F.; Hanfland, Michael; Pinkowicz, Dawid","Simultaneous manipulation of iron(II) spin crossover and LIESST behaviour using pressure, temperature and light.","Dalton transactions (Cambridge, England : 2003)","2024","","","","","10.1039/d4dt00509k","","x-ray","0.41008","synchrotron","","0.0943","0.0742","","","0.1991","0.2162","","","","","","1.025","","","","has coordinates","291371","2024-04-26","22:50:51",""
"7715847","20.7576","0.0007","20.7576","0.0007","9.3174","0.0017","90","","90","","90","","4014.7","0.8","100","","100","","","","1250000","","","","","6","I 41/a :2","-I 4ad","88","","catena-[tetrakis(m2-Cyano)-octakis(1H-pyrazole-N2)-tetracyano-di-iron(ii)-niobium(iv) tetrahydrate]","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Handzlik, Gabriela; Dziubek, Kamil F.; Hanfland, Michael; Pinkowicz, Dawid","Simultaneous manipulation of iron(II) spin crossover and LIESST behaviour using pressure, temperature and light.","Dalton transactions (Cambridge, England : 2003)","2024","","","","","10.1039/d4dt00509k","","x-ray","0.41008","synchrotron","","0.0603","0.0454","","","0.1028","0.1083","","","","","","0.949","","","","has coordinates","291371","2024-04-26","22:50:51",""
"7715848","21.1151","0.0005","21.1151","0.0005","9.3661","0.0017","90","","90","","90","","4175.9","0.8","100","","100","","","","830000","","","","","6","I 41/a :2","-I 4ad","88","","catena-[tetrakis(m2-Cyano)-octakis(1H-pyrazole-N2)-tetracyano-di-iron(ii)-niobium(iv) tetrahydrate]","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Handzlik, Gabriela; Dziubek, Kamil F.; Hanfland, Michael; Pinkowicz, Dawid","Simultaneous manipulation of iron(II) spin crossover and LIESST behaviour using pressure, temperature and light.","Dalton transactions (Cambridge, England : 2003)","2024","","","","","10.1039/d4dt00509k","","x-ray","0.41008","synchrotron","","0.0852","0.0543","","","0.1309","0.1473","","","","","","1.058","","","","has coordinates","291371","2024-04-26","22:50:51",""
"7715849","21.4699","0.0003","21.4699","0.0003","9.4581","0.0007","90","","90","","90","","4359.8","0.3","5","","5","","","","280000","","","","","6","I 41/a :2","-I 4ad","88","","catena-[tetrakis(m2-Cyano)-octakis(1H-pyrazole-N2)-tetracyano-di-iron(ii)-niobium(iv) tetrahydrate]","","- C32 H40 Fe2 N24 Nb O4 -","- C32 H40 Fe2 N24 Nb O4 -","- C128 H160 Fe8 N96 Nb4 O16 -","4","0.25","","Handzlik, Gabriela; Dziubek, Kamil F.; Hanfland, Michael; Pinkowicz, Dawid","Simultaneous manipulation of iron(II) spin crossover and LIESST behaviour using pressure, temperature and light.","Dalton transactions (Cambridge, England : 2003)","2024","","","","","10.1039/d4dt00509k","","x-ray","0.41008","synchrotron","","0.0504","0.0408","","","0.1022","0.1078","","","","","","1.058","","","","has coordinates","291371","2024-04-26","22:50:51",""
"8000095","9.6445","0.0005","9.6445","0.0005","29.651","0.002","90","","90","","90","","2758","0.3","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H32 N8 O12 Re Rh4 -","- C16 H32 N8 O12 Re Rh4 -","- C64 H128 N32 O48 Re4 Rh16 -","4","0.25","","Fuma, Yasuhiro; Ebihara, Masahiro","A Square-sheet Structure of Paddlewheel Dirhodium Complexes in Mixed Oxidation States with Perrhenate Linkers","Chemistry Letters","2006","35","11","1298","","10.1246/cl.2006.1298","","","0.7107","MoKα","","0.0338","0.0297","","","0.0478","0.0486","","","","","","1.312","","","","has coordinates","211175","2020-10-21","18:00:00",""
"8000143","18.723","0.002","18.723","0.002","30.706","0.005","90","","90","","90","","10764","2","200","2","200","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C88 H84 Co4 F24 N20 O18 -","- C88 H84 Co4 F24 N20 O18 -","- C352 H336 Co16 F96 N80 O72 -","4","0.25","","Mitsumoto, Kiyotaka; Koizumi, Satoshi; Shiga, Takuya; Nishikawa, Hiroyuki; Chi, Yun; Oshio, Hiroki","Alkoxo-bridged Cobalt(II) Cube and Its Radical Adduct","Chemistry Letters","2007","36","9","1154","","10.1246/cl.2007.1154","","","0.71073","MoKα","","0.0618","0.0481","","","0.1361","0.1451","","","","","","1.029","","","","has coordinates,has disorder","211175","2020-10-21","18:00:00",""
"8100739","4.8765","0.0003","4.8765","0.0003","9.8769","0.0009","90","","90","","90","","234.93","0.08","293","2","293","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- H Li4 N -","- H Li4 N -","- H4 Li16 N4 -","4","0.25","","Niewa, Rainer; Zherebtsov, D.","Redetermination of the crystal structure of tetralithium mononitride monohydride, Li~4~NH","Zeitschrift für Kristallographie - New Crystal Structures","2002","217","3","317","318","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101351","8.895","0.004","8.895","0.004","20.683","0.011","90","","90","","90","","1636.5","1.3","193","2","193","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C12 H20 S6 -","- C12 H20 S6 -","- C48 H80 S24 -","4","0.25","","Mahjoub, Ahmed; Zantour, Hédi","Crystal structure of 1,3,5,7-tetraethyl-2,4,6,8,9,10-hexathiaadamantane, C~4~S~6~(C~2~H~5~)~4~","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","577","578","","","","","","","","0.0461","","","0.1016","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101428","14.024","0.005","14.024","0.005","16.785","0.005","90","","90","","90","","3301","2","193","2","193","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C8 H8 N Na O -","- C8 H8 N Na O -","- C128 H128 N16 Na16 O16 -","16","1","","Czado, Wolfgang; Müller, Ulrich","Crystal structure of sodium phenolate‒acetonitrile (1/1), NaOC~6~H~5~ · CH~3~CN","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","63","64","","","","","","","","0.0509","","","0.0768","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102297","11.2174","0.0006","11.2174","0.0006","33.612","0.003","90","","90","","90","","4229.4","0.5","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","2, 2`-Bis(salicylideneamino)diphenyl sulfide","","- C26 H20 N2 O2 S -","- C26 H20 N2 O2 S -","- C208 H160 N16 O16 S8 -","8","0.5","","Sheng-Rong Guo; Yan-Qin Yuan","Crystal structure of 2,2'-bis(salicylideneamino)diphenyl sulfide, C26H20N2O2S","Zeitschrift für Kristallographie - New Crystal Structures","2008","223","3","269","","","","","0.71073","MoKα","","0.1092","0.106","","","0.2008","0.2024","","","","","","1.39","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102450","17.576","0.002","17.576","0.002","42.923","0.011","90","","90","","90","","13260","4","291","2","298","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","poly[di-μ-1,3-bis(4-pyridyl)propane-di- chloride-Cadmium(II) dihydrate], [[CdCl~2~(C~13~H~14~N~2~) ~2~]^.^2(H~2~O)]~n~","","- C26 H32 Cd Cl2 N4 O2 -","- C26 H32 Cd Cl2 N4 O2 -","- C416 H512 Cd16 Cl32 N64 O32 -","16","1","","Shan Hu; Li-Jun Jiang; Xin-Hua Li","Crystal structure of bis(m-1,3-bis(4-pyridyl)propane)cadium(II) dichloride dihydrate, Cd(C13H14N2)2Cl2 · 2H2O","Zeitschrift für Kristallographie - New Crystal Structures","2010","225","1","134","","","","","0.71073","MoKα","","0.1305","0.0535","","","0.0897","0.1046","","","","","","0.989","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8102879","14.443","0.0013","14.443","0.0013","19.959","0.004","90","","90","","90","","4163.5","1","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","C12 H22 Br4 N4 Zn","C12 H22 Br4 N4 Zn","","- C12 H22 Br4 N4 O0 Zn -","- C12 H22 Br4 N4 Zn -","- C96 H176 Br32 N32 Zn8 -","8","0.5","","Wei-Wei Zhou; Wang Zhao; Ming-Jun Song; Xia Bao; Feng-Wu Wang","Crystal structure of bis(N-ethyl-N'-methylimidazolium) tetrabromozinc(II), (C6H11N2)2[ZnBr4]","Zeitschrift für Kristallographie - New Crystal Structures","2010","225","4","801","","","","","0.71073","MoKα","","0.081","0.0554","","","0.1499","0.1681","","","","","","1.052","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8103369","15.6635","0.0002","15.6635","0.0002","27.1833","0.0006","90","","90","","90","","6669.29","0.19","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C64 H52 N16 Na4 O20 -","- C64 H52 N16 Na4 O20 -","- C256 H208 N64 Na16 O80 -","4","0.25","","Hui Gao; Chen Xu; Lu-Meng Duan; Zhi-Qiang Wang; Yao-Ting Fan","Crystal structure of methanol[m-N-(5-phenyl-1,3,4-oxadiazol-2-yl)-4-nitrobenzamide-k2N1,O1:kN2]sodium, Na(CH4O)(C15H9N4O4)","Zeitschrift für Kristallographie - New Crystal Structures","2012","227","2","189","","","","","0.71073","MoKα","","0.0564","0.0399","","","0.0968","0.1057","","","","","","1.023","","","","has coordinates","291193","2024-04-15","11:27:49",""
"8103751","5.148","","5.148","","11.173","","90","","90","","90","","296.106","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","(Li1.02 Y0.98) (Mo O4)2","","- Li1.02 Mo2 O8 Y0.98 -","- Li0.974 Mo2 O8 Y1.026 -","- Li1.948 Mo4 O16 Y2.052 -","2","0.125","","Kolitsch, U.","The crystal structures of phenacite-type Li2 (Mo O4), and scheelite-type Li Y (Mo O4)2 and Li Nd (Mo O4)2","Zeitschrift fuer Kristallographie (149,1979-)","2001","216","","449","454","","","","","","","","","","","","","","","","","","","","","","has coordinates","157046","2020-10-21","18:00:00",""
"8103752","5.243","","5.243","","11.44","","90","","90","","90","","314.475","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","(Li Nd) (Mo O4)2","","- Li Mo2 Nd O8 -","- Li0.994 Mo2 Nd1.006 O8 -","- Li1.988 Mo4 Nd2.012 O16 -","2","0.125","","Kolitsch, U.","The crystal structures of phenacite-type Li2 (Mo O4), and scheelite-type Li Y (Mo O4)2 and Li Nd (Mo O4)2","Zeitschrift fuer Kristallographie (149,1979-)","2001","216","","449","454","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103802","11.869","","11.869","","7.176","","90","","90","","90","","1010.91","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Na2 (Si2 O5)","","- Na2 O5 Si2 -","- Na2 O5 Si2 -","- Na16 O40 Si16 -","8","0.5","","Kahlenberg, V.; Weidenthaler, C.; Rakic, S.","Room- and high-temperature single crystal diffraction studies on gamma-(Na2 Si2 O5): an interrupted framework with exclusively Q(3) - units","Zeitschrift fuer Kristallographie (149,1979-)","2003","218","","421","431","","","","","","","","","","","","","","","","","","","","","","has coordinates","158991","2020-10-21","18:00:00",""
"8103929","14.635","","14.635","","12.071","","90","","90","","90","","2585.41","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Ce2 Br3 N","","- Br3 Ce2 N -","- Br3 Ce2 N -","- Br48 Ce32 N16 -","16","1","","Mattausch, H.J.; Simon, A.","Crystal structure of dicerium tribromide nitride Ce2 Br3 N","Zeitschrift fuer Kristallographie (149,1979-)","1996","211","","398","398","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103976","15.468","","15.468","","14.005","","90","","90","","90","","3350.82","","","","","","","","","","","","","7","I 41/a :2","-I 4ad","88","","Cs4 (Te4 (Re (C N)3)4) (H2 O)4","","- C12 H8 Cs4 N12 O4 Re4 Te4 -","- C12 H8 Cs4 N12 O4 Re4 Te4 -","- C48 H32 Cs16 N48 O16 Re16 Te16 -","4","0.25","","Mironov, Yu.V.; Albrecht-Schmitt, T.E.; Ibers, J.A.","Crystal structure of dodecacyano-tetra-mu3-tellurorhenate(IV) tetrahydrate, Cs4 (Re4 Te4 (C N)12) (H2 O)4","Zeitschrift fuer Kristallographie - New Crystal Structures","1997","212","","308","308","","","","","","","","","","","","","","","","","","","","","","has coordinates","200426","2020-10-21","18:00:00",""
