# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-05-21T21:11:48+02:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'P 1 2/c 1' 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
"1000254","5.617","0.001","5.595","0.001","11.333","0.002","90","","91.04","0.01","90","","356.1","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Copper hexaoxodivanadate dihydrate","","- Cu H4 O8 V2 -","- Cu H4 O8 V2 -","- Cu2 H8 O16 V4 -","2","0.5","","Leblanc, M; Ferey, G","Room-temperature structures of oxocopper(II) vanadate(V) hydrates, Cu~3~ V~2~ O~8~ (H~2~ O) and Cu V~2~ O~6~ (H2 O)2","Acta Crystallographica C (39,1983-)","1990","46","","15","18","","","","","","","0.045","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001159","8.44","0.003","13.034","0.004","8.203","0.003","90","","112.49","0.02","90","","833.8","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Cyclo-heptathioamidinium","","- H N S7 -","- H1.5 N S7 -","- H6 N4 S28 -","4","1","","Gasperin, M; Freymann, R; Garcia-Fernandez, H","Les Complexes a Transfert de Charge Octasoufre - Sulfurimine. Etude Structurale du Compose Octasoufre - Cyclotetraazathiane (3:1)","Acta Crystallographica B (24,1968-38,1982)","1982","38","","1728","1731","10.1107/S0567740882007043","","","","","","0.039","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001225","15.723","0.004","3.764","0.003","17.118","0.004","90","","113.42","0.02","90","","929.6","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","RUBIDIUM PHOSPHORUS TUNGSTEN OXIDE (1.74/8/28/100)","","- O50 P4 Rb0.87 W14 -","- O50 P4 Rb0.88 W14 -","- O50 P4 Rb0.88 W14 -","1","0.25","","Giroult, J P; Goreaud, M; Labbe, P; Raveau, B","Bronzes with a tunnel structure Rb~x~ P~8~ W~8n~ O~(24n+16)~. III. Rb~x~ P~8~ W~28~ O~100~: A member corresponding to a non-integral n value n=~3.5~","Acta Crystallographica B (24,1968-38,1982)","1982","38","","2342","2347","10.1107/S0567740882008759","","","","","","0.03","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001237","16.194","0.003","3.7719","0.0004","17.095","0.004","90","","93.89","0.02","90","","1041.8","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Rubidium phosphorus tungsten oxide (.8/4/16/56)","","- O56 P4 Rb0.8 W16 -","- O56 P4 Rb0.8 W16 -","- O56 P4 Rb0.8 W16 -","1","0.25","","Giroult, J P; Goreaud, M; Labbe, P; Raveau, B","Rb~x~ P~8~ W~32~ O~112~: A Tunnel Structure Built up from Re O~3~-Type Blocks and P~2~ O~7~ Groups","Acta Crystallographica B (24,1968-38,1982)","1980","36","","2570","2575","10.1107/S0567740880009466","","","","","","0.038","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001341","19.043","0.004","7.128","0.002","8.593","0.002","90","","96.63","","90","","1158.6","","","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Copper dineptunium decafluoride hexahydrate","","- Cu F10 H12 Np2 O6 -","- Cu F10 H12 Np2 O6 -","- Cu2 F20 H24 Np4 O12 -","2","0.5","","Cousson, A; Abazli, H; Jove, J; Gasperin, M","Synthese et etude structurale des composes Co Np~2~ F~10~ (H~2~ O)~8~ et Cu Np~2~ F~10~ (H~2~ O)~6~","Journal of the Less-Common Metals","1985","109","","155","168","10.1016/0022-5088(85)90115-8","","","","","","0.029","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001449","13.904","0.006","6.453","0.003","20.64","0.01","90","","125.05","0.01","90","","1516","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Tetrapotassium octaniobium pentaphosphate","","- K4 Nb8 O34 P5 -","- K4 Nb8 O34 P5 -","- K8 Nb16 O68 P10 -","2","0.5","","Benabbas, A; Borel, M M; Grandin, A; Leclaire, A; Raveau, B","The niobium phosphate bronze K~5-x~Nb~8~P~5~O~34~, a new tunnel structure, first member of the series (K~3~Nb~6~P~4~O~26~)~n~ . KNb~2~PO~8~","Journal of Solid State Chemistry","1990","87","","360","365","10.1016/0022-4596(90)90038-Y","","","","","","0.029","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001507","13.747","0.002","6.446","0.001","20.588","0.003","90","","124.94","0.01","90","","1495.5","","","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Potassium niobium aluminium phosphate *","","- Al0.8 K5 Nb7.2 O34 P5 -","- Al0.8 K5 Nb7.2 O34 P5 -","- Al1.6 K10 Nb14.4 O68 P10 -","2","0.5","","Leclaire, A.; Guerioune, M.; Borel, M. M.; Grandin, A.; Raveau, B.","Insertion of potassium in the α-K~4~Nb~8~P~5~O~34~ structure: the niobium phosphates α-K~5~Nb~8-x~M~x~P~5~O~34~","European Journal of Solid State and Inorganic Chemistry","1992","29","","473","483","","","","","","","0.048","","","","","","","","","","","","","","","has coordinates","200144","2020-10-21","18:00:00",""
"1001751","5.0289","0.0004","5.8596","0.0005","5.0715","0.0006","90","","91.519","0.008","90","","149.4","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Cadmium tungstate","","- Cd O4 W -","- Cd O4 W -","- Cd2 O8 W2 -","2","0.5","","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","","","","","","","0.037","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001845","19.58899","0.003","3.7681","0.0002","16.96999","0.003","90","","91.864","0.014","90","","1251.9","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Potassium phosphorus tungsten oxide (1/4/20/67)","","- K O67 P4 W20 -","- K O67 P4 W20 -","- K O67 P4 W20 -","1","0.25","","Labbe, P; Ouachee, D; Goreaud, M; Raveau, B","Bronzes with a Tunnel Structure Kx P4 O8 (W O3)2m: The Tenth Member of the Series - K P8 W40 O136","Journal of Solid State Chemistry","1983","50","","163","172","10.1016/0022-4596(83)90184-6","","","","","","0.04","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1004042","12.456","0.005","7.483","0.004","7.185","0.004","90","","91.24","0.02","90","","669.5","","","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Dipotassium imidobis(sulfonate)","","- H K2 N O6 S2 -","- H K2 N O6 S2 -","- H2 K4 N2 O12 S4 -","2","0.5","","Barbier, P; Parent, Y; Mairesse, G","Crystal structure of K~3~ N (S O~3~)~2~ H~2~ O (I) and fefinement of the crystal structure of K~2~ N H (S O~3~)~2~ (II)","Acta Crystallographica B (24,1968-38,1982)","1979","35","","1308","1312","10.1107/S0567740879006324","","","","","","0.043","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1004118","11.633","0.007","5.795","0.003","24.39","0.02","90","","101.35","0.05","90","","1612.1","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Bismuth molybdenum vanadium oxide (26/6.14/3.86/68)","","- Bi26 Mo6.14 O68 V3.86 -","- Bi26 Mo6.14 O68 V3.86 -","- Bi26 Mo6.14 O68 V3.86 -","1","0.25","","Vannier, R N; Mairesse, G; Abraham, F; Nowogorocki, G","Bi26 Mo10 Od solid solution type in the Bi2 O3 - Mo O3 - V2 O5 ternary diagram","Journal of Solid State Chemistry","1996","122","","394","406","10.1006/jssc.1996.0133","","","","","","0.041","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1004131","11.742","0.008","5.8","0.007","24.76999","0.05","90","","102.94","0.06","90","","1644.1","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Bismuth molybdenum oxide (26/10/69)","","- Bi26 Mo10 O69 -","- Bi26 Mo10 O68.5 -","- Bi26 Mo10 O68.5 -","1","0.25","","Vannier, R N; Mairesse, G; Abraham, F; Nowogorocki, G","Bi26 Mo10 Od solid solution type in the Bi2 O3 - Mo O3 - V2 O5 ternary diagram","Journal of Solid State Chemistry","1996","122","","394","406","10.1006/jssc.1996.0133","","","","","","0.048","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1004134","11.7525","0.0002","5.8005","0.0001","24.8024","0.0004","90","","102.867","0.001","90","","1648.3","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Bismuth molybdenum oxide (26.4/9.6/68.4)","","- Bi26.4 Mo9.6 O68.4 -","- Bi26.4 Mo9.6 O68.4 -","- Bi26.4 Mo9.6 O68.4 -","1","0.25","","Vannier, R-N; Abraham, F; Nowogrocki, G; Mairesse, G","New structural and electrical data on Bi-Mo mixed oxides with a structure based on (B12 O14)(infinite) columns","Journal of Solid State Chemistry","1999","142","","294","304","10.1006/jssc.1998.8034","","","","","","0.0476","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1010642","4.68","","5.66","","4.92","","90","","89.67","","90","","130.3","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Magnesium tungstate","","- Mg O4 W -","- Mg O2 W -","- Mg2 O4 W2 -","2","0.5","","Broch, E K","Untersuchungen ueber Kristallstrukturen des Wloframittypus und des Scheelittypus","Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo 1: Matematisk- Naturvidenskapelig Klasse","1929","1929","","1","618","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1100533","10.532","0.003","13.185","0.004","23.378","0.007","90","","96.33","0.02","90","","3226.58","","","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C44 H96 Fe4 N4 P4 Si4 -","- C88 H192 Fe8 N8 P8 Si8 -","- C176 H384 Fe16 N16 P16 Si16 -","2","0.5","","Riese, Ulrike; Harms, Klaus; Pebler, Jürgen; Dehnicke, Kurt","Phosphaniminato-Cluster von Eisen. Die Kristallstrukturen von [FeCl(NPEt~3~)]~4~, [Fe(C=C-SiMe~3~)(NPEt~3~)]~4~ und [Fe~3~Cl~4~{NP(NMe~2~)~3~}~3~]","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","5","746","754","10.1002/(sici)1521-3749(199905)625:5<746::aid-zaac746>3.0.co;2-h","","","","","","","","","","","","","","","","","","","","","has coordinates","177977","2020-10-21","18:00:00",""
"1501600","19.758","0.0012","10.8646","0.0007","36.649","0.002","90","","90.759","0.003","90","","7866.5","0.8","223","2","223","2","","","","","","","Synthesized by the authors. See text","5","P 1 2/c 1","-P 2yc","13","","","","- C136 H216 N30 O43 S4 -","- C80 H104 N30 O15 S4 -","- C160 H208 N60 O30 S8 -","2","0.5","","Laliberté, Dominic; Maris, Thierry; Sirois, Ariane; Wuest, James D.","Molecular Tectonics. Dendritic Construction of Porous Hydrogen-Bonded Networks","Organic Letters","2003","5","25","4787","4790","10.1021/ol035712j","","","1.54178","CuKα","","0.1337","0.097","","","0.2195","0.2326","","","","","","1.041","","","","has coordinates,has disorder","219237","2020-10-21","18:00:00",""
"1502057","9.3516","0.0007","17.7586","0.0014","8.2539","0.0007","90","","92.802","0.005","90","","1369.1","0.19","143","1","143","1","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C10 H14 B F3 K N O2 S -","- C10 H14 B F3 K N O2 S -","- C40 H56 B4 F12 K4 N4 O8 S4 -","4","1","","Molander, Gary A.; Fleury-Brégeot, Nicolas; Hiebel, Marie-Aude","Synthesis and cross-coupling of sulfonamidomethyltrifluoroborates.","Organic letters","2011","13","7","1694","1697","10.1021/ol200202g","","","0.71073","MoKα","","0.0494","0.0425","","","0.1065","0.1154","","","","","","1.005","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1502744","12.8954","0.001","5.5486","0.0004","20.0322","0.0015","90","","106.472","0.002","90","","1374.51","0.18","147","2","147","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C20 H14 O -","- C20 H14 O -","- C80 H56 O4 -","4","1","","Schwerin, Andrew F.; Johnson, Justin C.; Smith, Millicent B.; Sreearunothai, Paiboon; Popović, Duska; Cerný, Jirí; Havlas, Zdenek; Paci, Irina; Akdag, Akin; MacLeod, Matthew K.; Chen, Xudong; David, Donald E.; Ratner, Mark A.; Miller, John R.; Nozik, Arthur J.; Michl, Josef","Toward designed singlet fission: electronic states and photophysics of 1,3-diphenylisobenzofuran.","The journal of physical chemistry. A","2010","114","3","1457","1473","10.1021/jp907401t","","","0.71073","MoKα","","0.1113","0.0646","","","0.1499","0.1712","","","","","","1.045","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1503090","15.444","0.004","7.4809","0.0017","14.862","0.003","90","","116.866","0.004","90","","1531.7","0.6","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C21 H12 N2 O2 -","- C21 H12 N2 O2 -","- C84 H48 N8 O8 -","4","1","","Saha, Sukdeb; Ghosh, Amrita; Mahato, Prasenjit; Mishra, Sandhya; Mishra, Sanjiv K.; Suresh, E.; Das, Satyabrata; Das, Amitava","Specific recognition and sensing of CN- in sodium cyanide solution.","Organic letters","2010","12","15","3406","3409","10.1021/ol101281x","","","0.71073","MoKα","","0.1114","0.0934","","","0.172","0.1798","","","","","","1.308","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1503889","6.7325","0.001","12.196","0.002","15.301","0.002","90","","101.739","0.01","90","","1230.1","0.3","293","2","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C27 H35 B F2 N2 -","- C27 H35 B F2 N2 -","- C54 H70 B2 F4 N4 -","2","0.5","","Ozdemir, Tugba; Atilgan, Serdar; Kutuk, Ilker; Yildirim, Leyla T.; Tulek, Abdullah; Bayindir, Mehmet; Akkaya, Engin U.","Solid-state emissive BODIPY dyes with bulky substituents as spacers.","Organic letters","2009","11","10","2105","2107","10.1021/ol9005568","","x-ray","0.71073","MoKα","","","0.0738","","","","0.2193","","","","","","0.883","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1503927","11.269","0.003","5.309","0.0016","12.835","0.004","90","","90.832","0.005","90","","767.8","0.4","100","2","100","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C16 H20 O7 -","- C16 H20 O7 -","- C32 H40 O14 -","2","0.5","","Schneider, Tobias F.; Kaschel, Johannes; Dittrich, Birger; Werz, Daniel B.","anti-Oligoannelated THF moieties: synthesis via push-pull-substituted cyclopropanes.","Organic letters","2009","11","11","2317","2320","10.1021/ol900694m","","","0.71073","MoKα","","0.0806","0.0556","","","0.1256","0.1408","","","","","","1.082","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1504623","15.3542","0.0003","4.9003","0.0001","21.7359","0.0004","90","","96.509","0.001","90","","1624.87","0.05","90","0.2","90","0.2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C38 H36 F6 S2 -","- C38 H36 F6 S2 -","- C76 H72 F12 S4 -","2","0.5","","Wang, Yongfeng; Parkin, Sean R.; Gierschner, Johannes; Watson, Mark D.","Highly fluorinated benzobisbenzothiophenes.","Organic letters","2008","10","15","3307","3310","10.1021/ol8003468","","","1.54178","CuKα","","0.071","0.0655","","","0.1762","0.1817","","","","","","1.053","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1504839","13.769","0.002","11.3446","0.0017","19.385","0.003","90","","107.107","0.003","90","","2894","0.8","193","2","193","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C54 H84 O4 Si4 -","- C54 H84 O4 Si4 -","- C108 H168 O8 Si8 -","2","0.5","","Chung, Mee-Kyung; Lightbody, Owen C.; Stryker, Jeffrey M.","Ortho-silylated derivatives of tetrakis(2-hydroxyphenyl)ethene: a sterically isolated structural model for oxo-surface binding domains.","Organic letters","2008","10","17","3825","3828","10.1021/ol801427w","","","0.71073","MoKα","","0.0875","0.0586","","","0.1581","0.1741","","","","","","1.041","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1504897","7.9753","0.0009","16.4471","0.0019","19.293","0.003","90","","99.295","0.009","90","","2497.4","0.6","292","3","292","3","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C23 H26 N5 O5 -","- C23 H26 N5 O5 -","- C92 H104 N20 O20 -","4","1","","Yu, Ming-Ming; Li, Zhan-Xian; Wei, Liu-He; Wei, Dong-Hui; Tang, Ming-Sheng","A 1,8-naphthyridine-based fluorescent chemodosimeter for the rapid detection of Zn2+ and Cu2+.","Organic letters","2008","10","22","5115","5118","10.1021/ol8018192","","","0.71073","MoKα","","0.1607","0.0882","","","0.1867","0.2051","","","","","","1.531","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1504935","35.377","0.004","10.0059","0.0012","25.216","0.003","90","","105.136","0.005","90","","8616.3","1.8","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C48 H36 Cl6 O6 -","- C48 H36 Cl6 O6 -","- C384 H288 Cl48 O48 -","8","2","","Wadumethrige, Shriya H.; Rathore, Rajendra","A facile synthesis of elusive alkoxy-substituted hexa-peri-hexabenzocoronene.","Organic letters","2008","10","22","5139","5142","10.1021/ol8020429","","","1.54178","CuKα","","0.212","0.1474","","","0.3897","0.4204","","","","","","1.012","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505744","11.6887","","5.8139","","24.7151","","90","","101.838","","90","","1643.84","","","","298","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Ba0.5 Bi6 Mo2.5 O17 -","- Ba0.5 Bi6 Mo2.5 O17 -","- Ba2 Bi24 Mo10 O68 -","4","1","","Muktha, B.; Aarthi, T.; Madras, Giridhar; Guru Row, T. N.","Substitution effect on the photocatalytic degradation by the series AxBi26-xMo10O68+0.5y (A = Ba, y = 0; A = Bi, La, y = 2): a kinetic study.","The journal of physical chemistry. B","2006","110","21","10280","10286","10.1021/jp060945o","","","0.71073","MoKα","","0.0558","0.0558","","","0.1374","0.1374","","","","1.24","1.24","1.24","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505782","35.831","0.004","6.1603","0.0008","17.0632","0.0017","90","","90.397","0.008","90","","3766.3","0.7","183","2","183","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C40 H24.4 Cl7.6 O6 -","- C40 H24.4 Cl7.6 O6 -","- C160 H97.6 Cl30.4 O24 -","4","1","","Ben-Haida, Abderrazak; Colquhoun, Howard M.; Hodge, Philip; Williams, David J.","Synthesis of a Catechol-Based Poly(ether ether ketone) (“o-PEEK”) by Classical Step-Growth Polymerization and by Entropically Driven Ring-Opening Polymerization of Macrocyclic Oligomers","Macromolecules","2006","39","19","6467","","10.1021/ma060885k","","","1.54178","CuKα","","0.0866","0.0579","","","0.148","0.1627","","","","","","1.024","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1506124","20.041","0.008","9.284","0.004","21.351","0.008","90","","104.917","0.007","90","","3839","3","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C27.5 H28 Cl4 I N3 O4 -","- C27.5 H28 Cl4 I N3 O4 -","- C110 H112 Cl16 I4 N12 O16 -","4","1","","Rege, Pankaj D.; Tian, Yuan; Corey, E. J.","Studies of new indole alkaloid coupling methods for the synthesis of haplophytine.","Organic letters","2006","8","14","3117","3120","10.1021/ol061319c","","","0.71073","MoKα","","0.1665","0.0746","","","0.2419","0.2622","","","","","","0.944","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506867","22.4112","0.0003","4.59","","24.6403","0.0003","90","","113.19","0.001","90","","2329.89","0.05","120","2","120","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C26 H32 Br2 -","- C26 H32 Br2 -","- C104 H128 Br8 -","4","1","","Heeney, Martin; Bailey, Clare; Giles, Mark; Shkunov, Maxim; Sparrowe, David; Tierney, Steve; Zhang, Weimin; McCulloch, Iain","Alkylidene Fluorene Liquid Crystalline Semiconducting Polymers for Organic Field Effect Transistor Devices","Macromolecules","2004","37","14","5250","","10.1021/ma049798n","","","0.71073","MoKα","","0.0345","0.0272","","","0.0663","0.0699","","","","","","1.01","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1507562","22.44","0.002","5.2005","0.0004","31.963","0.003","90","","107.996","0.002","90","","3547.6","0.5","223","2","223","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C28 H24 N2 O4 S12 -","- C28 H24 N2 O4 S12 -","- C112 H96 N8 O16 S48 -","4","1","","Zhu, Qin-Yu; Han, Qiong-Hua; Shao, Ming-Yan; Gu, Jing; Shi, Zheng; Dai, Jie","Supramolecular and redox chemistry of tetrathiafulvalene monocarboxylic Acid with hydrogen-bonded pyridine and bipyridine molecules.","The journal of physical chemistry. B","2012","116","14","4239","4247","10.1021/jp2124179","","","0.71075","MoKα","","0.0882","0.0643","","","0.1255","0.1414","","","","","","1.093","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1507765","8.528","0.0007","7.3938","0.0006","13.2368","0.0011","90","","128.777","0.002","90","","650.67","0.09","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C6 H20 Al2 F10 N4 -","- C6 H20 Al2 F10 N4 -","- C12 H40 Al4 F20 N8 -","2","0.5","","Adil, K; Le Bail, A; Dujardin, G; Maisonneuve, V","A new 1D hybrid fluoroaluminate templated by an original tetramine","Polyhedron","2007","26","","2493","2497","10.1016/j.poly.2006.12.041","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1507814","24.3452","0.0014","8.79","0.0004","13.733","0.0009","90","","103.263","0.005","90","","2860.4","0.3","193","2","193","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","1-methyl-2,3,7-trimethoxyphenanthren-9-10-chinon","","- C18 H16 O5 -","- C18 H16 O5 -","- C144 H128 O40 -","8","2","","Trosien, Simon; Waldvogel, Siegfried R.","Synthesis of highly functionalized 9,10-phenanthrenequinones by oxidative coupling using MoCl5.","Organic letters","2012","14","12","2976","2979","10.1021/ol300948u","","","0.71073","MoKα","","0.0623","0.0436","","","0.1108","0.1221","","","","","","1.012","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1507897","11.582","0.002","13.466","0.003","24.641","0.005","90","","98.69","0.03","90","","3799","1.4","113","2","113","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C64 H82 Cl3 Gd N8 Ni2 O37 -","- C64 H72 Cl3 Gd N8 Ni2 O37 -","- C128 H144 Cl6 Gd2 N16 Ni4 O74 -","2","0.5","","Wang, D; Niu, C J; Li, X Z; Zhu, L N; Hao, P P","Syntheses, crystal structures and properties of lanthanide complexes featuring infinite molecular rectangle strands constructed from a new macrocyclic metalloligand","Inorganica Chimica Acta","2012","391","","20","27","10.1016/j.ica.2012.05.005","","","0.71073","MoKα","","0.0766","0.0586","","","0.1476","0.1578","","","","","","1.05","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1507898","11.587","0.002","13.463","0.003","24.707","0.005","90","","98.95","0.03","90","","3807.3","1.4","113","2","113","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C64 H82 Cl3 N8 Ni2 O37 Sm -","- C64 H76 Cl3 N8 Ni2 O37 Sm -","- C128 H152 Cl6 N16 Ni4 O74 Sm2 -","2","0.5","","Wang, D; Niu, C J; Li, X Z; Zhu, L N; Hao, P P","Syntheses, crystal structures and properties of lanthanide complexes featuring infinite molecular rectangle strands constructed from a new macrocyclic metalloligand","Inorganica Chimica Acta","2012","391","","20","27","10.1016/j.ica.2012.05.005","","","0.71073","MoKα","","0.0892","0.0604","","","0.1411","0.1595","","","","","","1.054","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1507899","11.569","0.002","13.459","0.003","24.824","0.005","90","","98.98","0.03","90","","3817.9","1.4","113","2","113","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C64 H82 Cl3 N8 Ni2 O37 Pr -","- C64 H76 Cl3 N8 Ni2 O37 Pr -","- C128 H152 Cl6 N16 Ni4 O74 Pr2 -","2","0.5","","Wang, D; Niu, C J; Li, X Z; Zhu, L N; Hao, P P","Syntheses, crystal structures and properties of lanthanide complexes featuring infinite molecular rectangle strands constructed from a new macrocyclic metalloligand","Inorganica Chimica Acta","2012","391","","20","27","10.1016/j.ica.2012.05.005","","","0.71073","MoKα","","0.1268","0.0753","","","0.1614","0.188","","","","","","1.049","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1508196","10.0743","0.0018","9.9792","0.0017","24.924","0.005","90","","90.988","0.003","90","","2505.3","0.8","100","","100","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C57 H90 Ge O3 -","- C57 H90 Ge O3 -","- C114 H180 Ge2 O6 -","2","0.5","","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","","0.0287","0.0275","","","0.068","0.0689","","","","","","1.068","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1508382","7.8124","0.0014","6.6564","0.0011","30.444","0.006","90","","96.062","0.002","90","","1574.3","0.5","93","","93","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H16 Br0.79 Cl1.21 Cu S16 -","- C20 H16 Br0.794 Cl1.206 Cu S16 -","- C40 H32 Br1.588 Cl2.412 Cu2 S32 -","2","0.5","","Kubo, Kazuya; Yamashita, Masahiro","New BEDT-TTF Radical Cation Salt with Mixed Anions: α'-[BEDT-TTF]2[CuBr2]0.4[CuCl2]0.6","Crystals","2012","2","2","284","293","10.3390/cryst2020284","","","0.71073","MoKα","","0.0417","0.0349","","","0.0747","0.0803","","","","","","1.188","","","","has coordinates,has disorder","210192","2020-10-21","18:00:00",""
"1508609","13.471","0.002","9.2889","0.0014","19.222","0.002","90","","134.152","0.006","90","","1725.8","0.4","223","","223","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C37 H44 Ag F3 N4 O3 S -","- C37 H44 Ag F3 N4 O3 S -","- C74 H88 Ag2 F6 N8 O6 S2 -","2","0.5","","Habata, Yoichi; Ikeda, Mari; Yamada, Sachiko; Takahashi, Hiroki; Ueno, Sumiko; Suzuki, Takatoshi; Kuwahara, Shunsuke","Argentivorous molecules: structural evidence for Ag(+)-π interactions in solution.","Organic letters","2012","14","17","4576","4579","10.1021/ol3019538","","","0.71073","MoKα","","0.0535","0.0482","","","0.1325","0.1384","","","","","","1.041","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1508770","14.5477","0.0006","9.8838","0.0003","14.5179","0.0007","90","","107.769","0.003","90","","1987.89","0.14","223","2","223","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C22 H22 F6 N2 -","- C22 H22 F6 N2 -","- C88 H88 F24 N8 -","4","1","","Müller, Christian H; Fröhlich, Roland; Daniliuc, Constantin G.; Hennecke, Ulrich","Efficient Synthesis of Chiral 2,2'-Bipyrrolidines by an anti-Selective Alkene Diamination.","Organic letters","2012","14","23","5944","5947","10.1021/ol302855z","","","1.54178","CuKα","","0.0654","0.057","","","0.1469","0.156","","","","","","1.032","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1508866","9.4219","0.0002","8.6467","0.0002","18.7345","0.0013","90","","103.222","0.007","90","","1485.81","0.12","150","0.2","150","0.2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C12 H18 F6 N2 O2 -","- C12 H18 F6 N2 O2 -","- C48 H72 F24 N8 O8 -","4","1","","Riofski, Mark V.; Hart, Allison D.; Colby, David A.","Amidinate salt of hexafluoroacetone hydrate for the preparation of fluorinated compounds by the release of trifluoroacetate.","Organic letters","2013","15","1","208","211","10.1021/ol303291x","","","1.54184","CU-Kα","","0.073","0.047","","","0.107","0.153","","","","","","1.166","","","","has coordinates","288505","2023-12-22","15:12:00",""
"1509207","8.95","","4.478","","14.62","","90","","145.35","","90","","333.144","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Au Ag Te4","","- Ag Au Te4 -","- Ag Au Te4 -","- Ag2 Au2 Te8 -","2","0.5","","Pertlik, F.","Kristallchemie natuerlicher Telluride. I: Verfeinerung der Kristallstruktur des Sylvanits, Au Ag Te4","TMPM. Tschermaks Mineralogische und Petrographische Mitteilungen (1979-)","1984","33","","203","212","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509398","10.44","","5.87","","5.07","","90","","90","","90","","310.704","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Ag In (W O4)2","","- Ag In O8 W2 -","- Ag In O8 W2 -","- Ag2 In2 O16 W4 -","2","0.5","","Okunera, A.S.; Pakhomov, V.I.; Sorokina, O.V.; Fedorov, P.M.","Structure and elastic properties of Ag In (W O4)2","Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR))","1977","3","","765","767","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509505","6.755","","10.684","","5.921","","90","","106.62","","90","","409.469","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Ag V (P S3)2","","- Ag P2 S6 V -","- Ag P2 S6 V -","- Ag2 P4 S12 V2 -","2","0.5","","Ouvrard, G.; Colombet, P.; Brec, R.; Lee, S.","A new chain compound of vanadium (III): Ag1/2 V1/2 P S3 structure, metal ordering, and magnetic properties","Materials Research Bulletin","1986","21","","917","928","10.1016/0025-5408(86)90129-7","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510139","4.8532","","6.3429","","10.0443","","90","","92.759","","90","","308.839","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Li (Au F4)","","- Au F4 Li -","- Au F4 Li -","- Au4 F16 Li4 -","4","1","","Engelmann, U.; Mueller, B.G.","Darstellung und Struktur der Tetrafluoroaurate(III) M(I)(AuF4) mit M(I) = Li, Rb","Zeitschrift fuer Anorganische und Allgemeine Chemie","1991","598","","103","110","10.1002/zaac.19915980110","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510210","14.949","","4.858","","13.723","","90","","93.86","","90","","994.334","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","K3 (Au (Se5)2 (Se3))","","- Au K3 Se13 -","- Au K3 Se13 -","- Au2 K6 Se26 -","2","0.5","","Park, Y.; Kanatzidis, M.G.","Niedrigdimensionale Polychalcogenid-Verbindungen: Die ungewoehnlichen Strukturen von (AuSe5)n(n-) und (AuSe13)n(3n-)","Angewandte Chemie (German Edition)","1990","102","","945","946","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510423","7.074","","9.773","","11.994","","90","","122.9","","90","","696.209","","","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","K6 Na (I O6) (Au O)2","","- Au2 I K6 Na O8 -","- Au2 I K6 Na O8 -","- Au4 I2 K12 Na2 O16 -","2","0.5","","Hoppe, R.; Schneider, J.","Das erste quinquinaere Oxoaurat(I) K6 Na (I O6) (Au O)2 = K6 (Na I O6) (Au O2/2)2","Zeitschrift fuer Anorganische und Allgemeine Chemie","1989","574","","54","64","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510922","6.8822","","4.9945","","12.5748","","90","","92.954","","90","","431.661","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","K Zn4 B3 O9","","- B3 K O9 Zn4 -","- B3 K O9 Zn4 -","- B6 K2 O18 Zn8 -","2","0.5","","Cheng, W.-D.; Kan, Z.-G.; Zhang, H.; Gong, Y.-J; Zhang, Y.-J.; Chen, D.-G.; Wu, D.-S.","Synthesis, band structures and optical properties of Zn3 B2 O6 and K Zn4 B3 O9","Solid State Sciences","2005","7","","179","188","10.1016/j.solidstatesciences.2004.09.001","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511692","24.577","","7.334","","25.493","","90","","106.708","","90","","4401.06","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","","","- B8 F12 -","- B8 F12 -","- B128 F192 -","16","4","","Pardoe, J.A.J.; Parsons, S.; Mackie, I.; Norman, N.C.; Pulham, C.R.; Rankin, D.W.H.; Timms, P.L.","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",""
"1514322","16.1473","0.0008","4.7928","0.0002","9.2488","0.0005","90","","90.212","0.005","90","","715.77","0.06","10","2","10","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Co adipate","","","- C6 H8 Co O4 -","- C6 H8 Co O4 -","- C24 H32 Co4 O16 -","4","1","","Saines, Paul J.; Barton, Phillip T.; Jura, Marek; Knight, Kevin S.; Cheetham, Anthony K.","Cobalt adipate, Co(C6H8O4): antiferromagnetic structure, unusual thermal expansion and magnetoelastic coupling","Materials Horizons","2014","1","3","332","","10.1039/c4mh00009a","","","0.71073","MoKα","","0.0847","0.0725","","","0.1898","0.1986","","","","","","1.178","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1514418","18.742","0.004","13.442","0.003","18.553","0.004","90","","114.4","0.003","90","","4256.6","1.6","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C65 H5 N O5 -","- C65 H5 N O5 -","- C260 H20 N4 O20 -","4","1","","Yu, Yuming; Shi, Lijun; Yang, Dazhi; Gan, Liangbing","Molecular containers with a dynamic orifice: open-cage fullerenes capable of encapsulating either H2O or H2 under mild conditions","Chemical Science","2013","4","2","814","","10.1039/c2sc21760k","","","0.71073","MoKα","","0.0789","0.0621","","","0.1519","0.1607","","","","","","1.038","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1514420","19.163","0.006","13.468","0.004","18.553","0.007","90","","114.32","0.004","90","","4363","3","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C68 H9 N O7 -","- C68 H9 N O7 -","- C272 H36 N4 O28 -","4","1","","Yu, Yuming; Shi, Lijun; Yang, Dazhi; Gan, Liangbing","Molecular containers with a dynamic orifice: open-cage fullerenes capable of encapsulating either H2O or H2 under mild conditions","Chemical Science","2013","4","2","814","","10.1039/c2sc21760k","","","0.71073","MoKα","","0.184","0.119","","","0.2952","0.3354","","","","","","1.068","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1514852","18.0616","0.0002","14.969","0.0002","18.2262","0.0003","90","","108.69","0.0008","90","","4667.84","0.11","150","","150","","","","105","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C70 H126 Lu4 N16 Na4 O43 -","- C70 H126 Lu4 N16 Na4 O43 -","- C140 H252 Lu8 N32 Na8 O86 -","2","0.5","","Allain, Clémence; Beer, Paul D.; Faulkner, Stephen; Jones, Michael W.; Kenwright, Alan M.; Kilah, Nathan L.; Knighton, Richard C.; Sørensen, Thomas Just; Tropiano, Manuel","Lanthanide appended rotaxanes respond to changing chloride concentration","Chemical Science","2013","4","1","489","","10.1039/c2sc21614k","","","0.71073","MoKα","","0.0723","0.0641","","0.1746","0.168","0.1745","","","","","","0.9954","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"1514969","14.883","0.009","11.843","0.01","19.893","0.01","90","","118.38","0.04","90","","3085","4","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C56 H48 Ag2 F12 N12 O4 P2 -","- C56 H48 Ag2 F12 N12 O4 P2 -","- C112 H96 Ag4 F24 N24 O8 P4 -","2","0.5","","Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong","Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes","Chemical Science","2012","3","2","359","","10.1039/c1sc00615k","","","0.71073","MoKα","","0.2709","0.0982","","","0.2019","0.2388","","","","","","1.059","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1515111","18.893","0.002","8.2648","0.0009","17.927","0.002","90","","108.099","0.002","90","","2660.7","0.5","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","6satMesBr2","","","- C23 H29 Br2 Cl3 N2 -","- C23 H29 Br2 Cl3 N2 -","- C92 H116 Br8 Cl12 N8 -","4","1","","Wiggins, Kelly M.; Moerdyk, Jonathan P.; Bielawski, Christopher W.","Homonuclear bond activation using a stable N,N′-diamidocarbene","Chemical Science","2012","3","10","2986","","10.1039/c2sc20639k","","","0.71075","MoKα","","0.063","0.0528","","","0.1352","0.1419","","","","","","1.006","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516473","12.998","0.005","5.59","0.002","20.271","0.008","90","","106.215","0.009","90","","1414.3","0.9","298","2","298","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C20 