"8104403","5.175","","5.175","","11.943","","90","","90","","90","","319.841","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Pb0.5 Th0.5 (V O4)","","- O4 Pb0.5 Th0.5 V -","- O4 Pb0.5 Th0.5 V -","- O16 Pb2 Th2 V4 -","4","0.25","","Andreetti, G.D.; Calestani, G.; Montenero, A.","The crystal structure of the Pb0.5 Th0.5 V O4 polymorphs with scheelite-, zircon- and huttonite-type structure","Zeitschrift fuer Kristallographie (149,1979-)","1984","168","","41","51","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104519","19.3878","0.001","19.3878","0.001","34.909","0.002","90","","90","","90","","13121.8","1.2","296","2","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Ba3 O6 Te -","- Ba3 O6 Te -","- Ba240 O480 Te80 -","80","5","","Stöger, Berthold; Weil, Matthias; Zobetz, Erich","Sr3TeO6 and Ba3TeO6: double perovskites with pronounced superstructures","Zeitschrift für Kristallographie","2010","225","","125","138","10.1524/zkri.2010.1234","","","","","","","0.034","","0.06","","","","","","","","","","","","has coordinates","183535","2020-10-21","18:00:00",""
"8104633","17.515","0.011","17.515","0.011","15.459","0.013","90","","90","","90","","4742","6","113.15","","113.15","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C12 H9 Cl F N3 -","- C12 H9 Cl F N3 -","- C192 H144 Cl16 F16 N48 -","16","1","","Wu, Hui-Zhen; Min, Li-Jing; Han, Liang; Liu, Xing-Hai; Sun, Na-Bo","The crystal structure of (E)-3-chloro-2-(2-(2-fluorobenzylidene)hydrazinyl)pyridine, C12H9ClFN3","Zeitschrift für Kristallographie - New Crystal Structures","2021","236","5","953","955","10.1515/ncrs-2021-0164","","","0.71073","MoKα","","0.0589","0.053","","","0.1126","0.1161","","","","","","1.177","","","","has coordinates","273334","2022-03-04","10:17:28",""
"8106080","14.2364","0.0004","14.2364","0.0004","20.541","0.0007","90","","90","","90","","4163.1","0.2","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","bis(2-benzoyl-5-hydroxylphenolato)copper","","- C26 H18 Cu O6 -","- C26 H18 Cu O6 -","- C208 H144 Cu8 O48 -","8","0.5","","Wang, Hui; Xiao, Zi-Jing","The crystal structure of bis(2-benzoyl-5-hydroxylphenolato-κ2 O,O′)copper(II), C26H18CuO6","Zeitschrift für Kristallographie - New Crystal Structures","2018","233","1","149","150","10.1515/ncrs-2017-0239","","","0.71073","MoKα","","0.0697","0.0482","","","0.1306","0.1476","","","","","","1.061","","","","has coordinates","279254","2022-11-14","09:36:52",""
"8106463","12.1303","0.0005","12.1303","0.0005","28.7471","0.0012","90","","90","","90","","4230","0.3","223","2","223","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","cis-bis(2,2'-bipyrimidine-κ^2^N,N')bis(thiocyanato-κ<i>N</i>)nickel(II)","","- C18 H12 N10 Ni S2 -","- C18 H12 N10 Ni S2 -","- C144 H96 N80 Ni8 S16 -","8","0.5","","Ha, Kwang","Crystal structure of cis-bis(2,2′-bipyrimidine-κ2N,N′)bis(thiocyanato-κN)nickel(II), C18H12N10NiS2","Zeitschrift für Kristallographie - New Crystal Structures","2017","232","1","147","148","10.1515/ncrs-2016-0202","","","0.71073","MoKα","","0.0418","0.0329","","","0.0798","0.0854","","","","","","1.061","","","","has coordinates","280329","2023-01-13","08:42:38",""
"8106694","8.8634","0.0006","8.8634","0.0006","27.731","0.004","90","","90","","90","","2178.5","0.4","296.15","","296.15","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C20 H16 Cu N10 O2 -","- C20 H16 Cu N10 O2 -","- C80 H64 Cu4 N40 O8 -","4","0.25","","Wang, Zhaodong; Xu, Qiang; Ni, Haitao; Liu, Xidong","Crystal structure of bis((pyrazin-2-ylmethyl)(pyrazine-2-carbonyl)amido-κ3 N,N′,N′′)copper(II), C20H16CuN10O2","Zeitschrift für Kristallographie - New Crystal Structures","2017","232","5","835","836","10.1515/ncrs-2017-0069","","","0.71073","MoKα","","0.0774","0.0541","","","0.139","0.1521","","","","","","1.105","","","","has coordinates,has disorder","280793","2023-02-06","09:47:18",""
"8106696","13.8885","0.0006","13.8885","0.0006","13.6718","0.0006","90","","90","","90","","2637.2","0.2","210","2","210","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","1,1'-bisisoquinoline","","- C18 H12 N2 -","- C18 H12 N2 -","- C144 H96 N16 -","8","0.5","","Grunwald, Nicolas; Kelling, Alexandra; Holdt, Hans-Jürgen; Schilde, Uwe","The crystal structure of 1,1′-bisisoquinoline, C18H12N2","Zeitschrift für Kristallographie - New Crystal Structures","2017","232","5","839","841","10.1515/ncrs-2017-0088","","","0.71073","MoKα","","0.037","0.0295","","","0.0832","0.0854","","","","","","1.031","","","","has coordinates","280795","2023-02-06","09:54:19",""
"8106887","10.3597","0.0015","10.3597","0.0015","32.729","0.01","90","","90","","90","","3512.6","1.3","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C14 H16 Cl N2 Nd O8 -","- C14 H16 Cl N2 Nd O8 -","- C112 H128 Cl8 N16 Nd8 O64 -","8","0.5","","Li, Rong-Fang; Li, Jin; Wang, Ke-Qiang; Huo, Su Zhen","Crystal structure of diaqua-bis(μ3-2-methyl-6-oxidopyridinium-4-carboxylato-κ3 O:O′:O′′)neodymium(III) chloride, C14H16ClN2O8Nd","Zeitschrift für Kristallographie - New Crystal Structures","2016","231","2","403","404","10.1515/ncrs-2015-0024","","","0.71073","MoKα","","0.0313","0.0234","","","0.0588","0.0625","","","","","","0.998","","","","has coordinates","281744","2023-03-08","10:13:00",""
"8107189","37.5562","0.0005","37.5562","0.0005","9.2031","0.0002","90","","90","","90","","12980.7","0.4","300","2","300","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","2-(1<i>H</i>-pyrazol-3-yl-κ<i>N</i>)pyridine-κ^2^<i>N</i>-bis(2-(2,4-\ difluorophenyl)pyridinato-κ^2^<i>C</i>,<i>N</i>)iridium(III) sesquihydrate","","- C30 H18 F4 Ir N5 -","- C30 H18 F4 Ir N5 -","- C480 H288 F64 Ir16 N80 -","16","1","","Abdul Latiff, Aqilah; Chong, Yan Yi; Mark-Lee, Wun Fui; Kassim, Mohammad B.","Crystal structure of 2-(1H-pyrazol-3-yl-κN)pyridine-κN-bis(2-(2,4-difluorophenyl)pyridinato-κ 2 C,N)iridium(III) sesquihydrate, C30H18F4IrN5·1.5[H2O]","Zeitschrift für Kristallographie - New Crystal Structures","2022","237","4","689","692","10.1515/ncrs-2022-0076","","","0.71073","MoKα","","0.0371","0.0312","","","0.1052","0.1166","","","","","","1.259","","","","has coordinates","283718","2023-05-12","08:24:53",""
"8107530","15.1344","0.0002","15.1344","0.0002","26.5431","0.0006","90","","90","","90","","6079.7","0.18","150","2","150.15","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C16 H10 N2 O7 Pb -","- C16 H10 N2 O7 Pb -","- C256 H160 N32 O112 Pb16 -","16","1","","Zhang, Yujie; Xiong, Shushu; He, Yongke","Crystal structure of poly[(μ3-2-(3,5-dicarboxyphenyl) benzimidazole-6-carboxylato-κ4O:O:O′:O″)lead(II)] monohydrate, C16H10N2O7Pb","Zeitschrift für Kristallographie - New Crystal Structures","2023","238","4","683","684","10.1515/ncrs-2023-0149","","","0.71073","MoKα","","0.0485","0.0419","","","0.096","0.0991","","","","","","1.115","","","","has coordinates","286499","2023-09-25","08:29:39",""
"9000485","13.09","","13.09","","13.75","","90","","90","","90","","2356.04","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","Leucite","- Al0.96 K O6 Si2.04 -","- Al0.96 K O6 Si2.04 -","- Al15.36 K16 O96 Si32.64 -","16","1","","Mazzi, F.; Galli, E.; Gottardi, G.","The crystal structure of tetragonal leucite","American Mineralogist","1976","61","","108","115","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:13:59",""
"9001518","12.988","","12.988","","13.8","","90","","90","","90","","2327.9","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","Leucite","- Al K O6 Si2 -","- Al0.99999 K O6 Si2.00001 -","- Al15.9998 K16 O96 Si32.0002 -","16","1","","Dove, M. T.; Cool, T.; Palmer, D. C.; Putnis, A.; Salje, E. K. H.; Winkler, B.","On the role of Al-Si ordering in the cubic-tetragonal phase transition of leucite Sample is Disordered","American Mineralogist","1993","78","","486","492","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:41",""
"9001519","12.931","","12.931","","13.812","","90","","90","","90","","2309.51","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","Leucite","- Al K O6 Si2 -","- Al K O6 Si2 -","- Al16 K16 O96 Si32 -","16","1","","Dove, M. T.; Cool, T.; Palmer, D. C.; Putnis, A.; Salje, E. K. H.; Winkler, B.","On the role of Al-Si ordering in the cubic-tetragonal phase transition of leucite Sample is Order model 1","American Mineralogist","1993","78","","486","492","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:41",""
"9001520","13.005","","13.005","","13.765","","90","","90","","90","","2328.07","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","Leucite","- Al K O6 Si2 -","- Al K O6 Si2 -","- Al16 K16 O96 Si32 -","16","1","","Dove, M. T.; Cool, T.; Palmer, D. C.; Putnis, A.; Salje, E. K. H.; Winkler, B.","On the role of Al-Si ordering in the cubic-tetragonal phase transition of leucite Sample is Order model 2","American Mineralogist","1993","78","","486","492","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:41",""
"9001795","13.05476","","13.05476","","13.75182","","90","","90","","90","","2343.68","","","","298","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","Leucite","- Al K O6 Si2 -","- Al0.99999 K O6 Si2.00001 -","- Al15.9998 K16 O96 Si32.0002 -","16","1","","Palmer, D. C.; Dove, M. T.; Ibberson, R. M.; Powell, B. M.","Structural behavior, crystal chemistry and phase transitions in substituted leucites: High-resolution neutron powder diffraction studies Sample: Natural, Expt. no. 3003, T = 298 K, KAlSi2O6","American Mineralogist","1997","82","","16","29","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9001796","13.2918","","13.2918","","13.74118","","90","","90","","90","","2427.68","","","","298","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","Leucite","- Al O6 Rb Si2 -","- Al0.99999 O6 Rb Si2.00001 -","- Al15.9998 O96 Rb16 Si32.0002 -","16","1","","Palmer, D. C.; Dove, M. T.; Ibberson, R. M.; Powell, B. M.","Structural behavior, crystal chemistry and phase transitions in substituted leucites: High-resolution neutron powder diffraction studies Sample: Expt. no. 2830, T = 298 K, RbAlSi2O6","American Mineralogist","1997","82","","16","29","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9001797","13.6524","","13.6524","","13.7216","","90","","90","","90","","2557.54","","","","298","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","Leucite","- Al Cs O6 Si2 -","- Al0.99999 Cs O6 Si2.00001 -","- Al15.9998 Cs16 O96 Si32.0002 -","16","1","","Palmer, D. C.; Dove, M. T.; Ibberson, R. M.; Powell, B. M.","Structural behavior, crystal chemistry and phase transitions in substituted leucites: High-resolution neutron powder diffraction studies Sample: Expt. no. 2828, T = 298 K, CsAlSi2O6","American Mineralogist","1997","82","","16","29","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9001798","13.20357","","13.20357","","13.95446","","90","","90","","90","","2432.74","","","","298","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","Leucite","- K0.9 O6 Si2 -","- K0.9 O6 Si2.00001 -","- K14.4 O96 Si32.0002 -","16","1","","Palmer, D. C.; Dove, M. T.; Ibberson, R. M.; Powell, B. M.","Structural behavior, crystal chemistry and phase transitions in substituted leucites: High-resolution neutron powder diffraction studies Sample: Expt. no. 3757, T = 298 K, KFeSi2O6","American Mineralogist","1997","82","","16","29","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9003674","12.535","","12.535","","12.37","","90","","90","","90","","1943.65","","","","","","","","","","synthesized at 3 GPa and 1000 C","synthesized at 3 GPa","","3","I 41/a :2","-I 4ad","88","","","","- Ca Ge O3 -","- Ca Ge O3 -","- Ca32 Ge32 O96 -","32","2","","Nakatsuka, A.; Chaya, H.; Yoshiasa, A.","Crystal structure of single-crystal CaGeO3 tetragonal garnet synthesized at 3 GPa and 1000 C","American Mineralogist","2005","90","","755","757","10.2138/am.2005.1801","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:32",""