H14 O -","- C20 H14 O -","- C80 H56 O4 -","4","1","","Ryerson, Joseph L.; Schrauben, Joel N.; Ferguson, Andrew J.; Sahoo, Subash Chandra; Naumov, Panče; Havlas, Zdenĕk; Michl, Josef; Nozik, Arthur J.; Johnson, Justin C.","Two Thin Film Polymorphs of the Singlet Fission Compound 1,3-Diphenylisobenzofuran","The Journal of Physical Chemistry C","2014","118","23","12121","","10.1021/jp502122d","","","0.71073","MoKα","","0.0491","0.0367","","","0.0939","0.1031","","","","","","1.046","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516658","11.0052","0.0002","13.4251","0.0002","14.8416","0.0003","90","","102.384","0.001","90","","2141.76","0.07","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C53 H33 Cl3 N6 O2 -","- C53 H33 Cl3 N6 O2 -","- C106 H66 Cl6 N12 O4 -","2","0.5","","Leung, Man-kit; Yang, Chih-Chiang; Lee, Jiun-Haw; Tsai, Hsin-Hung; Lin, Chi-Feng; Huang, Chih-Yen; Su, Yuhlong Oliver; Chiu, Chi-Feng","The unusual electrochemical and photophysical behavior of 2,2'-bis(1,3,4-oxadiazol-2-yl)biphenyls, effective electron transport hosts for phosphorescent organic light emitting diodes.","Organic letters","2007","9","2","235","238","10.1021/ol062668+","","","0.71073","MoKα","","0.107","0.078","","","0.2245","0.249","","","","","","1.722","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1517088","8.7677","0.0014","4.8934","0.0008","25.862","0.004","90","","93.889","0.003","90","","1107","0.3","100","2","100","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C20 Cl10 N6 -","- C20 Cl10 N6 -","- C40 Cl20 N12 -","2","0.5","","Zheng, Shijun; Thompson, Joe D.; Tontcheva, Ana; Khan, Saeed I.; Rubin, Yves","Perchloro-2,5,8-triazaphenalenyl radical.","Organic letters","2005","7","9","1861","1863","10.1021/ol050570+","","","0.71073","MoKα","","0.0605","0.0419","","","0.0987","0.1039","","","","","","1","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1517124","10.841","0.0006","6.875","0.0002","12.0651","0.0006","90","","98.538","0.005","90","","889.27","0.07","150","1","150","1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C15 H16 Br2 Cl2 O4 V -","- C15 H16 Br2 Cl2 O4 V -","- C30 H32 Br4 Cl4 O8 V2 -","2","0.5","","Iva Klepalova; Jan Honzicek; Jaromir Vinklarek; Zdenka Padelkova; Lucie Sebestova; Martina Rezacova","Vanadocene and niobocene dihalides containing electron-withdrawing substituents in the cyclopentadienyl rings: Synthesis, characterization and cytotoxicity","Inorganica Chimica Acta","2013","402","","109","115","","","","0.71073","MoKα","","0.0369","0.03","","","0.0698","0.0736","","","","","","1.09","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1517131","15.6","0.003","9.6539","0.0019","20.651","0.008","90","","112.25","0.02","90","","2878.5","1.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C60 H58 Co N14 O8 -","- C60 H58 Co N14 O8 -","- C120 H116 Co2 N28 O16 -","2","0.5","","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","","0.065","0.0443","","","0.136","0.1505","","","","","","1.03","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1517598","6.9972","0.0002","10.0161","0.0003","13.8929","0.0005","90","","124.842","0.002","90","","799.13","0.05","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C16 H16 Mn N2 O10 -","- C16 H16 Mn N2 O10 -","- C32 H32 Mn2 N4 O20 -","2","0.5","","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","","0.0421","0.0293","","","0.0743","0.0794","","","","","","1.001","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1518174","8.938","0.002","6.369","0.001","7.83","0.002","90","","116.23","0.03","90","","399.83","0.18","","","293","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Ca F5 Mn -","- Ca F5 Mn -","- Ca4 F20 Mn4 -","4","1","","Wandner, K.-H.; Hoppe, R.","Zum Jahn-Teller-effekt bei Mn(III)-fluoriden: CaMnF5","Revue de Chimie Minerale","1986","23","","520","531","","","x-ray","0.71069","MoKα","","","0.096","","","0.054","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1518198","13.991","0.003","6.494","0.001","20.814","0.005","90","","125.24","0.02","90","","1544.5","0.7","","","293","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- K5 Nb6 O34 P5 Zr2 -","- K4.94 Nb6 O34 P5 Zr2 -","- K9.88 Nb12 O68 P10 Zr4 -","2","0.5","","Deniard-Courant, Sylvie; Piffard, Yves; Tournoux, Michel","Structure cristalline de K5Nb6Zr2P5O34","Revue de Chimie Minerale","1987","24","","276","287","","","x-ray","0.71069","MoKα","","","0.034","","","0.039","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1518372","34.3413","0.0018","10.0447","0.0007","17.7382","0.0017","90","","96.234","0.006","90","","6082.6","0.8","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Mg-NDI","Mg-NDI","","- C69 H35 Mg4 N7 O30 -","- C69 H35 Mg4 N7 O30 -","- C138 H70 Mg8 N14 O60 -","2","0.5","","Mallick, Arijit; Garai, Bikash; Addicoat, Matthew A.; Petkov, Petko St.; Heine, Thomas; Banerjee, Rahul","Solid state organic amine detection in a photochromic porous metal organic framework","Chem. Sci.","2015","6","2","1420","","10.1039/C4SC03224A","","","0.71073","MoKα","","0.1637","0.1057","","","0.2679","0.2975","","","","","","0.856","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519315","24.7998","0.0005","16.6806","0.0003","24.9057","0.0005","90","","107.161","0.003","90","","9844.2","0.4","120","2","120","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C54 H60 N4 O6 -","- C54 H60 N4 O6 -","- C432 H480 N32 O48 -","8","2","","Lhotak, P. L.; Stibor, I.; Hursthouse, Michael B.; Light, Mark E.; Prokes, I.; Tucker, J. H. R.; Dudic, M.; Miyaji, H.","5,17-bis((6-methyl-2-pyridyl)amido)-25,26,27,28-tetrakis(propoxy)calix(4)arene","Crystal Structure Report Archive","2001","","","67","","","","","0.71073","MoKα","","0.1401","0.0626","","","0.1491","0.1796","","","","","","0.983","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1520200","4.7983","0.0005","5.708","0.006","4.9747","0.0005","90","","91.124","0.007","90","","136.22","0.14","293","2","293","2","","","2400","","","","","3","P 1 2/c 1","-P 2yc","13","","manganese tungstate","","- Mn O4 W -","- Mn O4 W -","- Mn2 O8 W2 -","2","0.5","","Ruiz-Fuertes, J.; Friedrich, A.; Gomis, O.; Errandonea, D.; Morgenroth, W.; Sans, J. A.; Santamaría-Pérez, D.","High-pressure structural phase transition in MnWO4","Physical Review B","2015","91","","104109","","","","","0.28982","","","0.029","0.0276","","","0.0604","0.0608","","","","","","1.109","","","","has coordinates","137660","2020-10-21","18:00:00",""
"1520201","4.6888","0.0006","5.536","0.006","4.8844","0.0005","90","","91.415","0.007","90","","126.75","0.14","293","2","293","2","","","14400","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Mn O4 W -","- Mn O4 W -","- Mn2 O8 W2 -","2","0.5","","Ruiz-Fuertes, J.; Friedrich, A.; Gomis, O.; Errandonea, D.; Morgenroth, W.; Sans, J. A.; Santamaría-Pérez, D.","High-pressure structural phase transition in MnWO4","Physical Review B","2015","91","","104109","","","","","0.28982","","","0.0375","0.0349","","","0.0791","0.0803","","","","","","1.084","","","","has coordinates","137661","2020-10-21","18:00:00",""
"1520202","4.6644","0.0007","5.468","0.006","4.8614","0.0006","90","","91.603","0.008","90","","123.94","0.14","293","2","293","2","","","20100","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Mn O4 W -","- Mn O4 W -","- Mn2 O8 W2 -","2","0.5","","Ruiz-Fuertes, J.; Friedrich, A.; Gomis, O.; Errandonea, D.; Morgenroth, W.; Sans, J. A.; Santamaría-Pérez, D.","High-pressure structural phase transition in MnWO4","Physical Review B","2015","91","","104109","","","","","0.28982","","","0.0717","0.0691","","","0.176","0.1821","","","","","","1.16","","","","has coordinates","137662","2020-10-21","18:00:00",""
"1520641","4.6986","0.0008","5.7293","0.0008","4.9367","0.0011","90","","90.615","0.025","90","","132.89","0.04","","","293","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- O4 W Zn -","- O4 W Zn -","- O8 W2 Zn2 -","2","0.5","","Dahlborg, Magnus Asberg; Svensson, Goran","Structural Changes in the System Zn(1-x)Cd(x)WO4, Determined from Single Crystal Data.","Acta Chemica Scandinavica","1999","53","","1103","1109","10.3891/acta.chem.scand.53-1103","","x-ray","0.71069","MoKα","","","0.0293","","","0.0706","","","","","","","1.126","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520642","4.7472","0.0007","5.767","0.0006","4.9629","0.0006","90","","90.862","0.013","90","","135.85","0.03","","","293","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Cd0.11 O4 W Zn0.89 -","- Cd0.11 O4 W Zn0.89 -","- Cd0.22 O8 W2 Zn1.78 -","2","0.5","","Dahlborg, Magnus Asberg; Svensson, Goran","Structural Changes in the System Zn(1-x)Cd(x)WO4, Determined from Single Crystal Data.","Acta Chemica Scandinavica","1999","53","","1103","1109","10.3891/acta.chem.scand.53-1103","","x-ray","0.71069","MoKα","","","0.0369","","","0.0816","","","","","","","1.157","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520643","4.9192","0.0011","5.843","0.0015","5.0301","0.0022","90","","91.505","0.023","90","","144.53","0.08","","","293","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Cd0.6 O4 W Zn0.4 -","- Cd0.6 O4 W Zn0.4 -","- Cd1.2 O8 W2 Zn0.8 -","2","0.5","","Dahlborg, Magnus Asberg; Svensson, Goran","Structural Changes in the System Zn(1-x)Cd(x)WO4, Determined from Single Crystal Data.","Acta Chemica Scandinavica","1999","53","","1103","1109","10.3891/acta.chem.scand.53-1103","","x-ray","0.71069","MoKα","","","0.036","","","0.0995","","","","","","","1.212","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520644","5.0053","0.0013","5.8615","0.0007","5.0664","0.0007","90","","91.467","0.021","90","","148.59","0.05","","","293","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Cd0.884 O4 W Zn0.116 -","- Cd0.884 O4 W Zn0.116 -","- Cd1.768 O8 W2 Zn0.232 -","2","0.5","","Dahlborg, Magnus Asberg; Svensson, Goran","Structural Changes in the System Zn(1-x)Cd(x)WO4, Determined from Single Crystal Data.","Acta Chemica Scandinavica","1999","53","","1103","1109","10.3891/acta.chem.scand.53-1103","","x-ray","0.71069","MoKα","","","0.0276","","","0.0676","","","","","","","1.068","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520645","5.04","0.0008","5.8701","0.0006","5.0841","0.0007","90","","91.476","0.019","90","","150.36","0.04","","","293","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Cd O4 W -","- Cd O4 W -","- Cd2 O8 W2 -","2","0.5","","Dahlborg, Magnus Asberg; Svensson, Goran","Structural Changes in the System Zn(1-x)Cd(x)WO4, Determined from Single Crystal Data.","Acta Chemica Scandinavica","1999","53","","1103","1109","10.3891/acta.chem.scand.53-1103","","x-ray","0.71069","MoKα","","","0.0254","","","0.0657","","","","","","","1.065","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521117","10.9459","","6.3197","","16.839","","90","","104.943","","90","","1125.44","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Ca5 Cu6 O12 -","- Ca5 Cu6 O12 -","- Ca20 Cu24 O48 -","4","1","","Galez, P.; Lomello-Tafin, M.; Opagiste, C.; Bertrand, C.; Hopfinger, T.","Crystal structure of Ca4.78 Cu6 O11.60","Journal of Solid State Chemistry","2000","151","","170","180","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521118","10.9456","","6.3192","","16.84079","","90","","104.952","","90","","1125.4","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Ca4.78 Cu6 O11.6 -","- Ca4.78 Cu6 O11.6 -","- Ca19.12 Cu24 O46.4 -","4","1","","Galez, P.; Lomello-Tafin, M.; Hopfinger, T.; Opagiste, C.; Bertrand, C.","Crystal structure of Ca4.78 Cu6 O11.60","Journal of Solid State Chemistry","2000","151","","170","180","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521289","19.988","0.004","16.619","0.004","27.233","0.004","90","","100.779","0.015","90","","8887","3","123","2","123","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","bis[mu-carbido(dichlorobis(tricyclohexylphosphine)ruthenium(VI)]gold(I)-tetrafluoroborate","","- C76 H134 Au B Cl10 F4 P4 Ru2 -","- C76 H134 Au B Cl10 F4 P4 Ru2 -","- C304 H536 Au4 B4 Cl40 F16 P16 Ru8 -","4","1","","Reinholdt, Anders; Vibenholt, Johan E.; Morsing, Thorbjørn J.; Schau-Magnussen, Magnus; Reeler, Nini E. A.; Bendix, Jesper","Carbide complexes as π-acceptor ligands","Chem. Sci.","2015","6","10","5815","","10.1039/C5SC02077H","","","0.71073","MoKα","","0.0831","0.0676","","","0.1546","0.1614","","","","","","1.224","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1524890","11.591","","10.835","","9.145","","90","","111.93","","90","","1065.4","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","K2 Ba (S6 O6)2","","- Ba K2 O12 S12 -","- Ba K2 O12 S12 -","- Ba2 K4 O24 S24 -","2","0.5","","Maroy, K.","Refinement of the crystal structure of potassium barium hexathionate","Acta Chemica Scandinavica (1-27,1973-42,1988)","1973","27","","1684","1694","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525239","5.871","","6.696","","5.659","","90","","109.8","","90","","209.316","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Na3 (Bi O4)","","- Bi Na3 O4 -","- Bi Na3 O4 -","- Bi2 Na6 O8 -","2","0.5","","Schwedes, B.; Hoppe, R.","Zur Kenntnis von Na3 Bi O4 und Na3 Sb O4","Zeitschrift fuer Anorganische und Allgemeine Chemie","1972","393","","136","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525240","5.795","","6.595","","5.418","","90","","109.4","","90","","195.309","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Na3 Sb O4","","- Na3 O4 Sb -","- Na3 O4 Sb -","- Na6 O8 Sb2 -","2","0.5","","Schwedes, B.; Hoppe, R.","Zur Kenntnis von Na3 Bi O4 und Na3 Sb O4","Zeitschrift fuer Anorganische und Allgemeine Chemie","1972","393","","136","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526154","9.4956","","3.9742","","7.0425","","90","","104.7","","90","","257.067","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Bi4 (Bi0.86 La1.14) O9","","- Bi4.86 La1.14 O9 -","- Bi4.86 La1.14 O9 -","- Bi4.86 La1.14 O9 -","1","0.25","","Obbade, S.; Drache, M.; Suard, E.; Conflant, P.","Ab initio determination of Bi4.86 La1.14 O9 monoclinic structure from powder neutron diffraction data. Characterization of the related solid solution","Journal of Solid State Chemistry","2001","162","","10","19","","","","","","","","","","","","","","","","","","","","","","has coordinates","147275","2020-10-21","18:00:00",""
"1526733","3.973","","11.228","","5.595","","90","","134.75","","90","","177.253","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Nd2 Gd2 O3 F6","","- F6 Gd2 Nd2 O3 -","- F6 Gd2 Nd2 O3 -","- F6 Gd2 Nd2 O3 -","1","0.25","","Takashima, M.; Nakajima, Y.; Tanioka, T.; Yonezawa, S.; Leblanc, M.","Oxide ion conductive structure and chemical stability of Nd2 Gd2 O3 F6","Solid State Sciences","2000","2","","71","76","","","","","","","","","","","","","","","","","","","","","","has coordinates","147974","2020-10-21","18:00:00",""
"1527303","6.2802","","4.4273","","8.367","","90","","91.76","","90","","232.529","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Hg2 (S O4)","","- Hg2 O4 S -","- Hg2 O4 S -","- Hg4 O8 S2 -","2","0.5","","Dorm, E.","The crystal structure of mercury(I) sulfate and selenate","Acta Chemica Scandinavica (1-27,1973-42,1988)","1969","23","","1607","1615","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527304","6.3507","","4.587","","8.499","","90","","90.98","","90","","247.545","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Hg2 Se O4","","- Hg2 O4 Se -","- Hg2 O4 Se -","- Hg4 O8 Se2 -","2","0.5","","Dorm, E.","The crystal structure of mercury(I) sulfate and selenate","Acta Chemica Scandinavica (1-27,1973-42,1988)","1969","23","","1607","1615","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527647","10.08","","5.81","","5.03","","90","","90","","90","","294.581","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Na In (W O4)2","","- In Na O8 W2 -","- In Na O8 W2 -","- In2 Na2 O16 W4 -","2","0.5","","Klevtsov, P.V.; Klevtsova, R.F.","Single-crystal synthesis and investigation of the double tungstates Na R (W O4)2, where R(III)= Fe, Sc Ga and In","Journal of Solid State Chemistry","1970","2","","278","282","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528188","8.578","","13.386","","9.368","","90","","124.3","","90","","888.619","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","Se2.9 S5.1","","- S5.1 Se2.9 -","- S5.06 Se2.94 -","- S20.24 Se11.76 -","4","1","","Weiss, J.","Roentgenographische Untersuchungen an Mischkristallen der Zusammensetzung Sen S8-n","Zeitschrift fuer Anorganische und Allgemeine Chemie","1977","435","","113","118","","","","","","","","","","","","","","","","","","","","","","has coordinates","150154","2020-10-21","18:00:00",""
"1528189","8.579","","13.405","","9.354","","90","","124.1","","90","","890.764","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","Se3.3 S4.7","","- S4.7 Se3.3 -","- S4.66 Se3.34 -","- S18.64 Se13.36 -","4","1","","Weiss, J.","Roentgenographische Untersuchungen an Mischkristallen der Zusammensetzung Sen S8-n","Zeitschrift fuer Anorganische und Allgemeine Chemie","1977","435","","113","118","","","","","","","","","","","","","","","","","","","","","","has coordinates","150155","2020-10-21","18:00:00",""
"1529223","11.2317","0.0017","3.8687","0.0006","14.557","0.002","90","","97.448","0.004","90","","627.2","0.16","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","Potassium 2-thiobarbiturate","","","- C4 H3 K N2 O2 S -","- C4 H3 K N2 O2 S -","- C16 H12 K4 N8 O8 S4 -","4","1","","N.N. Golovnev; M.S. Molokeev; M.Yu. Belash","Crystal structure of potassium 2-thiobarbiturate","Journal of Structural Chemistry","2013","54","3","566","","10.1134/S0022476613030141","","","0.71073","MoKα","","0.0813","0.0402","","","0.0791","0.0939","","","","","","1.002","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"1529354","8.7358","0.0012","9.1761","0.0012","19.689","0.002","90","","116.096","0.008","90","","1417.4","0.3","295","2","295","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C14 H22 O2 Se -","- C14 H22 O2 Se -","- C56 H88 O8 Se4 -","4","1","","Prasad, Poonam Rajesh; Singh, Harkesh B.; Butcher, Ray J.","Synthesis, Structure and Antioxidant Activity of Cyclohexene-Fused Selenuranes and Related Derivatives.","Molecules (Basel, Switzerland)","2015","20","7","12670","12685","10.3390/molecules200712670","","","0.71073","MoKα","","0.0888","0.0567","","","0.1414","0.1529","","","","","","1.024","","","","has coordinates,has disorder","152923","2020-10-21","18:00:00",""
"1529384","7.272","0.001","8.643","0.001","10.427","0.001","90","","93.2","0.01","90","","654.33","0.13","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C H N8 O2 -","- C H8 N8 O2 -","- C4 H32 N32 O8 -","4","1","","A.M. Astakhov; A.D. Vasiliev; M.S. Molokeev; A.M. Sirotinin; L.A. Kruglyakova; R.S. Stepanov","Crystal and Molecular Structure of Nitramino Derivatives of Tetrazole and 1,2,4-Triazole. II. 5-Nitraminotetrazole Diammonium Salt","Journal of Structural Chemistry","2004","45","1","175","180","10.1023/B:JORY.0000041520.90323.fe","","","1.5406","","","0.0456","0.0379","","","0.1006","0.1066","","","","","","1.032","","","","has coordinates,has Fobs","153314","2020-10-21","18:00:00",""
"1529950","13.384","","4.0616","","16.883","","90","","106.27","","90","","881.013","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","","","- Mo8 O23 -","- Mo8 O23 -","- Mo16 O46 -","2","0.5","","Fujishita, H.; Sato, M.; Hoshino, S.; Sato, S.","Structure determination of low-dimensional conductor Mo8 O23","Journal of Solid State Chemistry","1987","66","","40","46","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1530021","12.862","","13.862","","16.029","","90","","127.7","","90","","2261.21","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","(Nb Se4)4 Br2","","- Br2 Nb4 Se16 -","- Br2 Nb4 Se16 -","- Br8 Nb16 Se64 -","4","1","","Grenouilleau, P.; Guemas, L.; Meerschaut, A.; Rouxel, J.","M4 Se16 Br2 (M= Nb, Ta), a new chain-like structure from progressive condensation of (M2 Se4) groups","Journal of Solid State Chemistry","1987","66","","293","303","","","","","","","","","","","","","","","","","","","","","","has coordinates","154980","2020-10-21","18:00:00",""
"1530022","12.844","","13.875","","16.018","","90","","127.57","","90","","2262.56","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","(Ta Se4)4 Br2","","- Br2 Se16 Ta4 -","- Br2 Se16 Ta4 -","- Br8 Se64 Ta16 -","4","1","","Grenouilleau, P.; Meerschaut, A.; Guemas, L.; Rouxel, J.","M4 Se16 Br2 (M= Nb, Ta), a new chain-like structure from progressive condensation of (M2 Se4) groups","Journal of Solid State Chemistry","1987","66","","293","303","","","","","","","","","","","","","","","","","","","","","","has coordinates","154981","2020-10-21","18:00:00",""
"1530138","4.6227","","6.5142","","5.7186","","90","","96.616","","90","","171.059","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Pb (H P O4)","","- H O4 P Pb -","- O4 P Pb -","- O8 P2 Pb2 -","2","0.5","","Katrusiak, A.; Nelmes, R.J.","Pressure dependence of the crystal structure of lead hydrogen phosphate (Pb H P O4)","Journal of Physics: Condensed Matter","1989","1","","10165","10174","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530642","4.637","","6.537","","5.731","","90","","96.65","","90","","172.55","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Pb (H P O4)","","- H O4 P Pb -","- H O4 P Pb -","- H2 O8 P2 Pb2 -","2","0.5","","Restori, R.; Tun, Z.; McIntyre, G.J.; Nelmes, R.J.","On the pressure dependence of the crystal structure of Pb H P O4","Journal of Physics C","1987","20","","591","597","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530707","17.437","","8.029","","16.787","","90","","111.7","","90","","2183.66","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","(Mo8.8 W1.2) O29","","- Mo8.8 O29 W1.2 -","- Mo8.8 O29 W1.2 -","- Mo35.2 O116 W4.8 -","4","1","","Sato, M.; Onoda, M.; Matsuda, Y.","Structural transitions in Mon O3n-1 (n=9 and 10)","Journal of Physics C","1987","20","","4763","4771","","","","","","","","","","","","","","","","","","","","","","has coordinates","155904","2020-10-21","18:00:00",""
"1530890","9.322","","5.132","","7.277","","90","","95.66","","90","","346.438","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Cs Lu (W O4)2","","- Cs Lu O8 W2 -","- Cs Lu O8 W2 -","- Cs2 Lu2 O16 W4 -","2","0.5","","Torardi, C.C.; Page, C.; Brixner, L.H.; Blasse, G.; Dirksen, G.J.","Structure and luminescence of some Cs Ln W2 O8 compounds","Journal of Solid State Chemistry","1987","69","","171","178","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1531375","4.7565","","5.7281","","5.1358","","90","","90.355","","90","","139.926","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","(Mn0.333 Ta0.667)2 O4","","- Mn0.666 O4 Ta1.334 -","- Mn0.666 O4 Ta1.334 -","- Mn1.332 O8 Ta2.668 -","2","0.5","","Esmaeilzadeh, S.; Grins, J.","Meta-stable phases in the Mn - Ta - O system","Solid State Sciences","2002","4","","117","123","","","","","","","","","","","","","","","","","","","","","","has coordinates","156828","2020-10-21","18:00:00",""
"1532179","4.03","","11.4","","5.72","","90","","135.2","","90","","185.17","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","La2 Eu2 O3 F6","","- Eu2 F6 La2 O3 -","- Eu2 F6 La2 O3 -","- Eu2 F6 La2 O3 -","1","0.25","","Takashima, M.; Yonezawa, S.; Leblanc, M.","Synthesis and oxide ion conductivity of lanthanum-europium oxide fluoride, La2 Eu2 O3 F6","Solid State Ionics","2002","154","","547","553","","","","","","","","","","","","","","","","","","","","","","has coordinates","157839","2020-10-21","18:00:00",""
"1532260","8.408","","5.017","","11.94","","90","","98.42","","90","","498.235","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Pb2 V5 O12","","- O12 Pb2 V5 -","- O12 Pb2 V5 -","- O24 Pb4 V10 -","2","0.5","","Shpanchenko, R.V.; Chernaya, V.V.; Abakumov, A.M.; Hadermann, J.; Antipov, E.V.; van Tendeloo, G.; Kaul, E.E.; Geibel, C.; Sheptyakov, D.; Balagurov, A.M.","Crystal structure and magnetic properties of the novel oxide Pb2 V5 O12","Zeitschrift fuer Anorganische und Allgemeine Chemie","2001","627","","2143","2150","","","","","","","","","","","","","","","","","","","","","","has coordinates","157943","2020-10-21","18:00:00",""
"1532465","15.9874","0.0006","18.0758","0.0004","18.1871","0.0006","90","","107.85","0.004","90","","5002.8","0.3","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C47.5 H62.5 F6 N1.5 O6.5 P -","- C47.5 H62.5 F6 N1.5 O6.5 P -","- C190 H250 F24 N6 O26 P4 -","4","1","","Jia, Fei; He, Zhenfeng; Yang, Liu-Pan; Pan, Zhi-Sheng; Yi, Min; Jiang, Ren-Wang; Jiang, Wei","Oxatub[4]arene: a smart macrocyclic receptor with multiple interconvertible cavities","Chem. Sci.","2015","6","12","6731","","10.1039/C5SC03251B","","","1.54178","CuKα","","0.1088","0.0907","","","0.2874","0.3221","","","","","","1.349","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532677","8.498","","13.134","","9.311","","90","","124.89","","90","","852.427","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","","","- S7 Se -","- S6.97 Se1.03 -","- S27.88 Se4.12 -","4","1","","Laitinen, R.; Niinisto, L.; Steudel, R.","Structural studies on the sulfur-selenium binary system","Acta Chemica Scandinavica, Series A: (28,1974-)","1979","33","","737","747","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1532681","8.596","","13.374","","9.392","","90","","124.28","","90","","892.177","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","","","- S6 Se2 -","- S6 Se2 -","- S24 Se8 -","4","1","","Laitinen, R.; Niinisto, L.; Steudel, R.","Structural studies on the sulfur-selenium binary system","Acta Chemica Scandinavica, Series A: (28,1974-)","1979","33","","737","747","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1532800","5.944407","","5.924701","","16.77515","","90","","90.2363","","90","","590.796","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","","","- Fe3 O4 -","- Fe3 O4 -","- Fe24 O32 -","8","2","","Wright, J.P.; Radaelli, P.G.; Attfield, J.P.","Charge ordered structure of magnetite Fe3 O4 below the Verwey transition","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2002","66","","214422-1","214422-15","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1534302","8.34","","13.11","","9.3","","90","","123.9","","90","","843.988","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","Se1.1 S6.9","","- S6.9 Se1.1 -","- S6.91 Se1.09 -","- S27.64 Se4.36 -","4","1","","Boudreau, R.A.; Haendler, H.M.","The isostructural gamma-sulfur phase of selenium-sulfur, Sen S8-n","Journal of Solid State Chemistry","1981","36","","289","296","","","","","","","","","","","","","","","","","","","","","","has coordinates","160860","2020-10-21","18:00:00",""
"1534303","8.4","","13.26","","9.37","","90","","124.5","","90","","860.114","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","Se3.7 S4.3","","- S4.35 Se3.55 -","- S4.35 Se3.55 -","- S17.4 Se14.2 -","4","1","","Boudreau, R.A.; Haendler, H.M.","The isostructural gamma-sulfur phase of selenium-sulfur, Sen S8-n","Journal of Solid State Chemistry","1981","36","","289","296","","","","","","","","","","","","","","","","","","","","","","has coordinates","160861","2020-10-21","18:00:00",""
"1535411","13.331","","7.541","","35.245","","90","","144.45","","90","","2060.03","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Na4 Ti (P O4)2 O","","- Na4 O9 P2 Ti -","- Na4 O9 P2 Ti -","- Na40 O90 P20 Ti10 -","10","2.5","","Bolotina, N.B.; Maksimov, B.A.; Petricek, V.; Simonov, V.I.","Crystal structure of modulated monoclinic Na4 Ti P2 O9 phase at 293K","Kristallografiya","1995","40","","611","625","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535502","14.877","","8.193","","23.616","","90","","93.53","","90","","2873.03","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Cs10 (Si4) (Si3 O9)","","- Cs10 O9 Si7 -","- Cs10 O9 Si7 -","- Cs40 O36 Si28 -","4","1","","Hoffmann, S.; Faessler, T.F.; Hoch, C.; Roehr, C.","Alkali metal tetrelide-tetrelates: ""double salts"" with (E4)(4-) Zintl anions (E = Si, Ge) and the first dimeric cyclotrisilicate ions (Si6 O17)(10-)","Angew. Chem. Int. ed.","2001","40","","4398","4400","","","","","","","","","","","","","","","","","","","","","","has coordinates","162900","2020-10-21","18:00:00",""
"1536069","6.545","","6.7906","","8.864","","90","","90.708","","90","","393.926","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Cs2 (C O3) (H2 O)3","","- C H6 Cs2 O6 -","- C H6 Cs2 O6 -","- C2 H12 Cs4 O12 -","2","0.5","","Cirpus, V.; Wittrock, J.; Adam, A.","Carbonat-Hydrate der schweren Alkalimetalle: Darstellung und Struktur von Rb2 C O3 * 1.5(H2 O) und Cs2 C O3 * 3(H2 O)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2001","627","","533","538","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536426","10.878","","6.853","","10.499","","90","","111.71","","90","","727.152","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Lu6 (Ge4 O17)","","- Ge4 Lu6 O17 -","- Ge4 Lu6 O17 -","- Ge8 Lu12 O34 -","2","0.5","","Palkina, K.K.; Dzhurinskii, B.F.; Kuz'mina, N.E.; Lysanova, G.V.; Komova, M.G.","Structure and synthesis of lutetium germanate Lu6Ge4O17","Zhurnal Neorganicheskoi Khimii","1994","39","","184","187","","","","","","","","","","","","","","","","","","","","","","has coordinates","164130","2020-10-21","18:00:00",""
"1536526","12.288","","6.4835","","12.66","","90","","91.91","","90","","1008.05","","","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Pr Cl2 (N O3) (H2 O)5","","- Cl2 H10 N O8 Pr -","- Cl2 H10 N O8 Pr -","- Cl8 H40 N4 O32 Pr4 -","4","1","","Wickleder, M.S.; Mueller, I.; Meyer, G.","Das Chloridnitrat Pr Cl2 (N O3) . 5(H2 O) mit kationischen und anionischen Komplexen gemaess (Pr Cl2 (H2 O)6) (Pr Cl2 (N O3)2 (H2 O)4)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2001","627","","4","6","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536776","8.578","","13.386","","9.368","","90","","124.7","","90","","884.365","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","Te S7","","- S7 Te -","- S6.98 Te1.02 -","- S27.92 Te4.08 -","4","1","","Pupp, M.; Weiss, J.","Mischkristalle der Zusammensetzung Ten S8-n","Zeitschrift fuer Anorganische und Allgemeine Chemie","1978","440","","31","36","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537110","17.018","","8.7744","","45.569","","90","","101.466","","90","","6668.69","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Cs48 (Sn4)4 (Sn O3)4 O7 (O2)","","- Cs48 O21 Sn20 -","- Cs48 O21 Sn20 -","- Cs96 O42 Sn40 -","2","0.5","","Frisch, G.; Hoch, C.; Roehr, C.; Zoennchen, P.; Becker, K.D.; Niemeier, D.","Alkaline metal stannide-stannates: ""double salts"" with Zintl (Sn4)(4-) and stannate (Sn O3)(4-) anions","Zeitschrift fuer Anorganische und Allgemeine Chemie","2003","629","","1661","1672","","","","","","","","","","","","","","","","","","","","","","has coordinates","165125","2020-10-21","18:00:00",""
"1537539","10.161","","6.141","","14.165","","90","","110.11","","90","","829.991","","","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","(N H3 (C H2)2 N H3) (Sn2 (C2 O4)3) (H2 O)","","- C8 H12 N2 O13 Sn2 -","- C8 H10 N2 O13 Sn2 -","- C16 H20 N4 O26 Sn4 -","2","0.5","","Kokunov, Yu.V.; Gorbunova, Yu.E.; Detkov, D.G.","Tin(II) oxalate and oxalatofluoride polymeric compounds. Synthesis and crystal structure of (H3 N (C H2)2 N H3)0.5 (Sn F (C2 O4)) * (H2 O) and (H3 N (C H2)2 N H3) (Sn2 (C2 O4)3) * 0.5(H2 O)","Zhurnal Neorganicheskoi Khimii","2004","49","","1094","1100","","","","","","","","","","","","","","","","","","","","","","has coordinates","165757","2020-10-21","18:00:00",""
"1537550","6.361","","7.407","","6.256","","90","","109.3","","90","","278.192","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","Zr Cl4","","- Cl4 Zr -","- Cl4 Zr -","- Cl8 Zr2 -","2","0.5","","Krebs, B.","Die Kristallstruktur von Zirkoniumtetrachlorid","Zeitschrift fuer Anorganische und Allgemeine Chemie","1970","378","","263","272","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537569","8.55","","13.34","","9.336","","90","","124.17","","90","","881.019","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","Se2.57 S5.43","","- S5.43 Se2.57 -","- S5.434 Se2.566 -","- S21.736 Se10.264 -","4","1","","Laitinen, R.; Rautenberg, N.; Steidel, J.; Steudel, R.","Crystal structure and vibrational analysis of cyclo-triselenium pentasulfide prepared by the reaction of titanocene pentasulfide with dichlorodiselane","Zeitschrift fuer Anorganische und Allgemeine Chemie","1982","486","","116","128","","","","","","","","","","","","","","","","","","","","","","has coordinates","165806","2020-10-21","18:00:00",""
"1539964","4.684","","6.642","","5.781","","90","","97.18","","90","","178.443","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Pb (H P O4)","","- H O4 P Pb -","- O4 P Pb -","- O8 P2 Pb2 -","2","0.5","","Worzala, H.; Jost, K.H.","On the mechanism of the conversion of lead dihydrogenphosphate, Pb (H2 P O4)2, into lead monohydrogenphosphate, Pb H P O4, and phosphoric acid","Zeitschrift fuer Anorganische und Allgemeine Chemie","1982","486","","165","176","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1540106","13.155","","5.927","","9.023","","90","","107.7","","90","","670.217","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Sb3 O2 F5","","- F5 O2 Sb3 -","- F5 O2 Sb3 -","- F20 O8 Sb12 -","4","1","","Holz, K.; Mattes, R.","Verbindungen des Antimon(III) mit SbFnOm-Koordinationssphaere. Kristallstrukturen von K(SbF2)HAsO4, NH4(SbF2)HAsO4 und Sb3O2F5","Zeitschrift fuer Anorganische und Allgemeine Chemie","1989","578","","133","142","","","","","","","","","","","","","","","","","","","","","","has coordinates","169287","2020-10-21","18:00:00",""