"9004185","14.357","","14.357","","5.908","","90","","90","","90","","1217.78","","","","","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","Mannardite","- Ba0.517 Cr0.508 H2 O8.483 Ti2.984 V0.508 -","- Ba0.517 Cr0.508 H0.966 O8.483 Ti2.984 V0.508 -","- Ba4.136 Cr4.064 H7.728 O67.864 Ti23.872 V4.064 -","8","0.5","","Szymanski, J. T.","The crystal structure of mannardite, a new hydrated cryptomelane-group (hollandite) mineral with a doubled short axis","The Canadian Mineralogist","1986","24","","67","78","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9005298","9.873","","9.873","","10.288","","90","","90","","90","","1002.83","","","","298.15","","","","","","","","Synthetic","5","I 41/a :2","-I 4ad","88","","","Garronite","- Al0.354 Ca0.175 H10 O2.86 Si0.646 -","- Al0.354 Ca0.175 H1.72 O2.86 Si0.646 -","- Al5.664 Ca2.8 H27.52 O45.76 Si10.336 -","16","1","","Schropfer, L.; Joswig, W.","Structure analyses of a partially dehydrated synthetic Ca-garronite single crystal under different T, pH2O conditions Sample: GAR25/20, T = 25 C, 60% relative humidity","European Journal of Mineralogy","1997","9","","53","66","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9005299","9.912","","9.912","","10.303","","90","","90","","90","","1012.25","","","","298.15","","","","","","","","Synthetic","5","I 41/a :2","-I 4ad","88","","","Garronite","- Al0.354 Ca0.175 H10 O2.86 Si0.646 -","- Al0.354 Ca0.175 H1.72 O2.86 Si0.646 -","- Al5.664 Ca2.8 H27.52 O45.76 Si10.336 -","16","1","","Schropfer, L.; Joswig, W.","Structure analyses of a partially dehydrated synthetic Ca-garronite single crystal under different T, pH2O conditions Sample: GAR25/27, T = 25 C, 80% relative humidity","European Journal of Mineralogy","1997","9","","53","66","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9007621","16.144","","16.144","","10.706","","90","","90","","90","","2790.29","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","Stenhuggarite","- As2 Ca Fe O7 Sb -","- As2 Ca Fe O7 Sb -","- As32 Ca16 Fe16 O112 Sb16 -","16","1","","Coda, A.; Dal Negro, A.; Sabelli, C.; Tazzoli, V.","The crystal structure of stenhuggarite","Acta Crystallographica, Section B","1977","33","","1807","1811","10.1107/S0567740877007109","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007785","5.003","","5.003","","11.143","","90","","90","","90","","278.909","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Er O4 V -","- Er O4 V -","- Er4 O16 V4 -","4","0.25","","Range, K. J.; Meister, H.","ErVO4-II, a scheelite-type high-pressure modification of erbium orthovanadate","Acta Crystallographica, Section C","1990","46","","1093","1094","10.1107/S0108270189014162","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007793","15.0263","","15.0263","","7.3971","","90","","90","","90","","1670.19","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Ge8.5 Na4 O20 -","- Ge8.5 Na4 O20 -","- Ge34 Na16 O80 -","4","0.25","","Fleet, M. E.","Refinement of the structure of sodium enneagermanate (Na4Ge9O20)","Acta Crystallographica, Section C","1990","46","","1202","1204","10.1107/S0108270189011042","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9008105","5.4312","","5.4312","","12.1065","","90","","90","","90","","357.117","","","","","","","","","","","","Los Lamentos, Mexico","3","I 41/a :2","-I 4ad","88","","","Wulfenite","- Mo O4 Pb -","- Mo O4 Pb -","- Mo4 O16 Pb4 -","4","0.25","","Leciejewicz, J.","A neutron crystallographic investigation of lead molybdenum oxide, PbMoO4","Zeitschrift fur Kristallographie","1965","121","","158","164","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008282","4.952","","4.952","","23.275","","90","","90","","90","","570.757","","","","","","","","","","","","rodingitic dykes in a ophiolitic zone in the Taurus Mountains,","5","I 41/a :2","-I 4ad","88","","","Chantalite","- Al2 Ca H4 O8 Si -","- Al2 Ca H4 O8 Si -","- Al8 Ca4 H16 O32 Si4 -","4","0.25","","Liebich, B. W.; Sarp, H.; Parthe, E.","The crystal structure of chantalite, CaAl2(OH)4SiO4 southwest Turkey","Zeitschrift fur Kristallographie","1979","150","","53","63","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9009404","5.434","","5.434","","12.107","","90","","90","","90","","357.5","","","","","","","","","","","","Monte Cengio, Vicenza, Italy","3","I 41/a :2","-I 4ad","88","","","Wulfenite","- Mo O4 Pb -","- Mo O4 Pb -","- Mo4 O16 Pb4 -","4","0.25","","Lugli, C.; Medici, L.; Saccardo, D.","Natural wulfenite: structural refinement by single-crystal X-ray diffraction","Neues Jahrbuch fur Mineralogie, Monatshefte","1999","1999","","281","288","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009524","19.99","","19.99","","5.908","","90","","90","","90","","2360.84","","","","","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","Baotite","- Ba4 Cl Fe0.64 Nb1.44 O28 Si4 Ti5.92 -","- Ba4 Cl Fe0.64 Nb1.44 O28 Si4 Ti5.92 -","- Ba16 Cl4 Fe2.56 Nb5.76 O112 Si16 Ti23.68 -","4","0.25","","Nekrasov Yu, V.; Ponomarev, V. I.; Simonov, V. I.; Kheiker, D. M.","Refinement of the atomic structure of baotite and