"1540427","31.467","0.005","9.589","0.005","30.77","0.005","90","","91.556","0.005","90","","9281","5","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C78 H96 Cl16 Fe2 N8 O18 -","- C78 H96 Cl16 Fe2 N8 O18 -","- C312 H384 Cl64 Fe8 N32 O72 -","4","1","","Sil, Debangsu; Dey, Soumyajit; Kumar, Amit; Bhowmik, Susovan; Rath, Sankar Prasad","Oxidation triggers extensive conjugation and unusual stabilization of two di-heme dication diradical intermediates: role of bridging group for electronic communication","Chem. Sci.","2016","7","2","1212","","10.1039/C5SC03120F","","","0.71069","MoKα","","0.1108","0.0679","","","0.1584","0.1791","","","","","","1.031","","","","has coordinates,has disorder","175898","2020-10-21","18:00:00",""
"1540763","7.0076","","6.2256","","12","","90","","92.175","","90","","523.141","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Cs Ti2 Cl7","","- Cl7 Cs Ti2 -","- Cl7 Cs Ti2 -","- Cl14 Cs2 Ti4 -","2","0.5","","Zhang, J.; Corbett, J.D.","Synthesis and Structure of the Novel Layered Phase CsTi2Cl7","Zeitschrift fuer Anorganische und Allgemeine Chemie","1990","580","","36","44","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541187","13.4","","4.04","","16.8","","90","","106.1","","90","","873.814","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","","","- Mo8 O23 -","- Mo8 O23 -","- Mo16 O46 -","2","0.5","","Magneli, A.","The crystal structures of Mo9 O26 (beta'-molybdenum oxide) and Mo8 O23 (beta - molybdenum oxide)","Acta Chemica Scandinavica (1-27,1973-42,1988)","1948","2","","501","517","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1541666","11.641","","8.179","","14.253","","90","","98.48","","90","","1342.22","","","","","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","(Cu (C S (N H2)2)3) Cl (H2 O)","","- C3 H14 Cl Cu N6 O S3 -","- C3 H14 Cl Cu N6 O S3 -","- C12 H56 Cl4 Cu4 N24 O4 S12 -","4","1","","Bombicz, P.; Mutikainen, I.; Krunks, M.; Leskela, T.; Madarasz, J.; Niinisto, L.","Synthesis, vibrational spectra and X-ray structures of copper(I) thiourea complexes","Inorganica Chimica Acta","2004","357","","513","525","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541873","5.53","","7.1","","18.3","","90","","102.72","","90","","700.879","","","","","","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","Na2 (Ti0.5 Mn0.5) (Ti0.25 Zr0.75) (Si2 O7) O (F (O H))0.5","","- F0.5 H0.5 Mn0.5 Na2 O8.5 Si2 Ti0.75 Zr0.75 -","- F0.5 Mn0.5 Na2 O8.5 Si2 Ti0.75 Zr0.75 -","- F2 Mn2 Na8 O34 Si8 Ti3 Zr3 -","4","1","","Simonov, V.I.; Belov, N.V.","The determination of the structure of seidozerite","Kristallografiya","1959","4","","163","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541982","11.58","","10.81","","9.14","","90","","112","","90","","1060.83","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","K2 Ba (S6 O6)2","","- Ba K2 O12 S12 -","- Ba K2 O12 S12 -","- Ba2 K4 O24 S24 -","2","0.5","","Foss, O.; Johnson, K.","The crystal structure of potassium barium hexathionate","Acta Chemica Scandinavica (1-27,1973-42,1988)","1965","19","","2207","2218","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1542088","11.71","","6.69","","8.2","","90","","102.67","","90","","626.745","","","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Ca Mg (B3 O4 (O H)3)2 (H2 O)3","","- B6 Ca H12 Mg O17 -","- B6 Ca Mg O17 -","- B12 Ca2 Mg2 O34 -","2","0.5","","Rumanova, I.M.; Ashirov, A.","Determination of the crystal structure of hydroboracite Ca Mg (B3 O4 (O H)3)2 (H2 O)3","Kristallografiya","1963","8","","828","845","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1542943","13.0334","0.0006","8.6509","0.0004","17.4221","0.0011","90","","101.862","0.005","90","","1922.41","0.18","293.6","0.1","293.6","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C23 H17 F4 N O -","- C23 H17 F4 N O -","- C92 H68 F16 N4 O4 -","4","1","","Wu, Xin-Xing; Chen, Wen-Long; Shen, Yi; Chen, Si; Xu, Peng-Fei; Liang, Yong-Min","Palladium-Catalyzed Domino Heck/Intermolecular C-H Bond Functionalization: Efficient Synthesis of Alkylated Polyfluoroarene Derivatives.","Organic letters","2016","18","8","1784","1787","10.1021/acs.orglett.6b00447","","x-ray","0.71073","MoKα","","0.1333","0.0674","","","0.1551","0.2076","","","","","","1.038","","","","has coordinates","182524","2020-10-21","18:00:00",""
"1543584","14.848","0.006","6.391","0.002","7.149","0.003","90","","103.09","0.004","90","","660.8","0.4","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C15 H10 Cd O6 -","- C15 H10 Cd O6 -","- C30 H20 Cd2 O12 -","2","0.5","","Lan Qin; Lei Yu; Xiao-Zhi Yan; Wen-Na Zhao; Lei Han","Two sinusoidal wavelike 2D coordination polymers with benzophenone-4,4'-dicarboxylate","Inorganica Chimica Acta","2014","","","233","237","10.1016/j.ica.2013.09.028","","","0.71073","MoKα","","0.0187","0.0183","","","0.0481","0.0484","","","","","","1.09","","","","has coordinates","211137","2020-10-21","18:00:00",""
"1543585","14.539","0.003","6.3406","0.0013","7.2354","0.0014","90","","104.19","0.03","90","","646.7","0.2","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C15 H10 O6 Zn -","- C15 H10 O6 Zn -","- C30 H20 O12 Zn2 -","2","0.5","","Lan Qin; Lei Yu; Xiao-Zhi Yan; Wen-Na Zhao; Lei Han","Two sinusoidal wavelike 2D coordination polymers with benzophenone-4,4'-dicarboxylate","Inorganica Chimica Acta","2014","","","233","237","10.1016/j.ica.2013.09.028","","","0.71073","MoKα","","0.0793","0.0639","","","0.2145","0.2307","","","","","","1.171","","","","has coordinates","211137","2020-10-21","18:00:00",""
"1544058","14.3047","0.001","9.6601","0.0004","22.0345","0.0015","90","","94.006","0.007","90","","3037.4","0.3","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C54 H40 Cd3 Cl2 N10 O16 -","- C54 H40 Cd3 Cl2 N10 O16 -","- C108 H80 Cd6 Cl4 N20 O32 -","2","0.5","","Apurba Bhunia; Ennio Zangrando; Soumen Mistri; Subal Chandra Manna","Oxalato-bridged oligonuclear complexes of cadmium(II)/lead(II) with bipyridine coligands: Synthesis, crystal structure, electronic spectra, density functional theory calculation and effect of organic compounds on the fluorescence property","Inorganica Chimica Acta","2014","","","528","537","10.1016/j.ica.2013.10.001","","","1.5418","CuKα","","0.1175","0.0719","","","0.2121","0.2603","","","","","","0.988","","","","has coordinates","211137","2020-10-21","18:00:00",""
"1544135","12.2298","0.0013","7.6667","0.0008","17.9898","0.0014","90","","125.106","0.005","90","","1379.9","0.2","185","2","185","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H20 F10 N4 Zn -","- C26 H20 F10 N4 Zn -","- C52 H40 F20 N8 Zn2 -","2","0.5","","Li, Xiao-Qing; Wang, Bin; Ji, He-Yuan; Li, Yue-Sheng","Insights into the mechanism for ring-opening polymerization of lactide catalyzed by Zn(C6F5)2/organic superbase Lewis pairs","Catal. Sci. Technol.","2016","6","21","7763","","10.1039/C6CY01587E","","","0.71073","MoKα","","0.0459","0.0372","","","0.0854","0.09","","","","","","1.057","","","","has coordinates","188059","2020-10-21","18:00:00",""
"1544293","12.5178","0.0011","7.8321","0.0009","12.6354","0.0015","90","","107.763","0.008","90","","1179.7","0.2","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","2,4-Dimethylpyrido[1,2-<i>a</i>]pyrimidin-5-ium perchlorate","","- C10 H11 Cl N2 O4 -","- C10 H11 Cl N2 O4 -","- C40 H44 Cl4 N8 O16 -","4","1","","Posel, Maciej; Stoeckli-Evans, Helen","2,4-Dimethylpyrido[1,2-<i>a</i>]pyrimidin-5-ium perchlorate","IUCrData","2016","1","10","x161543","","10.1107/S2414314616015431","","","0.71073","MoKα","","0.1173","0.0716","","","0.1382","0.1676","","","","","","1.129","","","","has coordinates,has Fobs","187349","2020-10-21","18:00:00",""
"1544632","41.2884","0.0009","14.0841","0.0004","54.0058","0.0015","90","","97.789","0.002","90","","31115.2","1.4","140","","140","","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C160 H192 B20 F16 Fe8 N56 O48 Pd2 -","- C160 H192 B20 F16 Fe8 N56 O48 Pd2 -","- C640 H768 B80 F64 Fe32 N224 O192 Pd8 -","4","1","","Jansze, Suzanne M.; Wise, Matthew D.; Vologzhanina, Anna V.; Scopelliti, Rosario; Severin, Kay","PdII2L4-type coordination cages up to three nanometers in size","Chem. Sci.","2017","8","3","1901","","10.1039/C6SC04732G","","x-ray","1.54184","CuKα","","0.2129","0.1467","","","0.2909","0.3321","","","","","","0.995","","","","has coordinates,has disorder","193752","2020-10-21","18:00:00",""
"1545316","13.0549","0.0013","6.8643","0.0007","15.8088","0.0015","90","","97.519","0.002","90","","1404.5","0.2","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H14 N2 O3 S2 -","- C14 H14 N2 O3 S2 -","- C56 H56 N8 O12 S8 -","4","1","","Zhou, Min; Ma, Hang-Ying; Liu, Zhi-Hua; Yang, Guang-Yu; Du, Gang; Ye, Yan-Qing; Li, Gan-Peng; Hu, Qiu-Fen","(+)-Meyeniins A-C, Novel Hexahydroimidazo[1,5-c]thiazole Derivatives from the Tubers of Lepidium meyenii: Complete Structural Elucidation by Biomimetic Synthesis and Racemic Crystallization.","Journal of agricultural and food chemistry","2017","","","","","10.1021/acs.jafc.6b05805","","","0.71073","MoKα","","0.0347","0.0299","","","0.08","0.0835","","","","","","1.085","","","","has coordinates","192644","2020-10-21","18:00:00",""
"1545491","7.0734","0.0008","10.4076","0.0012","6.7019","0.0012","90","","116.683","0.004","90","","440.83","0.11","296","","296","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Dichlorido(<i>o</i>-phenylenediamine)palladium(II)","","- C6 H8 Cl2 N2 Pd -","- C6 H8 Cl2 N2 Pd -","- C12 H16 Cl4 N4 Pd2 -","2","0.5","WM4038","Konno, Yosuke; Matsushita, Nobuyuki","Dichlorido(<i>o</i>-phenylenediamine)palladium(II)","IUCrData","2017","2","2","x170144","","10.1107/S2414314617001444","","","0.71075","MoKα","","0.022","0.0197","","","0.0514","0.0526","","","","","","1.092","","","","has coordinates,has Fobs","193953","2020-10-21","18:00:00",""
"1546089","12.926","0.008","11.204","0.007","19.694","0.009","90","","123","0.03","90","","2392","3","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C52.5 H47 B Cl F2 N3 O8 -","- C52.5 H47 B Cl F2 N3 O8 -","- C105 H94 B2 Cl2 F4 N6 O16 -","2","0.5","","Sheng, Wanle; Zheng, Yu-Qing; Wu, Qinghua; Wu, Yayang; Yu, Changjiang; Jiao, Lijuan; Hao, Erhong; Wang, Jie-Yu; Pei, Jian","Synthesis, Properties, and Semiconducting Characteristics of BF2 Complexes of β,β-Bisphenanthrene-Fused Azadipyrromethenes.","Organic letters","2017","19","11","2893","2896","10.1021/acs.orglett.7b01133","","","0.71073","MoKα","","0.2169","0.0996","","","0.2177","0.273","","","","","","1.021","","","","has coordinates,has disorder","197512","2020-10-21","18:00:00",""
"1546140","17.3958","0.0014","12.1322","0.001","24.263","0.002","90","","106.755","0.001","90","","4903.3","0.7","123","2","123","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C36 H34 B10 Cl2 F10 Ir N4 P -","- C36 H34 B10 Cl2 F10 Ir N4 P -","- C144 H136 B40 Cl8 F40 Ir4 N16 P4 -","4","1","","Yan, Hong; Li, Xiang; Yin, Yongheng; Lu, Changsheng; Tong, Xiao; Zhao, Qiang","Using highly emissive and environmentally sensitive o-carborane-functionalized metallophosphors to monitor mitochondrial polarity","Chem. Sci.","2017","","","","","10.1039/C7SC00160F","","","0.71073","MoKα","","0.0437","0.0348","","","0.0957","0.0999","","","","","","1.057","","","","has coordinates,has disorder","197056","2020-10-21","18:00:00",""
"1546741","9.2078","0.00013","10.49143","0.00018","16.4278","0.0003","90","","96.1345","0.0014","90","","1577.89","0.05","193","2","193","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C28 H38 F6 N6 O4 P Ru -","- C28 H38 F6 N6 O4 P Ru -","- C56 H76 F12 N12 O8 P2 Ru2 -","2","0.5","","Li, Cai; Ip, Kwok-Wa; Man, Wai-Lun; Song, Dan; He, Ming-Liang; Yiu, Shek-Man; Lau, Tai-Chu; ZHU, Guangyu","Cytotoxic (Salen)ruthenium(III) Anticancer Complexes Exhibit Different Modes of Cell Death Directed by Axial Ligands","Chem. Sci.","2017","","","","","10.1039/C7SC02205K","","","1.54178","CuKα","","0.0381","0.0377","","","0.1008","0.1012","","","","","","1.042","","","","has coordinates,has disorder","199416","2020-10-21","18:00:00",""
"1546845","8.0042","0.0002","11.5133","0.0003","17.4969","0.0005","90","","114.231","0.001","90","","1470.37","0.07","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C28 H22 N4 Ni3 O16 -","- C28 H22 N4 Ni3 O16 -","- C56 H44 N8 Ni6 O32 -","2","0.5","","Liu, Feng; Gao, Wei; Zhang, Xiu-Mei; Liu, Jie-Ping; Gao, En-Qing","Four coordination polymers based on dinuclear and trinuclear units with a new multifunctional pyridyl-dicarboxylate ligand: luminescence and magnetic properties","CrystEngComm","2017","19","38","5755","5763","10.1039/C7CE01042G","","","0.71073","MoKα","","0.0432","0.0336","","","0.0797","0.0843","","","","","","1.051","","","","has coordinates","282777","2023-04-20","11:56:49",""
"1546947","8.6135","0.0007","10.2226","0.0008","19.2641","0.0015","90","","93.739","0.002","90","","1692.6","0.2","233","2","233","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C44 H38 Si -","- C44 H38 Si -","- C88 H76 Si2 -","2","0.5","","Lee, Jiwon; Park, Yoona; Jung, Joori; Han, Won-Sik","Blue-Shifted Aggregation-Induced Emission of Siloles by Simple Structural Modification and Their Application as Nitro Explosive Chemosensor","Photochem. Photobiol. Sci.","2017","","","","","10.1039/C7PP00268H","","","0.71073","MoKα","","0.1499","0.0595","","","0.1397","0.1981","","","","","","1.038","","","","has coordinates","200199","2020-10-21","18:00:00",""
"1547112","12.1984","0.0004","10.6577","0.0004","23.0168","0.0008","90","","102.007","0.001","90","","2926.88","0.18","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C34 H31 Br N2 O4 -","- C34 H31 Br N2 O4 -","- C136 H124 Br4 N8 O16 -","4","1","","Kang, Zhenghui; Zhang, Dan; Hu, Wenhao","Regio- and Diastereoselective Three-Component Reactions via Trapping of Ammonium Ylides with N-Alkylquinolinium Salts: Synthesis of Multisubstituted Tetra- and Dihydroquinoline Derivatives.","Organic letters","2017","19","14","3783","3786","10.1021/acs.orglett.7b01664","","","0.71073","MoKα","","0.0611","0.0427","","","0.104","0.1147","","","","","","1.029","","","","has coordinates","200630","2020-10-21","18:00:00",""
"1548025","12.158","0.002","10.943","0.002","16.944","0.003","90","","93.548","0.004","90","","2250","0.7","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C34 H50 N7 O20 Pt3 -","- C34 H36 N7.001 O20.002 Pt3 -","- C68 H72 N14.002 O40.004 Pt6 -","2","0.5","","Christopher H. Hendon; Aron Walsh; Norinobu Akiyama; Yosuke Konno; Takashi Kajiwara; Tasuku Ito; Hiroshi Kitagawa; Ken Sakai","One-dimensional Magnus-type platinum double salts","Nature Communications","2016","7","","11950","","10.1038/ncomms11950","","","0.71073","MoKα","","0.0352","0.0249","","","0.0497","0.0512","","","","","","0.873","","","","has coordinates,has disorder","203150","2020-10-21","18:00:00",""
"1548316","30.5759","0.0009","17.0735","0.0005","38.4463","0.0012","90","","113.034","0.002","90","","18470.3","1","150","2","150","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C61 H141 K8 Mo18 N7 O99 S18 -","- C47.3 K8 Mo18 N4 O98.9 S18 -","- C189.2 K32 Mo72 N16 O395.6 S72 -","4","1","","Hong-Ying Zang; Andreu Ruiz de la Oliva; Haralampos N. Miras; De-Liang Long; Roy T. McBurney; Leroy Cronin","Discovery of gigantic molecular nanostructures using a flow reaction array as a search engine","Nature Communications","2014","5","","3715","","10.1038/ncomms4715","","","0.71073","MoKα","","0.1126","0.0711","","","0.1831","0.2152","","","","","","1.029","","","","has coordinates","203779","2020-10-21","18:00:00",""
"1548659","13.855","0.004","9.378","0.002","30.742","0.008","90","","101.648","0.003","90","","3912.1","1.7","100","2","100","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C78 H78 B2 Fe2 N8 O2 P2 Zn2 -","- C78 H78 B2 Fe2 N8 O2 P2 Zn2 -","- C156 H156 B4 Fe4 N16 O4 P4 Zn4 -","2","0.5","","Abubekerov, Mark; Wei, Junnian; Swartz, Kevin R.; Xie, Zhixin; Pei, Qibing; Diaconescu, Paula L.","Preparation of multiblock copolymers <i>via</i> step-wise addition of l-lactide and trimethylene carbonate.","Chemical science","2018","9","8","2168","2178","10.1039/c7sc04507g","","","0.71073","MoKα","","0.0979","0.0793","","","0.2114","0.2198","","","","","","1.038","","","","has coordinates,has disorder","228680","2020-10-21","18:00:00",""
"1549535","11.5934","0.0011","10.5944","0.0007","15.822","0.002","90","","106.13","0.011","90","","1866.8","0.3","","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C13 H18 Cu2 N O12 -","- C13 H18 Cu2 N O12 -","- C52 H72 Cu8 N4 O48 -","4","1","","Köferstein, Roberto; Robl, Christian","Synthesis and Crystal Structure of Two CuII-benzene-1,2,4,5-tetracarboxylates with Three-Dimensional Open Frameworks","Zeitschrift für anorganische und allgemeine Chemie","2014","640","2","310","","10.1002/zaac.201300527","","","","","","0.042","0.033","","","","","","","","","","","","","","has coordinates","208277","2020-10-21","18:00:00",""
"1549779","8.3287","0.0007","13.8956","0.0009","20.3124","0.0015","90","","90.635","0.008","90","","2350.7","0.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Ethyl 2-anilino-4-methyl-5-[5-methyl-1-(4-methylphenyl)-1<i>H</i>-1,2,3-triazole-4-carbonyl]thiophene-3-carboxylate","","- C25 H24 N4 O3 S -","- C25 H24 N4 O3 S -","- C100 H96 N16 O12 S4 -","4","1","HB4250","El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Yousif, Emad; Hegazy, Amany S.; Kariuki, Benson M.","Ethyl 2-anilino-4-methyl-5-[5-methyl-1-(4-methylphenyl)-1<i>H</i>-1,2,3-triazole-4-carbonyl]thiophene-3-carboxylate","IUCrData","2018","3","8","x181106","","10.1107/S2414314618011069","","","0.71073","MoKα","","0.1577","0.0629","","","0.1362","0.1822","","","","","","1.012","","","","has coordinates,has Fobs","209560","2020-10-21","18:00:00",""
"1549934","26.0567","0.0005","14.2086","0.0003","28.6868","0.0006","90","","94.091","0.002","90","","10593.6","0.4","150","0.1","150","0.1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","1","","","- C114 H108 N16 O12 -","- C114 H108 N16 O12 -","- C456 H432 N64 O48 -","4","1","","Qu, Hang; Tang, Xiao; Wang, Xinchang; Li, Zhihao; Huang, Zheyu; Zhang, Hui; Tian, Zhongqun; Cao, Xiaoyu","Chiral molecular face-rotating sandwich structures constructed through restricting the phenyl flipping of tetraphenylethylene.","Chemical science","2018","9","47","8814","8818","10.1039/c8sc03404d","","x-ray","1.54184","CuKα","","0.081","0.0576","","","0.1504","0.1668","","","","","","1.013","","","","has coordinates","228760","2020-10-21","18:00:00",""
"1549957","24.5859","0.0004","11.8194","0.0002","26.9019","0.0004","90","","116.277","0.001","90","","7009.6","0.2","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C77 H77 Au Cl2 Sb4 -","- C77 H77 Au Cl2 Sb4 -","- C308 H308 Au4 Cl8 Sb16 -","4","1","","Li, Ying-Zhou; Ganguly, Rakesh; Hong, Kar Yiu; Li, Yongxin; Tessensohn, Malcolm Eugene; Webster, Richard; Leong, Weng Kee","Stibine-protected Au<sub>13</sub> nanoclusters: syntheses, properties and facile conversion to GSH-protected Au<sub>25</sub> nanocluster.","Chemical science","2018","9","46","8723","8730","10.1039/c8sc03132k","","","0.71073","MoKα","","0.0765","0.044","","","0.0806","0.0955","","","","","","1.047","","","","has coordinates","228752","2020-10-21","18:00:00",""
"1550977","12.0303","0.0005","11.0429","0.0004","22.8724","0.0009","90","","94.3767","0.0015","90","","3029.7","0.2","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C65 H99 B2 Fe N7 O3 -","- C65 H99 B2 Fe N7 O3 -","- C130 H198 B4 Fe2 N14 O6 -","2","0.5","","Kiernicki, John J.; Shanahan, James P.; Zeller, Matthias; Szymczak, Nathaniel K.","Tuning ligand field strength with pendent Lewis acids: access to high spin iron hydrides","Chemical Science","2019","","","","","10.1039/C9SC00561G","","","0.71073","MoKα","","0.0714","0.0518","","","0.1204","0.1365","","","","","","1.067","","","","has coordinates,has disorder","214979","2020-10-21","18:00:00",""
"1551448","12.0069","0.0004","3.9729","0.0002","22.0798","0.0007","90","","100.208","0.003","90","","1036.58","0.07","150","","150","","","","","","","",".","3","P 1 2/c 1","-P 2yc","13","","","","- C24 H10 Br4 -","- C24 H10 Br4 -","- C48 H20 Br8 -","2","0.5","","Niko Pavlicek; Przemyslaw Gawel; Daniel R. Kohn; Zsolt Majzik; Yaoyao Xiong; Gerhard Meyer; Harry L. Anderson; Leo Gross","Polyyne formation via skeletal rearrangement induced by atomic manipulation","Nature Chemistry","2018","10","","853","858","10.1038/s41557-018-0067-y","","","1.54184","CuKα","","0.0525","0.0499","","0.1282","0.1222","0.1282","","","","","","1.0504","","","","has coordinates,has Fobs","216016","2020-10-21","18:00:00",""
"1551488","19.934","0.004","10.691","0.002","29.55","0.007","90","","101.58","0.003","90","","6169","2","123","2","123","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C57 H33 F10 N6 O3 -","- C57 H33 F10 N6 O3 -","- C228 H132 F40 N24 O12 -","4","1","","Jackson D. Megiatto Jr; Dalvin D. Mendez-Hernandez; Marely E. Tejeda-Ferrari; Anne-Lucie Teillout; Manuel J. Llansola-Portoles; Gerdenis Kodis; Oleg G. Poluektov; Tijana Rajh; Vladimiro Mujica; Thomas L. Groy; Devens Gust; Thomas A. Moore; Ana L. Moore","A bioinspired redox relay that mimics radical interactions of the Tyr-His pairs of photosystem II","Nature Chemistry","2014","6","","423","428","10.1038/nchem.1862","","","0.71073","MoKα","","0.1501","0.0774","","","0.1946","0.2276","","","","","","0.978","","","","has coordinates","216060","2020-10-21","18:00:00",""
"1551520","20.55","0.03","7.366","0.012","17.52","0.03","90","","105.71","0.03","90","","2553","7","296.15","","296.15","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C23 H23 Cl2 N7 S2 Zn -","- C23 H21 Cl2 N7 S2 Zn -","- C92 H84 Cl8 N28 S8 Zn4 -","4","1","","Yu, Ping; Deng, Jungang; Cai, Jinhua; Zhang, Zhenlei; Zhang, Juzheng; Hamid Khan, Muhammad; Liang, Hong; Yang, Feng","Anticancer and biological properties of a Zn-2,6-diacetylpyridine bis(thiosemicarbazone) complex.","Metallomics : integrated biometal science","2019","11","8","1372","1386","10.1039/c9mt00124g","","","0.71073","MoKα","","0.0998","0.0517","","","0.1338","0.169","","","","","","0.973","","","","has coordinates","224652","2020-10-21","18:00:00",""
"1551527","18.098","0.003","4.3275","0.0008","14.572","0.003","90","","104.283","0.003","90","","1106","0.4","90","2","90","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C19 H26 Cl2 N2 O8 -","- C19 H20 Cl2 N2 O8 -","- C38 H40 Cl4 N4 O16 -","2","0.5","","MIKURIYA, Masahiro; KOYAMA, Yoshiki; MITSUHASHI, Ryoji","Synthesis and Crystal Structure of 1,3-Bis(5-chloro-3-methoxysalicylideneamino)-2-propanol Trihydrate","X-ray Structure Analysis Online","2019","35","0","33","","10.2116/xraystruct.35.33","","","0.71073","MoKα","","0.0903","0.0734","","","0.2011","0.214","","","","","","1.093","","","","has coordinates,has disorder","216137","2020-10-21","18:00:00",""
"1551629","14.1757","0.0003","8.23382","0.00015","28.6476","0.0006","90","","102.007","0.0007","90","","3270.59","0.11","93","","93","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C16 H17 N O4 S2 -","- C16 H17 N O4 S2 -","- C128 H136 N8 O32 S16 -","8","2","","IGARASHI, Ryota; NAGASE, Hiromasa; FURUISHI, Takayuki; TOMONO, Kazuo; ENDO, Tomohiro; UEDA, Haruhisa","Crystal Structure of an Epalrestat Methanol Solvate","X-ray Structure Analysis Online","2015","31","0","1","","10.2116/xraystruct.31.1","","","1.54187","CuKα","","","0.0337","","","","0.0883","","","","","","1.088","","","","has coordinates","216240","2020-10-21","18:00:00",""
"1551866","16.471","0.003","13.801","0.003","18.659","0.004","90","","91.86","0.03","90","","4239.3","1.5","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C40 H39 Cu3 N8 O16.5 -","- C40 H39 Cu3 N8 O16.5 -","- C160 H156 Cu12 N32 O66 -","4","1","","Muthukumar, P.; Moon, Dohyun; Anthony, Philip Philip","Copper Coordination Polymer Electrocatalyst for Strong Hydrogen Evolution Reaction Activity in Neutral Medium: Influence of Coordination Environment and Network Structure","Catalysis Science & Technology","2019","","","","","10.1039/C9CY00759H","","","0.6","synchrotron","","0.0649","0.0518","","","0.1653","0.1736","","","","","","1.066","","","","has coordinates","279031","2022-11-07","10:58:29",""
"1552861","7.1661","0.0003","15.084","0.0006","19.1836","0.0009","90","","103.732","0.004","90","","2014.35","0.15","103","2","103","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C56 H80 Cl16 N16 O16 Zn4 -","- C56 H80 Cl16 N16 O16 Zn4 -","- C56 H80 Cl16 N16 O16 Zn4 -","1","0.25","","Nie, Yu; Zhang, Zhi-Xu; Shi, Ping-Ping; Zhang, Wan-Ying; Ye, Qiong; Fu, Da-Wei","Flexible Thin Film and Bulk Switchable Relaxor Coexisting Most Optimal 473 nm Blue Light without Blue-Light Hazard/Visual Injury","The Journal of Physical Chemistry C","2019","","","","","10.1021/acs.jpcc.9b09239","","","0.71073","MoKα","","0.1148","0.1021","","","0.2082","0.2102","","","","","","1.052","","","","has coordinates,has disorder","227682","2020-10-21","18:00:00",""
"1553006","23.3968","0.0008","10.7057","0.0004","19.1358","0.0007","90","","90.758","0.003","90","","4792.7","0.3","173","","173","","","","","","","","","9","P 1 2/c 1","-P 2yc","13","","","","- C49.5 H45 B Cl5 F4 N O P2 Ru -","- C49.5 H45 B Cl5 F4 N O P2 Ru -","- C198 H180 B4 Cl20 F16 N4 O4 P8 Ru4 -","4","1","","Zhou, Xiaoxi; Zhang, Chunhong; Lin, Yumei; He, Xumin; Zhang, Yan; Wang, Jianbo; Xia, Haiping","1,2-Migration in the reactions of ruthenium vinyl carbene with propargyl alcohols","Org. Chem. Front.","2014","1","9","1077","","10.1039/C4QO00152D","","","0.71073","MoKα","","0.056","0.0448","","","0.1173","0.1221","","","","","","1.355","","","","has coordinates","232954","2020-10-21","18:00:00",""
"1553136","12.8276","0.0003","8.4882","0.0002","24.8068","0.0007","90","","91.044","0.002","90","","2700.6","0.12","291","2","291.15","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C14 H14 N2 O3 -","- C14 H14 N2 O3 -","- C112 H112 N16 O24 -","8","2","","Zhang, Duo; Cui, Xiuling; Yang, Fangfang; Zhang, Qianqian; Zhu, Yu; Wu, Yangjie","Palladium-catalyzed direct ortho C‒O bond construction of azoxybenzenes with carboxylic acids and alcohols","Organic Chemistry Frontiers","2015","2","8","951","","10.1039/C5QO00120J","","","1.54184","CuKα","","0.0653","0.0478","","","0.1264","0.1417","","","","","","1.026","","","","has coordinates","233629","2020-10-21","18:00:00",""
"1553221","15.9874","0.0007","10.2887","0.0004","13.7969","0.0006","90","","108.28","0.001","90","","2154.92","0.16","173","2","173","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C14 H12 O3 -","- C14 H12 O3 -","- C112 H96 O24 -","8","2","","Cai, Shujun; Xiao, Zheming; Ou, Jinjie; Shi, Yingbo; Gao, Shuanhu","A photo-induced C‒C bond formation methodology to construct tetrahydrofluorenones and their related structures","Organic Chemistry Frontiers","2016","3","3","354","","10.1039/C5QO00392J","","","0.71073","MoKα","","0.0706","0.0506","","","0.1169","0.1317","","","","","","1.022","","","","has coordinates","233715","2020-10-21","18:00:00",""
"1553555","19.0809","0.0007","5.7136","0.0002","17.2112","0.0006","90","","100.175","0.001","90","","1846.87","0.11","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","3-iodo-5-isopropoxy-2,4-diphenylselenophene","3-iodo-5-isopropoxy-2,4-diphenylselenophene","","- C20 H19 I O Se -","- C20 H19 I O Se -","- C80 H76 I4 O4 Se4 -","4","1","","Pistoia, Renan P.; Roehrs, Juliano A.; Back, Davi F.; Zeni, Gilson","Iodine-mediated regioselective 5-endo-dig electrophilic cyclization reaction of selenoenynes: synthesis of selenophene derivatives","Organic Chemistry Frontiers","2017","4","2","277","","10.1039/C6QO00491A","","","0.71073","MoKα","","0.0243","0.0207","","","0.0482","0.0495","","","","","","1.07","","","","has coordinates","235127","2020-10-21","18:00:00",""
"1555384","12.718","0.002","8.6639","0.0016","12.342","0.002","90","","101.101","0.003","90","","1334.5","0.4","293","2","293.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C30 H32 B2 F4 N4 -","- C30 H32 B2 F4 N4 -","- C60 H64 B4 F8 N8 -","2","0.5","","Wang, Jun; Wu, Qinghua; Wang, Shaowu; Yu, Changjiang; Li, Jin; Hao, Erhong; Wei, Yun; Mu, Xiaolong; Jiao, Lijuan","Conformation-Restricted Partially and Fully Fused BODIPY Dimers as Highly Stable Near-Infrared Fluorescent Dyes.","Organic letters","2015","17","21","5360","5363","10.1021/acs.orglett.5b02717","","","0.71073","MoKα","","0.1728","0.0614","","","0.1313","0.1804","","","","","","0.981","","","","has coordinates,has disorder","238591","2020-10-21","18:00:00",""
"1555925","11.104","0.004","9.075","0.003","27.414","0.01","90","","91.04","0.006","90","","2762","1.7","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C27 H20 F O P -","- C27 H20 F O P -","- C108 H80 F4 O4 P4 -","4","1","","Hu, Gaobo; Shan, Changkai; Chen, Weizhu; Xu, Pengxiang; Gao, Yuxing; Zhao, Yufen","Copper-Catalyzed Direct Coupling of Unprotected Propargylic Alcohols with P(O)H Compounds: Access to Allenylphosphoryl Compounds under Ligand- and Base-Free Conditions.","Organic letters","2016","18","23","6066","6069","10.1021/acs.orglett.6b03028","","","0.71","MoKα","","0.0985","0.0784","","","0.1998","0.2094","","","","","","1.047","","","","has coordinates","239250","2020-10-21","18:00:00",""
"1556087","12.7413","0.0001","12.9234","0.0001","20.9538","0.0001","90","","89.975","0.001","90","","3450.27","0.04","100.01","0.1","100.01","0.1","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","[Ag2(dppa)3](NO3)2","","- C37 H33.5 Ag Cl2 N2 O1.5 P3 -","- C37 H33.5 Ag Cl2 N2 O1.5 P3 -","- C148 H134 Ag4 Cl8 N8 O6 P12 -","4","1","","Ma, Howard Z.; McKay, Alasdair I.; Mravak, Antonija; Scholz, Michael S.; White, Jonathan M.; Mulder, Roger J.; Bieske, Evan J.; Bonačić-Koutecký, Vlasta; O'Hair, Richard A. J.","Structural characterization and gas-phase studies of the [Ag10H8(L)6]2+ nanocluster dication","Nanoscale","2019","","","","","10.1039/C9NR08321A","","x-ray","1.54184","CuKα","","0.0376","0.0368","","","0.1011","0.1017","","","","","","1.078","","","","has coordinates,has disorder","242767","2020-10-21","18:00:00",""
"1557388","20.1826","0.0009","18.7307","0.0007","17.1854","0.0006","90","","91.583","0.002","90","","6494.2","0.4","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C56 H40 N4 O12 Zn2 -","- C56 H40 N4 O12 Zn2 -","- C224 H160 N16 O48 Zn8 -","4","1","","Park, In-Hyeok; Dey, Atanu; Sasaki, Kenta; Ohba, Masaaki; Lee, Shim Sung; Vittal, Jagadese J.","Disappeared supramolecular isomer reappears with perylene guest","IUCrJ","2020","7","2","324","330","10.1107/S2052252520001451","","","1.54178","CuKα","","0.0997","0.0768","","","0.2231","0.2401","","","","","","1.091","","","","has coordinates,has disorder","249078","2020-10-21","18:00:00",""
"1557669","21.7576","0.0003","9.38142","0.00011","22.7647","0.0003","90","","99.6152","0.0011","90","","4581.39","0.1","100","0.1","100","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C30 H20 F2 N2 O2 -","- C30 H20 F2 N2 O2 -","- C240 H160 F16 N16 O16 -","8","2","","Wang, Haoran; Xing, Hao; Gong, Junyi; Zhang, Haoke; Zhang, Jun; Wei, Peifa; Yang, Guojian; Lam, Jacky W. Y.; Lu, Ran; Tang, Ben Zhong","“Living” luminogens: light driven ACQ-to-AIE transformation accompanied with solid-state actuation","Materials Horizons","2020","7","6","1566","1572","10.1039/D0MH00447B","","x-ray","1.54184","CuKα","","0.0482","0.0447","","","0.1112","0.1139","","","","","","1.025","","","","has coordinates","258156","2020-10-21","18:00:00",""
"1557789","4.519","0.003","5.503","0.008","4.888","0.002","90","","90.59","0.08","90","","121.5","0.2","","","293","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","Riesite IMA-2015-110","","","- O2 Ti -","- O2 Ti -","- O8 Ti4 -","4","1","","Oliver Tschauner; Chi Ma; Antonio Lanzirotti; Matthew G. Newville","Riesite, a New High Pressure Polymorph of TiO2 from the Ries Impact Structure","Minerals","2020","10","","78","","10.3390/min10010078","powder diffraction","x-ray","0.6199","","","","","","","","","0.078","0.096","","","","","","","","has coordinates","250752","2020-10-21","18:00:00",""
"1557838","13.5339","0.0006","13.5131","0.0006","18.1559","0.0006","90","","100.481","0.002","90","","3265","0.2","100","","100","","","","","","","","see text","4","P 1 2/c 1","-P 2yc","13","","","","- C72 H102 Al2 N4 -","- C72 H102 Al2 N4 -","- C144 H204 Al4 N8 -","2","0.5","","Weetman, Catherine; Porzelt, Amelie; Bag, Prasenjit; Hanusch, Franziska; Inoue, Shigeyoshi","Dialumenes ‒ aryl vs. silyl stabilisation for small molecule activation and catalysis","Chemical Science","2020","11","18","4817","4827","10.1039/D0SC01561J","","x-ray","0.71073","MoKα","","0.046","0.0406","","","0.0962","0.0997","","","","","","1.043","","","","has coordinates,has disorder","257388","2020-10-21","18:00:00",""