the isomorphic relationships in this mineral","Soviet Physics Crystallography","1969","14","","508","514","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009626","5.2429","","5.2429","","11.3737","","90","","90","","90","","312.64","","","","","","","","100","","","","","3","I 41/a :2","-I 4ad","88","","","Scheelite","- Ca O4 W -","- Ca O4 W -","- Ca4 O16 W4 -","4","0.25","","Hazen, R. M.; Finger, L. W.; Mariathasan, J. W. E.","High-pressure crystal chemistry of scheelite-type tungstates and molybdates Note: P = 0.0001 GPa, in air","Journal of Physics and Chemistry of Solids","1985","46","","253","263","10.1016/0022-3697(85)90039-3","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009627","5.2429","","5.2429","","11.3737","","90","","90","","90","","312.64","","","","","","","","100","","","","","3","I 41/a :2","-I 4ad","88","","","Scheelite","- Ca O4 W -","- Ca O4 W -","- Ca4 O16 W4 -","4","0.25","","Hazen, R. M.; Finger, L. W.; Mariathasan, J. W. E.","High-pressure crystal chemistry of scheelite-type tungstates and molybdates Note: P = 0.0001 GPa, in the diamond anvil cell","Journal of Physics and Chemistry of Solids","1985","46","","253","263","10.1016/0022-3697(85)90039-3","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009628","5.216","","5.216","","11.313","","90","","90","","90","","307.789","","","","","","","","1030000","","","","","3","I 41/a :2","-I 4ad","88","","","Scheelite","- Ca O4 W -","- Ca O4 W -","- Ca4 O16 W4 -","4","0.25","","Hazen, R. M.; Finger, L. W.; Mariathasan, J. W. E.","High-pressure crystal chemistry of scheelite-type tungstates and molybdates Note: P = 1.03 GPa","Journal of Physics and Chemistry of Solids","1985","46","","253","263","10.1016/0022-3697(85)90039-3","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009629","5.1936","","5.1936","","11.255","","90","","90","","90","","303.587","","","","","","","","2030000","","","","","3","I 41/a :2","-I 4ad","88","","","Scheelite","- Ca O4 W -","- Ca O4 W -","- Ca4 O16 W4 -","4","0.25","","Hazen, R. M.; Finger, L. W.; Mariathasan, J. W. E.","High-pressure crystal chemistry of scheelite-type tungstates and molybdates Note: P = 2.03 GPa","Journal of Physics and Chemistry of Solids","1985","46","","253","263","10.1016/0022-3697(85)90039-3","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009630","5.174","","5.174","","11.197","","90","","90","","90","","299.747","","","","","","","","3120000","","","","","3","I 41/a :2","-I 4ad","88","","","Scheelite","- Ca O4 W -","- Ca O4 W -","- Ca4 O16 W4 -","4","0.25","","Hazen, R. M.; Finger, L. W.; Mariathasan, J. W. E.","High-pressure crystal chemistry of scheelite-type tungstates and molybdates Note: P = 3.12 GPa","Journal of Physics and Chemistry of Solids","1985","46","","253","263","10.1016/0022-3697(85)90039-3","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009631","5.16","","5.16","","11.142","","90","","90","","90","","296.662","","","","","","","","4090000","","","","","3","I 41/a :2","-I 4ad","88","","","Scheelite","- Ca O4 W -","- Ca O4 W -","- Ca4 O16 W4 -","4","0.25","","Hazen, R. M.; Finger, L. W.; Mariathasan, J. W. E.","High-pressure crystal chemistry of scheelite-type tungstates and molybdates Note: P = 4.09 GPa","Journal of Physics and Chemistry of Solids","1985","46","","253","263","10.1016/0022-3697(85)90039-3","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009632","5.222","","5.222","","11.425","","90","","90","","90","","311.552","","","","","","","","100","","","","","3","I 41/a :2","-I 4ad","88","","","Powellite","- Ca Mo O4 -","- Ca Mo O4 -","- Ca4 Mo4 O16 -","4","0.25","","Hazen, R. M.; Finger, L. W.; Mariathasan, J. W. E.","High-pressure crystal chemistry of scheelite-type tungstates and molybdates Note: P = 0.0001 GPa Note: B(2,2) altered from .0012 in order to match Biso","Journal of Physics and Chemistry of Solids","1985","46","","253","263","10.1016/0022-3697(85)90039-3","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009633","5.1996","","5.1996","","11.365","","90","","90","","90","","307.262","","","","","","","","1300000","","","","","3","I 41/a :2","-I 4ad","88","","","Powellite","- Ca Mo O4 -","- Ca Mo O4 -","- Ca4 Mo4 O16 -","4","0.25","","Hazen, R. M.; Finger, L. W.; Mariathasan, J. W. E.","High-pressure crystal chemistry of scheelite-type tungstates and molybdates Note: P = 1.30 GPa","Journal of Physics and Chemistry of Solids","1985","46","","253","263","10.1016/0022-3697(85)90039-3","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009634","5.1801","","5.1801","","11.301","","90","","90","","90","","303.245","","","","","","","","2490000","","","","","3","I 41/a :2","-I 4ad","88","","","Powellite","- Ca Mo O4 -","- Ca Mo O4 -","- Ca4 Mo4 O16 -","4","0.25","","Hazen, R. M.; Finger, L. W.; Mariathasan, J. W. E.","High-pressure crystal chemistry of scheelite-type tungstates and molybdates Note: P = 2.49 GPa","Journal of Physics and Chemistry of Solids","1985","46","","253","263","10.1016/0022-3697(85)90039-3","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009635","5.1605","","5.1605","","11.226","","90","","90","","90","","298.957","","","","","","","","3650000","","","","","3","I 41/a :2","-I 4ad","88","","","Powellite","- Ca Mo O4 -","- Ca Mo O4 -","- Ca4 Mo4 O16 -","4","0.25","","Hazen, R. M.; Finger, L. W.; Mariathasan, J. W. E.","High-pressure crystal chemistry of scheelite-type tungstates and molybdates Note: P = 3.65 GPa","Journal of Physics and Chemistry of Solids","1985","46","","253","263","10.1016/0022-3697(85)90039-3","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009636","5.1515","","5.1515","","11.193","","90","","90","","90","","297.039","","","","","","","","4190000","","","","","3","I 