"1558065","23.165","0.0004","7.44609","0.00009","15.706","0.0002","90","","107.268","0.0016","90","","2587.01","0.07","150","2","150","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C26 H25.5 F3 I Ir N3 O P0.5 -","- C26 H25.5 F3 I Ir N3 O P0.5 -","- C104 H102 F12 I4 Ir4 N12 O4 P2 -","4","1","","Zhang, Wen-Ying; Banerjee, Samya; Hughes, George M.; Bridgewater, Hannah E.; Song, Ji-Inn; Breeze, Ben G.; Clarkson, Guy J.; Coverdale, James P. C.; Sanchez-Cano, Carlos; Ponte, Fortuna; Sicilia, Emilia; Sadler, Peter J.","Ligand-centred redox activation of inert organoiridium anticancer catalysts","Chemical Science","2020","11","21","5466","5480","10.1039/D0SC00897D","","x-ray","0.71073","MoKα","","0.0314","0.0231","","","0.0416","0.0439","","","","","","1.05","","","","has coordinates,has disorder","257399","2020-10-21","18:00:00",""
"1558195","8.4965","0.0005","7.8419","0.0005","26.1413","0.0017","90","","90.318","0.002","90","","1741.73","0.19","296","2","296.15","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C12 H36 Ag Br12 In N4 -","- C12 H36 Ag Br12 In N4 -","- C24 H72 Ag2 Br24 In2 N8 -","2","0.5","","Connor, Bridget A.; Biega, Raisa-Ioana; Leppert, Linn; Karunadasa, Hemamala I.","Dimensional reduction of the small-bandgap double perovskite Cs<sub>2</sub>AgTlBr<sub>6</sub>.","Chemical science","2020","11","29","7708","7715","10.1039/d0sc01580f","","","0.71073","MoKα","","0.0684","0.0599","","","0.1573","0.1641","","","","","","1.112","","","","has coordinates,has disorder","256034","2020-10-21","18:00:00",""
"1558197","8.4673","0.0003","7.8406","0.0003","26.1647","0.001","90","","90.312","0.002","90","","1737.01","0.11","298","","298","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C12 H36 Ag Br12 N4 Tl -","- C12 H36 Ag Br12 N4 Tl -","- C24 H72 Ag2 Br24 N8 Tl2 -","2","0.5","","Connor, Bridget A.; Biega, Raisa-Ioana; Leppert, Linn; Karunadasa, Hemamala I.","Dimensional reduction of the small-bandgap double perovskite Cs<sub>2</sub>AgTlBr<sub>6</sub>.","Chemical science","2020","11","29","7708","7715","10.1039/d0sc01580f","","","0.7288","synchrotron","","0.0495","0.038","","","0.0862","0.0905","","","","","","1.082","","","","has coordinates,has disorder","256034","2020-10-21","18:00:00",""
"1558320","10.1578","0.0019","11.4859","0.0018","14.985","0.003","90","","106.365","0.017","90","","1677.5","0.5","300","2","300.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","sql-1,3-Co-NCS","","","- C24 H16 Co N10 S2 -","- C24 H16 Co N10 S2 -","- C48 H32 Co2 N20 S4 -","2","0.5","","Zaworotko, Michael; Kumar, Naveen; Chang, Ze; Yu, Mei-Hui; Kumar, Amrit; O’Nolan, Daniel; Bu, Xian-He; Patyk-Kaźmierczak, Ewa; Bezrukov, Andrey A.; Mukherjee, Soumya; Wang, Shi-Qiang","Crystal engineering of a rectangular sql coordination network to enable xylenes selectivity over ethylbenzene","Chemical Science","2020","","","","","10.1039/D0SC02123G","","","1.54178","CuKα","","0.2123","0.1287","","","0.3214","0.3547","","","","","","1.071","","","","has coordinates,has disorder","253188","2020-10-21","18:00:00",""
"1559001","10.087","0.002","6.34","0.003","15.557","0.001","90","","124.36","0.01","90","","821.3","0.4","","","294","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","[Cu(C4H10NO3)2].5H2O","","","- C8 H30 Cu N2 O11 -","- C8 Cu N2 O11 -","- C16 Cu2 N4 O22 -","2","0.5","","Kotila, Sirpa; Valkonen, Jussi","Copper(II) Complexes of 2-Amino-2-hydroxymethyl-1,3-propanediol. Part 1. Synthesis, Structure and Thermal Behavior of Three trans-Bis[2-amino-2-hydroxymethyl-1,3-propanediolato-(1)-O,N]copper(II) Complexes, [Cu(C4H10NO3)2], [Cu(C4H10NO3)2(H2O)] and [Cu(C4H10NO3)2].5H2O","Acta Chemica Scandinavica","1993","47","","950","956","10.3891/acta.chem.scand.47-0950","","x-ray","0.71073","MoKα","","","0.026","","","0.032","","","","","","","0.713","","","","has coordinates","256205","2020-10-21","18:00:00",""
"1559256","9.369","0.0004","8.7013","0.0005","12.1951","0.0006","90","","112.512","0.003","90","","918.42","0.08","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C16 H16 Cl Cu2 N6 O2 -","- C16 H16 Cl Cu2 N6 O2 -","- C32 H32 Cl2 Cu4 N12 O4 -","2","0.5","","Chevalier, Aline; Osypenko, Artem; Lehn, Jean-Marie; Meyer, Daniel","Phase transfer of metal cations by induced dynamic carrier agents: biphasic extraction based on dynamic covalent chemistry","Chemical Science","2020","","","","","10.1039/D0SC04098C","","","1.54178","CuKα","","0.0795","0.0526","","","0.1344","0.1498","","","","","","1.038","","","","has coordinates","256968","2020-10-21","18:00:00",""
"1559772","19.158","0.0007","6.7794","0.0003","17.4666","0.0006","90","","109.362","0.001","90","","2140.25","0.14","200","2","200","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C54 H38 F8 N4 -","- C54 H38 F8 N4 -","- C108 H76 F16 N8 -","2","0.5","","Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio","Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines.","Chemical science","2020","12","6","2181","2188","10.1039/d0sc05899h","","","0.7288","synchrotron","","0.0585","0.0542","","","0.1407","0.1462","","","","","","1.034","","","","has coordinates,has disorder","267084","2021-07-05","16:54:06",""
"1559781","19.1368","0.0008","6.7789","0.0003","17.4066","0.0008","90","","109.373","0.001","90","","2130.24","0.16","150","2","150","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C54 H38 F8 N4 -","- C54 H38 F8 N4 -","- C108 H76 F16 N8 -","2","0.5","","Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio","Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines.","Chemical science","2020","12","6","2181","2188","10.1039/d0sc05899h","","","0.7288","synchrotron","","0.0606","0.0585","","","0.1458","0.1484","","","","","","1.045","","","","has coordinates,has disorder","267084","2021-07-05","16:54:06",""
"1559783","19.2225","0.0009","6.7835","0.0003","17.5663","0.0008","90","","109.337","0.002","90","","2161.35","0.17","250","2","250","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C54 H38 F8 N4 -","- C54 H38 F8 N4 -","- C108 H76 F16 N8 -","2","0.5","","Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio","Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines.","Chemical science","2020","12","6","2181","2188","10.1039/d0sc05899h","","","0.7288","synchrotron","","0.0609","0.0572","","","0.1497","0.1549","","","","","","1.049","","","","has coordinates,has disorder","267084","2021-07-05","16:54:06",""
"1559784","19.2767","0.0006","6.7799","0.0002","17.6615","0.0006","90","","109.29","0.001","90","","2178.67","0.12","301","2","301","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C54 H38 F8 N4 -","- C54 H38 F8 N4 -","- C108 H76 F16 N8 -","2","0.5","","Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio","Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines.","Chemical science","2020","12","6","2181","2188","10.1039/d0sc05899h","","","0.7288","synchrotron","","0.0629","0.058","","","0.1585","0.1661","","","","","","1.048","","","","has coordinates,has disorder","267084","2021-07-05","16:54:06",""
"1559838","11.4524","0.0007","10.1266","0.0006","12.3116","0.001","90","","122.009","0.001","90","","1210.74","0.14","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- B7 K9 Li3 Nd3 O21 -","- B7 K9 Li3 Nd3 O21 -","- B14 K18 Li6 Nd6 O42 -","2","0.5","","Chen, Pengyun; Xia, Mingjun; Li, Rukang","Mixed Alkali Neodymium Orthoborates: K9 Li3 Nd3 (BO3 )7 and A 2 LiNd(BO3 )2 (A = Rb, Cs)","Zeitschrift für anorganische und allgemeine Chemie","2016","642","5","424","430","10.1002/zaac.201500804","","","0.71073","MoKα","","0.0303","0.0298","","","0.0748","0.0753","","","","","","1.125","","","","has coordinates","260055","2020-12-21","17:55:32",""
"1559855","18.7182","0.0007","24.1607","0.0011","23.662","0.0009","90","","98.957","0.003","90","","10570.5","0.7","173","","173","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C45 H50 B2 Fe N10 O -","- C45 H50 B2 Fe N10 O -","- C360 H400 B16 Fe8 N80 O8 -","8","2","","Nurdin, Lucie; Yang, Yan; Neate, Peter G. N.; Piers, Warren E.; Maron, Laurent; Neidig, Michael L.; Lin, Jian-Bin; Gelfand, Benjamin S.","Activation of ammonia and hydrazine by electron rich Fe(ii) complexes supported by a dianionic pentadentate ligand platform through a common terminal Fe(iii) amido intermediate.","Chemical science","2020","12","6","2231","2241","10.1039/d0sc06466a","","","1.54178","CuKα","","0.0915","0.0677","","","0.1758","0.1953","","","","","","1.029","","","","has coordinates,has disorder","267085","2021-07-05","16:54:38",""
"1559995","22.8339","0.0003","9.8626","0.0002","22.7576","0.0003","90","","117.704","0.001","90","","4537.52","0.13","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C29 H17 F4 N3 O Pt -","- C29 H17 F4 N3 O Pt -","- C232 H136 F32 N24 O8 Pt8 -","8","2","","Maisuls, Iván; Wang, Cui; Gutierrez Suburu, Matias E.; Wilde, Sebastian; Daniliuc, Constantin-Gabriel; Brünink, Dana; Doltsinis, Nikos L.; Ostendorp, Stefan; Wilde, Gerhard; Kösters, Jutta; Resch-Genger, Ute; Strassert, Cristian A.","Ligand-controlled and nanoconfinement-boosted luminescence employing Pt(ii) and Pd(ii) complexes: from color-tunable aggregation-enhanced dual emitters towards self-referenced oxygen reporters","Chemical Science","2021","12","9","3270","3281","10.1039/D0SC06126C","","","0.71073","MoKα","","0.0632","0.0434","","","0.0827","0.0936","","","","","","1.069","","","","has coordinates","263695","2021-04-05","14:22:30",""
"1560381","18.7074","0.0011","9.1703","0.0005","28.5497","0.0016","90","","94.276","0.003","90","","4884.1","0.5","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C46 H37 Cd3 N10 O20 -","- C46 H31 Cd3 N10 O20 -","- C184 H124 Cd12 N40 O80 -","4","1","","Shi, Chenjie; Wang, Zikai; Chen, Yifan; Zhang, Xiaoyu; Zhao, Yue; Tao, Yuehong; Wu, Hua","Structural diversity of four coordination polymers based on 5-nitro-1,2,3-benzenetricarboxylic acid (H3nbta): Solvothermal syntheses, structural characterizations and properties","Journal of Solid State Chemistry","2017","253","","35","42","10.1016/j.jssc.2017.05.010","","","0.71073","MoKα","","0.0401","0.0303","","","0.0708","0.0747","","","","","","1.018","","","","has coordinates","261965","2021-02-15","10:24:32",""
"1561000","13.235","0.014","8.817","0.009","17.848","0.019","90","","96.459","0.013","90","","2070","4","296","2","296.15","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C84 H66 N8 Ni2 O17 Si2 -","- C84 H66 N8 Ni2 O17 Si2 -","- C84 H66 N8 Ni2 O17 Si2 -","1","0.25","","Li, Qi; Guo, Tiantian; Lv, Xin; Lin, Yifang; Dai, Zhihui; Fang, Min; Bao, Jianchun; Wu, Yong","Two Ni(II) semiconducting metal-organic frameworks based on the tetrakis(4-carboxyphenyl)silane and an imidazole ligand: Syntheses, characterization, water stability and photoelectric properties","Journal of Solid State Chemistry","2018","265","","100","108","10.1016/j.jssc.2018.05.010","","","0.71073","MoKα","","0.0399","0.034","","","0.0986","0.1035","","","","","","1.071","","","","has coordinates","262972","2021-03-10","10:44:28",""
"1561196","7.8496","0.0005","5.3514","0.0003","16.5895","0.001","90","","100.705","0.002","90","","684.74","0.07","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C10 H12 N6 O6 Zn -","- C10 H12 N6 O6 Zn -","- C20 H24 N12 O12 Zn2 -","2","0.5","","Duan, Hui; Dan, Wenyan; Fang, Xiangdong","Zinc-coordinated MOFs complexes regulated by hydrogen bonds: Synthesis, structure and luminescence study toward broadband white-light emission","Journal of Solid State Chemistry","2018","260","","159","164","10.1016/j.jssc.2018.01.024","","","0.71073","MoKα","","0.0295","0.0245","","","0.062","0.0641","","","","","","1.075","","","","has coordinates","263241","2021-03-23","08:27:51",""
"1561685","9.5837","0.0003","12.643","0.0003","13.9294","0.0004","90","","110.093","0.0011","90","","1585.05","0.08","103","2","103","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C27 H11 Co3 O18 -","- C27 H11 Co3 O18 -","- C54 H22 Co6 O36 -","2","0.5","","Yu, Xianglin; Toh, Yong Siang; Zhao, Jun; Nie, Lina; Ye, Kaiqi; Wang, Yue; Li, Dongsheng; Zhang, Qichun","Surfactant-thermal method to prepare two new cobalt metal-organic frameworks","Journal of Solid State Chemistry","2015","232","","14","18","10.1016/j.jssc.2015.08.048","","","0.71073","MoKα","","0.0378","0.0321","","","0.085","0.0872","","","","","","1.15","","","","has coordinates,has disorder","264084","2021-04-13","09:27:37",""
"1561744","15.291","0.015","11.235","0.012","24.984","0.018","90","","115.28","0.04","90","","3881","6","296","2","296.15","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C74 H66 N10 Ni3 O30.5 S2 -","- C74 H56 N10 Ni3 O30.5 S2 -","- C148 H112 N20 Ni6 O61 S4 -","2","0.5","","Feng, Xun; Liu, Jing; Li, Jin; Ma, Lu-Fang; Wang, Li-Ya; Ng, Seik-Weng; Qin, Guo-Zhan","Series of coordination polymers based on 4-(5-sulfo-quinolin-8-yloxy) phthalate and bipyridinyl coligands: Structure diversity and properties","Journal of Solid State Chemistry","2015","230","","80","89","10.1016/j.jssc.2015.06.018","","","0.71073","MoKα","","0.1898","0.0865","","","0.1997","0.2592","","","","","","0.965","","","","has coordinates","264140","2021-04-14","09:30:57",""
"1561824","18.3022","0.0003","8.84836","0.00016","17.5015","0.0003","90","","93.8224","0.0015","90","","2827.97","0.08","292.82","0.1","292.82","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C22 H14 Br4 Cd N4 O4 -","- C22 H14 Br4 Cd N4 O4 -","- C88 H56 Br16 Cd4 N16 O16 -","4","1","","Zhang, Xiaowei; Xing, Peiqi; Geng, Xiujuan; Sun, Daofeng; Xiao, Zhenyu; Wang, Lei","Transition metal coordination polymers based on tetrabromoterephthalic and bis(imidazole) ligands: Syntheses, structures, topological analysis and photoluminescence properties","Journal of Solid State Chemistry","2015","229","","49","61","10.1016/j.jssc.2015.05.008","","","1.54184","CuKα","","0.0642","0.0583","","","0.177","0.1862","","","","","","1.044","","","","has coordinates","264205","2021-04-15","09:36:21",""
"1561879","14.9539","0.0018","11.532","0.0014","20.406","0.002","90","","91.324","0.002","90","","3518","0.7","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C55 H55 Ag5 B5 F20 N15 O10 -","- C55 H55 Ag5 B5 F20 N15 O10 -","- C110 H110 Ag10 B10 F40 N30 O20 -","2","0.5","","Kuai, Hai-Wei; Cheng, Xiao-Chun; Li, Deng-Hao; Hu, Tao; Zhu, Xiao-Hong","Syntheses, characterization and properties of silver, copper and palladium complexes from bis(oxazoline)-containing ligands","Journal of Solid State Chemistry","2015","228","","65","75","10.1016/j.jssc.2015.04.021","","","0.71073","MoKα","","0.0801","0.0444","","","0.0968","0.1115","","","","","","1.001","","","","has coordinates,has disorder","264290","2021-04-19","07:01:06",""
"1561946","12.3428","0.0006","8.4603","0.0004","16.0543","0.0006","90","","92.881","0.004","90","","1674.33","0.13","93.15","","93.15","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Aqua(1,4,7,10-tetraazacyclododecane)zinc(II) bis(perchlorate)","","- C8 H22 Cl2 N4 O9 Zn -","- C8 H22 Cl2 N4 O9 Zn -","- C32 H88 Cl8 N16 O36 Zn4 -","4","1","VM4048","Ichimaru, Yoshimi; Kato, Koichi; Kurosaki, Hiromasa; Fujioka, Haruto; Sakai, Misa; Yamaguchi, Yoshihiro; Wanchun, Jin; Sugiura, Kirara; Imai, Masanori; Koike, Tohru","Aqua(1,4,7,10-tetraazacyclododecane)zinc(II) bis(perchlorate)","IUCrData","2021","6","4","","","10.1107/S2414314621003977","","x-ray","1.54184","CuKα","","0.0758","0.0665","","","0.1811","0.1856","","","","","","1.078","","","","has coordinates,has disorder,has Fobs","264354","2021-04-21","05:21:36",""
"1562076","8.7238","0.0009","11.396","0.0012","23.211","0.003","90","","97.59","0.002","90","","2287.3","0.4","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C92 H86 Cu4 N16 O23 S2 -","- C92 H78.8 Cu4 N16 O23 S2 -","- C92 H78.8 Cu4 N16 O23 S2 -","1","0.25","","Kuai, Hai-Wei; Lv, Gao-Chao; Hou, Chao; Sun, Wei-Yin","Anion-controlled assembly of metal 3,5-bis(benzimidazol-1-ylmethyl) benzoate complexes: Synthesis, characterization and property","Journal of Solid State Chemistry","2015","223","","2","16","10.1016/j.jssc.2014.02.028","","","0.71073","MoKα","","0.0624","0.0549","","","0.155","0.1598","","","","","","1.075","","","","has coordinates","264525","2021-04-26","07:24:59",""
"1562336","17.899","0.002","8.0675","0.0012","7.84","0.0011","90","","95.565","0.002","90","","1126.8","0.3","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H20 Cl2 Cu N6 O5 -","- C20 H20 Cl2 Cu N6 O5 -","- C40 H40 Cl4 Cu2 N12 O10 -","2","0.5","","Xiong, Pingping; Li, Jie; Bu, Huaiyu; Wei, Qing; Zhang, Ruolin; Chen, Sanping","Copper(II) complexes with 4-(1H-1, 2, 4-trizol-1-ylmethyl) benzoic acid: Syntheses, crystal structures and antifungal activities","Journal of Solid State Chemistry","2014","215","","292","299","10.1016/j.jssc.2014.04.012","","","0.71073","MoKα","","0.0367","0.029","","","0.0551","0.0585","","","","","","1.014","","","","has coordinates","264727","2021-04-30","09:41:16",""