41/a :2","-I 4ad","88","","","Powellite","- Ca Mo O4 -","- Ca Mo O4 -","- Ca4 Mo4 O16 -","4","0.25","","Hazen, R. M.; Finger, L. W.; Mariathasan, J. W. E.","High-pressure crystal chemistry of scheelite-type tungstates and molybdates Note: P = 4.19 GPa","Journal of Physics and Chemistry of Solids","1985","46","","253","263","10.1016/0022-3697(85)90039-3","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009637","5.138","","5.138","","11.152","","90","","90","","90","","294.402","","","","","","","","5100000","","","","","3","I 41/a :2","-I 4ad","88","","","Powellite","- Ca Mo O4 -","- Ca Mo O4 -","- Ca4 Mo4 O16 -","4","0.25","","Hazen, R. M.; Finger, L. W.; Mariathasan, J. W. E.","High-pressure crystal chemistry of scheelite-type tungstates and molybdates Note: P = 5.10 GPa","Journal of Physics and Chemistry of Solids","1985","46","","253","263","10.1016/0022-3697(85)90039-3","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009638","5.1286","","5.1286","","11.119","","90","","90","","90","","292.458","","","","","","","","5710000","","","","","3","I 41/a :2","-I 4ad","88","","","Powellite","- Ca Mo O4 -","- Ca Mo O4 -","- Ca4 Mo4 O16 -","4","0.25","","Hazen, R. M.; Finger, L. W.; Mariathasan, J. W. E.","High-pressure crystal chemistry of scheelite-type tungstates and molybdates Note: P = 5.71 GPa","Journal of Physics and Chemistry of Solids","1985","46","","253","263","10.1016/0022-3697(85)90039-3","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009732","13.2106","","13.2106","","13.721","","90","","90","","90","","2394.59","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","Ammonioleucite","- Al0.89 K0.34 N0.53 O6 Si2.11 -","- Al0.8898 K0.34 N0.53 O6 Si2.1099 -","- Al14.2368 K5.44 N8.48 O96 Si33.7584 -","16","1","","Yamada, M.; Miyawaki, R.; Nakai, I.; Izumi, F.; Nagashima, K.","A Rietveld analysis of the crystal structure of ammonioleucite","Mineralogical Journal","1998","20","","105","112","10.2465/minerj.20.105","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9009811","5.46979","","5.46979","","12.06339","","90","","90","","90","","360.92","","","","290","","","","","","","","Synthetic","3","I 41/a :2","-I 4ad","88","","","Stolzite","- O4 Pb W -","- O4 Pb W -","- O16 Pb4 W4 -","4","0.25","","Chipaux, R.; Andre, G.; Cousson, A.","Crystal structure of lead tungstate at 1.4 and 300 K Sample: .Top. at T = 290 K Note: Scheelite structure","Journal of Alloys and Compounds","2001","325","","91","94","10.1016/S0925-8388(01)01367-6","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009812","5.46462","","5.46462","","12.04787","","90","","90","","90","","359.774","","","","290","","","","","","","","Synthetic","3","I 41/a :2","-I 4ad","88","","","Stolzite","- O4 Pb W -","- O4 Pb W -","- O16 Pb4 W4 -","4","0.25","","Chipaux, R.; Andre, G.; Cousson, A.","Crystal structure of lead tungstate at 1.4 and 300 K Sample: Bottom, T = 290 K Note: Scheelite structure","Journal of Alloys and Compounds","2001","325","","91","94","10.1016/S0925-8388(01)01367-6","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009813","5.43241","","5.43241","","12.04817","","90","","90","","90","","355.554","","","","290","","","","","","","","Synthetic","3","I 41/a :2","-I 4ad","88","","","Stolzite","- O4 Pb W -","- O4 Pb W -","- O16 Pb4 W4 -","4","0.25","","Chipaux, R.; Andre, G.; Cousson, A.","Crystal structure of lead tungstate at 1.4 and 300 K Sample: Yellow, T = 290 K Note: Scheelite structure","Journal of Alloys and Compounds","2001","325","","91","94","10.1016/S0925-8388(01)01367-6","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009814","5.45961","","5.45961","","12.00222","","90","","90","","90","","357.754","","","","1.4","","","","","","","","Synthetic","3","I 41/a :2","-I 4ad","88","","","Stolzite","- O4 Pb W -","- O4 Pb W -","- O16 Pb4 W4 -","4","0.25","","Chipaux, R.; Andre, G.; Cousson, A.","Crystal structure of lead tungstate at 1.4 and 300 K Sample: Top, T = 1.4 K Note: Scheelite structure","Journal of Alloys and Compounds","2001","325","","91","94","10.1016/S0925-8388(01)01367-6","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009815","5.45565","","5.45565","","11.9923","","90","","90","","90","","356.94","","","","1.4","","","","","","","","Synthetic","3","I 41/a :2","-I 4ad","88","","","Stolzite","- O4 Pb W -","- O4 Pb W -","- O16 Pb4 W4 -","4","0.25","","Chipaux, R.; Andre, G.; Cousson, A.","Crystal structure of lead tungstate at 1.4 and 300 K Sample: Bottom, T = 1.4 K Note: Scheelite structure","Journal of Alloys and Compounds","2001","325","","91","94","10.1016/S0925-8388(01)01367-6","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009963","13.218","","13.218","","13.71","","90","","90","","90","","2395.35","","","","","","","","","","","","River Nidym, Siberian platform, Russia","4","I 41/a :2","-I 4ad","88","","","Analcime","- Al0.94 N0.94 O6 Si2.06 -","- Al0.9399 N0.94 O6 Si2.0601 -","- Al15.0384 N15.04 O96 Si32.9616 -","16","1","","Moroz, N. K.; Seryotkin Yu, V.; Afanasiev, I. S.; Belitzkii, I. A.","Arrangement of extraframework cations in NH4-analcime Note: O5 positions taken from ICSD Note: x(Al1) corrected","Journal of Structural Chemistry","1998","39","","281","283","10.1007/BF02873630","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:33",""
"9011373","5.135","","5.135","","33.882","","90","","90","","90","","893.408","","","","","","","","","","","","Alpine fissures, Pizzo Cervandone area, Ossola Valley, Italy","5","I 41/a :2","-I 4ad","88","","","Paraniite-(Y)","- As Ca2 O12 W2 Y -","- As Ca2 O12 W2 Y -","- As4 Ca8 O48 W8 Y4 -","4","0.25","","Demartin, F.; Gramaccioli, C. M.; Pilati, T.","Structure of a new natural tungstate arsenate, [Ca2Y(AsO4)(WO4)2], structurally related to scheelite Locality: Alpine fissures, Pizzo Cervandone area, Ossola Valley, Italy Note: anisoU's from ICSD","Acta Crystallographica, Section C","1992","48","","1357","1359","10.1107/S0108270192003688","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""
"9012062","5.147","","5.147","","11.7216","","90","","90","","90","","310.524","","","","566","","","","","","","","Synthetic","3","I 41/a :2","-I 4ad","88","","","Clinobisvanite","- Bi O4 V -","- Bi O4 V -","- Bi4 O16 V4 -","4","0.25","","Sleight, A. W.; Chen, H.-Y.; Ferretti, A.; Cox, D. E.","Crystal growth and structure of BiVO4 Sample: T = 566 K","Materials Research Bulletin","1979","14","","1571","1581","10.1016/0025-5408(72)90227-9","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9013186","13.084","","13.084","","13.784","","90","","90","","90","","2359.7","","","","","","","","100","","","P = 0.0001 GPa in air","","6","I 41/a :2","-I 4ad","88","","","Leucite","- Al0.99 Fe0.009 K0.948 Na0.026 O6 Si2.001 -","- Al0.99 Fe0.009 K0.948 Na0.026 O6 Si2.001 -","- Al15.84 Fe0.144 K15.168 Na0.416 O96 Si32.016 -","16","1","","Gatta, G. D.; Rotiroti, N.; Ballaran, T. B.; Pavese, A.","Leucite at high pressure: Elastic behavior, phase stability, and petrological implications Locality: Sabatini volcanic district, Lazium, Italy Note: P = 0.0001 GPa in air","American Mineralogist","2008","93","","1588","1596","10.2138/am.2008.2932","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013187","13.097","","13.097","","13.755","","90","","90","","90","","2359.42","","","","","","","","100","","","P = 0.0001 GPa in diamond cell","Sabatini volcanic district, Lazium, Italy","6","I 41/a :2","-I 4ad","88","","","Leucite","- Al0.99 Fe0.009 K0.948 Na0.026 O6 Si2.001 -","- Al0.99 Fe0.009 K0.948 Na0.026 O6 Si2.001 -","- Al15.84 Fe0.144 K15.168 Na0.416 O96 Si32.016 -","16","1","","Gatta, G. D.; Rotiroti, N.; Ballaran, T. B.; Pavese, A.","Leucite at high pressure: Elastic behavior, phase stability, and petrological implications Note: P = 0.0001 GPa in diamond cell","American Mineralogist","2008","93","","1588","1596","10.2138/am.2008.2932","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9013188","13.053","","13.053","","13.732","","90","","90","","90","","2339.67","","","","","","","","380000","","","","Sabatini volcanic district, Lazium, Italy","6","I 41/a :2","-I 4ad","88","","","Leucite","- Al0.99 Fe0.009 K0.948 Na0.026 O6 Si2.001 -","- Al0.99 Fe0.009 K0.948 Na0.026 O6 Si2.001 -","- Al15.84 Fe0.144 K15.168 Na0.416 O96 Si32.016 -","16","1","","Gatta, G. D.; Rotiroti, N.; Ballaran, T. B.; Pavese, A.","Leucite at high pressure: Elastic behavior, phase stability, and petrological implications Note: P = 0.38 GPa","American Mineralogist","2008","93","","1588","1596","10.2138/am.2008.2932","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9013189","12.955","","12.955","","13.684","","90","","90","","90","","2296.61","","","","","","","","1200000","","","","Sabatini volcanic district, Lazium, Italy","6","I 41/a :2","-I 4ad","88","","","Leucite","- Al0.99 Fe0.009 K0.948 Na0.026 O6 Si2.001 -","- Al0.99 Fe0.009 K0.948 Na0.026 O6 Si2.001 -","- Al15.84 Fe0.144 K15.168 Na0.416 O96 Si32.016 -","16","1","","Gatta, G. D.; Rotiroti, N.; Ballaran, T. B.; Pavese, A.","Leucite at high pressure: Elastic behavior, phase stability, and petrological implications Note: P = 1.20 GPa","American Mineralogist","2008","93","","1588","1596","10.2138/am.2008.2932","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9013190","12.891","","12.891","","13.653","","90","","90","","90","","2268.83","","","","","","","","1770000","","","","Sabatini volcanic district, Lazium, Italy","6","I 41/a :2","-I 4ad","88","","","Leucite","- Al0.99 Fe0.009 K0.948 Na0.026 O6 Si2.001 -","- Al0.99 Fe0.009 K0.948 Na0.026 O6 Si2.001 -","- Al15.84 Fe0.144 K15.168 Na0.416 O96 Si32.016 -","16","1","","Gatta, G. D.; Rotiroti, N.; Ballaran, T. B.; Pavese, A.","Leucite at high pressure: Elastic behavior, phase stability, and petrological implications Note: P = 1.77 GPa","American Mineralogist","2008","93","","1588","1596","10.2138/am.2008.2932","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9013191","13.073","","13.073","","13.731","","90","","90","","90","","2346.67","","","","","","","","100","","","P = 0.0001 GPa in air after decompression","Sabatini volcanic district, Lazium, Italy","6","I 41/a :2","-I 4ad","88","","","Leucite","- Al0.99 Fe0.009 K0.948 Na0.026 O6 Si2.001 -","- Al0.99 Fe0.009 K0.948 Na0.026 O6 Si2.001 -","- Al15.84 Fe0.144 K15.168 Na0.416 O96 Si32.016 -","16","1","","Gatta, G. D.; Rotiroti, N.; Ballaran, T. B.; Pavese, A.","Leucite at high pressure: Elastic behavior, phase stability, and petrological implications Note: P = .0001 GPa in air after decompression","American Mineralogist","2008","93","","1588","1596","10.2138/am.2008.2932","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9015950","5.456","","5.456","","12.02","","90","","90","","90","","357.811","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","Stolzite","- O4 Pb W -","- O16 Pb4 W4 -","- O16 Pb4 W4 -","","","","Moreau, J. M.; Galez, P.; Peigneux, J. P.; Korzhik, M. V.","Structural characterization of PbWO4 and related new phase Pb7W8O(32-x) Note: scheelite structure","Journal of Alloys and Compounds","1996","238","","46","48","10.1016/0925-8388(95)02175-2","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""