"1562487","20.71","0.007","15.286","0.005","17.893","0.005","90","","102.56","0.005","90","","5529","3","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C38 H30 Co2 N4 O8 -","- C38 H30 Co2 N4 O8 -","- C152 H120 Co8 N16 O32 -","4","1","","Jia, Li-Na; Zhao, Yang; Hou, Lei; Cui, Lin; Wang, Hai-Hua; Wang, Yao-Yu","An interpenetrated pillared-layer MOF: Synthesis, structure, sorption and magnetic properties","Journal of Solid State Chemistry","2014","210","1","251","255","10.1016/j.jssc.2013.11.008","","","0.71073","MoKα","","0.1132","0.0677","","","0.1815","0.2016","","","","","","0.925","","","","has coordinates","265095","2021-05-11","08:24:14",""
"1562605","10.0129","0.0011","14.0992","0.0016","11.0454","0.0012","90","","113.927","0.001","90","","1425.3","0.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H10 N O4 Zn -","- C14 H10 N O4 Zn -","- C56 H40 N4 O16 Zn4 -","4","1","","Liu, Guang-Zhen; Li, Xiao-Dong; Xin, Ling-Yun; Li, Xiao-Ling; Wang, Li-Ya","Diverse assemblies of the (4,4) grid layers exemplified in Zn(II)/Co(II) coordination polymers with dual linear ligands","Journal of Solid State Chemistry","2013","203","","106","113","10.1016/j.jssc.2013.03.053","","","0.71073","MoKα","","0.0282","0.0238","","","0.0637","0.0656","","","","","","1.062","","","","has coordinates,has disorder","265275","2021-05-17","09:05:29",""
"1563297","23.315","0.003","9.7287","0.0013","11.8332","0.0016","90","","104.487","0.007","90","","2598.7","0.6","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H26 Co3 N2 O12 -","- C24 H26 Co3 N2 O12 -","- C96 H104 Co12 N8 O48 -","4","1","","Gu, Jin-Zhong; Lv, Dong-Yu; Gao, Zhu-Qing; Liu, Jian-Zhao; Dou, Wei; Tang, Yu","Synthesis, structures, luminescent and magnetic properties of four coordination polymers with the flexible 1,3-phenylenediacetate ligands","Journal of Solid State Chemistry","2011","184","3","675","683","10.1016/j.jssc.2011.01.030","","","0.71073","MoKα","","0.0558","0.0427","","","0.0997","0.1063","","","","","","1.064","","","","has coordinates","266358","2021-06-10","09:18:30",""
"1563540","4.80282","0.00004","5.75801","0.00006","4.98611","0.00005","90","","91.1775","0.0006","90","","137.86","0.002","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- O4 Sc0.67 W -","- O4 Sc0.669 W -","- O8 Sc1.338 W2 -","2","0.5","","Varga, Tamas; Mitchell, J.F.; Wang, Jun; Arnold, Lindsay G.; Toby, Brian H.; Malliakas, Christos D.","High-pressure synthesis, crystal and electronic structures of a new scandium tungstate, Sc0.67WO4","Journal of Solid State Chemistry","2010","183","7","1567","1573","10.1016/j.jssc.2010.04.039","","","","","","","","","","","","","","2.44","","","","","","","has coordinates","266527","2021-06-17","08:52:38",""
"1564002","14.9231","0.0004","16.3404","0.0004","23.6648","0.0008","90","","101.619","0.0014","90","","5652.4","0.3","90","","90","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","Chlorido[1,2-dimethyl-3-oxo-κO-pyridine-4(1H)-selonato- κSe](η5-1,2,3,4,5-pentamethylcyclopentadienyl)iridium(III)","","- C47 H56 Cl4 Ir2 N2 O2 Se2 -","- C47 H56 Cl4 Ir2 N2 O2 Se2 -","- C188 H224 Cl16 Ir8 N8 O8 Se8 -","4","1","","Harringer, Sophia; Matzinger, Manuel; Gajic, Natalie; Hejl, Michaela; Jakupec, Michael A.; Kandioller, Wolfgang; Keppler, Bernhard K.","First insights into the novel class of organometallic compounds bearing a bidentate selenopyridone coordination motif: Synthesis, characterization, stability and biological investigations","Inorganica Chimica Acta","2020","513","","119919","","10.1016/j.ica.2020.119919","","x-ray","0.71073","MoKα","","0.0359","0.0282","","","0.0543","0.0569","","","","","","1.038","","","","has coordinates","276143","2022-06-22","06:24:16",""
"1564470","20.4487","0.001","5.2605","0.0003","18.3325","0.0009","90","","96.546","0.002","90","","1959.18","0.18","100","2","100","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C34 H46 N4 O14 S2 Zn -","- C34 H46 N4 O14 S2 Zn -","- C68 H92 N8 O28 S4 Zn2 -","2","0.5","","García-García, Amalia; Echenique-Errandonea, Estitxu; Cepeda, Javier; Choquesillo-Lazarte, Duane; Seco, José M.; Salinas-Castillo, Alfonso; Sánchez-Moreno, Manuel; Méndez-Arriaga, José M.; Rodríguez-Diéguez, Antonio","Photoluminescence and in vitro cytotoxicity analysis in a novel mononuclear Zn(II) coordination compound based on bumetanide","Inorganica Chimica Acta","2020","509","","119708","","10.1016/j.ica.2020.119708","","","1.54178","CuKα","","0.073","0.0667","","","0.1744","0.1811","","","","","","1.094","","","","has coordinates","268314","2021-08-31","07:53:33",""
"1564630","18.7592","0.0007","9.7333","0.0004","16.0077","0.0006","90","","106.724","0.002","90","","2799.2","0.19","296.15","","296.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C49 H45 Cu3 N7 O8 -","- C49 H45 Cu3 N7 O8 -","- C98 H90 Cu6 N14 O16 -","2","0.5","","Boussadia, Ahlem; Beghidja, Adel; Gali, Lynda; Beghidja, Chahrazed; Elhabiri, Mourad; Rabu, Pierre; Rogez, Guillaume","Coordination properties of two new Schiff-base phenoxy-carboxylates and comparative study of their antioxidant activities","Inorganica Chimica Acta","2020","508","","119656","","10.1016/j.ica.2020.119656","","","0.71073","MoKα","","0.1037","0.0784","","","0.2251","0.25","","","","","","1.038","","","","has coordinates","269129","2021-09-14","09:04:44",""
"1564869","11.6762","0.0007","8.0358","0.0004","15.1245","0.0009","90","","111.631","0.006","90","","1319.16","0.14","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H24 Cd N10 O8 -","- C24 H24 Cd N10 O8 -","- C48 H48 Cd2 N20 O16 -","2","0.5","","Zhang, Hong-Bin; Zhang, Xiao-Fang; Chai, Lan-Qin; Tang, Li-Jian; Zhang, Hong-Song","Zinc(II) and Cadmium(II) complexes containing imidazole ring: Structural, spectroscopic, antibacterial, DFT calculations and Hirshfeld surface analysis","Inorganica Chimica Acta","2020","507","","119610","","10.1016/j.ica.2020.119610","","","0.71073","MoKα","","0.0469","0.04","","","0.0946","0.1016","","","","","","1.046","","","","has coordinates","269834","2021-10-07","07:40:49",""
"1564884","12.4725","0.0004","9.4873","0.0003","15.3776","0.0005","90","","96.348","0.001","90","","1808.48","0.1","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C11 H19 Cu N4 O5.5 S3.5 -","- C11 H19 Cu N4 O5.5 S3.5 -","- C44 H76 Cu4 N16 O22 S14 -","4","1","","Murphy, Jaime M.; Gaertner, Andrea A.E.; Owen, Amanda M.; Struder, Samantha; McMillen, Colin D.; Wetzler, Modi; Brumaghim, Julia L.","Coordination complexes of methimazole with copper: Controlling redox reactions and sulfur extrusion","Inorganica Chimica Acta","2020","507","","119568","","10.1016/j.ica.2020.119568","","","0.71073","MoKα","","0.0528","0.0427","","","0.085","0.0896","","","","","","1.066","","","","has coordinates,has disorder","269848","2021-10-07","08:34:19",""
"1565189","9.7153","0.0005","18.5782","0.0007","19.4324","0.0008","90","","93.53","0.004","90","","3500.8","0.3","150","","150","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C58 H60 Cl8 F12 Fe N12 P2 -","- C58 H60 Cl8 F12 Fe N12 P2 -","- C116 H120 Cl16 F24 Fe2 N24 P4 -","2","0.5","","Lindh, Linnea; Gordivska, Olga; Persson, Samuel; Michaels, Hannes; Fan, Hao; Chabera, Pavel; Rosemann, Nils W.; Gupta, Arvind Kumar; Benesperi, Iacopo; Uhlig, Jens; Prakash, Om; Sheibani, Esmaeil; Kjær, Kasper Skov; Boschloo, Gerrit; Yartsev, Arkady; Freitag, Marina; Lomoth, Reiner; Persson, Petter; Wärnmark, Kenneth","Dye-Sensitized Solar Cells based on Fe N-heterocyclic Carbene Photosensitizers with Improved Rod-like Push-Pull Functionality","Chemical Science","2021","","","","","10.1039/D1SC02963K","","","0.71073","MoKα","","0.0643","0.0512","","","0.1208","0.1282","","","","","","1.073","","","","has coordinates,has disorder","270602","2021-11-11","23:16:37",""
"1565247","7.206","0.003","18.089","0.008","21.259","0.009","90","","104.489","0.013","90","","2683","2","296","2","296.15","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C21 H18 Br4 Cl3 Dy N2 O3 -","- C21 H18 Br4 Cl3 Dy N2 O3 -","- C84 H72 Br16 Cl12 Dy4 N8 O12 -","4","1","","Yin, Xiuju; Li, Shixiong; Liao, Beiling","Investigation of magneto-structural relation based on a series of mononuclear dysprosium single-ion magnets with high Oh symmetry","Inorganica Chimica Acta","2020","504","","119451","","10.1016/j.ica.2020.119451","","","0.71073","MoKα","","0.1632","0.1215","","","0.2754","0.2922","","","","","","1.278","","","","has coordinates","270683","2021-11-16","09:50:02",""
"1565344","12.669","0.002","20.792","0.003","21.234","0.003","90","","104.749","0.005","90","","5409","1.4","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C105 H75 Cl13 Hg2 N8 -","- C105 H75 Cl13 Hg2 N8 -","- C210 H150 Cl26 Hg4 N16 -","2","0.5","","Godde, Bérangère; Ferlay, Sylvie; Kyritsakas, Nathalie; Hosseini, Mir Wais; Jouaiti, Abdelaziz","Variations around 1D coordination polymers built from the triarylamine scaffold and Hg(II) or Cd(II)","Inorganica Chimica Acta","2020","503","","119427","","10.1016/j.ica.2020.119427","","","0.71073","MoKα","","0.199","0.0868","","","0.21","0.2608","","","","","","1.096","","","","has coordinates","270799","2021-11-22","10:14:01",""
"1565978","16.922","0.0015","17.1293","0.0018","27.104","0.003","90","","100.952","0.004","90","","7713.3","1.4","162","2","162","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","tetraepoxyoctabenzo[20]cyclacene-C60","","","- C214 H136 Cl4 O4 -","- C214 H136 Cl4 O4 -","- C428 H272 Cl8 O8 -","2","0.5","","Chen, Han; Xia, Zeming; Miao, Qian","Synthesis, aromatization and cavitates of an oxanorbornene-fused dibenzo[de,qr]tetracene nanobox","Chemical Science","2022","13","8","2280","2285","10.1039/D1SC06553J","","","0.71073","MoKα","","0.262","0.1808","","","0.4293","0.4849","","","","","","1.05","","","","has coordinates","273352","2022-03-04","22:07:32",""
"1565982","24.0563","0.0004","25.5964","0.0004","43.2943","0.0007","90","","93.25","0.001","90","","26615.8","0.7","99.99","0.1","99.99","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C98 H102 F6 N8 O2 S5 -","- C98 H102 F6 N8 O2 S5 -","- C980 H1020 F60 N80 O20 S50 -","10","2.5","","Li, Guoping; Feng, Liang-Wen; Mukherjee, Subhrangsu; Jones, Leighton O.; Jacobberger, Robert M.; Huang, Wei; Young, Ryan M.; Pankow, Robert M.; Zhu, Weigang; Lu, Norman; Kohlstedt, Kevin L.; Sangwan, Vinod K.; Wasielewski, Michael R.; Hersam, Mark C.; Schatz, George C.; DeLongchamp, Dean M.; Facchetti, Antonio; Marks, Tobin J.","Non-fullerene acceptors with direct and indirect hexa-fluorination afford >17% efficiency in polymer solar cells","Energy & Environmental Science","2022","15","2","645","659","10.1039/D1EE03225A","","x-ray","1.54184","CuKα","","0.2087","0.1694","","","0.4542","0.4809","","","","","","1.783","","","","has coordinates,has disorder","273375","2022-03-04","22:16:17",""
"1566874","9.948","0.0006","5.7541","0.0003","23.8405","0.0014","90","","100.984","0.003","90","","1339.67","0.13","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C16 H14 N2 O2 -","- C16 H14 N2 O2 -","- C64 H56 N8 O8 -","4","1","","Xing, Yi; Li, Zhongyu; Baryshnikov, Glib; Shen, Shen; Ye, Danfeng; Ågren, Hans; Zhu, Liangliang","Water Molecular Bridge-Induced Selective Dual Polarization in Crystals for Stable Multi-Emitter","Chemical Science","2022","","","","","10.1039/D2SC00908K","","","1.34138","GaKα","","0.0407","0.0341","","","0.0786","0.0828","","","","","","1.039","","","","has coordinates","274699","2022-04-26","22:09:23",""
"1566905","20.5713","0.001","15.332","0.0004","21.6572","0.0008","90","","96.891","0.004","90","","6781.3","0.5","100.01","0.12","100.01","0.12","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C64 H50 N30 O15 Zn6 -","- C64 H50 N30 O15 Zn6 -","- C128 H100 N60 O30 Zn12 -","2","0.5","","Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan","Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework","Chemical Science","2022","13","17","4813","4820","10.1039/D2SC00188H","","","1.54184","CuKα","","0.1781","0.1114","","","0.2984","0.3512","","","","","","0.965","","","","has coordinates,has disorder","274889","2022-05-04","21:41:17",""
"1566906","20.7927","0.0005","15.218","0.0002","21.7299","0.0005","90","","93.52","0.002","90","","6862.9","0.2","100","0.14","100","0.14","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C66 H50 N30 O15 Zn6 -","- C66 H50 N30 O15 Zn6 -","- C132 H100 N60 O30 Zn12 -","2","0.5","","Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan","Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework","Chemical Science","2022","13","17","4813","4820","10.1039/D2SC00188H","","","1.54184","CuKα","","0.1408","0.1002","","","0.274","0.3142","","","","","","0.974","","","","has coordinates,has disorder","274889","2022-05-04","21:41:18",""
"1566907","20.6916","0.0003","15.2813","0.0002","21.6745","0.0003","90","","92.481","0.001","90","","6846.93","0.16","100","0.2","100","0.2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C67 H50 N30 O15 Zn6 -","- C67 H50 N30 O15 Zn6 -","- C134 H100 N60 O30 Zn12 -","2","0.5","","Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan","Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework","Chemical Science","2022","13","17","4813","4820","10.1039/D2SC00188H","","","1.54184","CuKα","","0.1091","0.0929","","","0.2496","0.2652","","","","","","1.057","","","","has coordinates,has disorder","274889","2022-05-04","21:41:18",""
"1566908","20.5389","0.0019","15.2128","0.0005","21.6422","0.0009","90","","94.526","0.006","90","","6741.1","0.7","100","0.18","100","0.18","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C66 H50 N30 O15 Zn6 -","- C66 H50 N30 O15 Zn6 -","- C132 H100 N60 O30 Zn12 -","2","0.5","","Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan","Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework","Chemical Science","2022","13","17","4813","4820","10.1039/D2SC00188H","","x-ray","1.54184","CuKα","","0.1574","0.1162","","","0.2985","0.3476","","","","","","1.058","","","","has coordinates,has disorder","274889","2022-05-04","21:41:19",""
"1566909","20.7798","0.0004","15.2345","0.0002","21.6564","0.0004","90","","93.144","0.002","90","","6845.4","0.2","100","0.1","100","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C66 H50 N30 O15 Zn6 -","- C66 H50 N30 O15 Zn6 -","- C132 H100 N60 O30 Zn12 -","2","0.5","","Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan","Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework","Chemical Science","2022","13","17","4813","4820","10.1039/D2SC00188H","","","1.54184","CuKα","","0.1126","0.0893","","","0.2611","0.2925","","","","","","1.019","","","","has coordinates,has disorder","274889","2022-05-04","21:41:19",""
"1567081","13.3858","0.0002","14.2988","0.0002","13.1709","0.0002","90","","109.65","0.002","90","","2374.11","0.07","100","2","99.97","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H36 B I N4 O2 -","- C20 H36 B I N4 O2 -","- C80 H144 B4 I4 N16 O8 -","4","1","","Kuehn, Laura; Zapf, Ludwig; Werner, Luis; Stang, Martin; Würtemberger-Pietsch, Sabrina; Krummenacher, Ivo; Braunschweig, Holger; Lacôte, Emmanuel; Marder, Todd B.; Radius, Udo","NHC induced radical formation <i>via</i> homolytic cleavage of B-B bonds and its role in organic reactions.","Chemical science","2022","13","28","8321","8333","10.1039/d2sc02096c","","x-ray","1.54184","CuKα","","0.0422","0.0367","","","0.0946","0.1018","","","","","","1.09","","","","has coordinates,has disorder","277093","2022-08-06","11:38:29",""
"1567215","4.73523","","5.74138","","4.99198","","90","","90.0801","","90","","135.716","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Fe O4 W -","- Fe O4 W -","- Fe2 O8 W2 -","2","0.5","","Patil, Amitkumar R.; Dongale, Tukaram D.; Kamat, Rajanish K.; Rajpure, Keshav Y.","Spray pyrolysis deposited iron tungstate memristive device for artificial synapse application","Materials Today Communications","2021","29","","102900","","10.1016/j.mtcomm.2021.102900","","","","","","","","","","","","","","","","","","","","","has coordinates","276519","2022-07-04","08:11:29",""
"1567216","4.69482","","5.72249","","4.92885","","90","","90.6325","","90","","132.411","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- O4 W Zn -","- O4 W Zn -","- O8 W2 Zn2 -","2","0.5","","Patil, Amitkumar R.; Dongale, Tukaram D.; Kamat, Rajanish K.; Rajpure, Keshav Y.","Spray deposited zinc tungstate thin film for non-volatile memory application","Materials Letters","2022","322","","132494","","10.1016/j.matlet.2022.132494","","","","","","","","","","","","","","","","","","","","","has coordinates","276525","2022-07-04","08:51:07",""
"1567393","34.6729","0.0018","5.8345","0.0003","19.159","0.001","90","","106.03","0.002","90","","3725.1","0.3","150","2","150","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C20 H24 Fe O6 -","- C20 H24 Fe O6 -","- C160 H192 Fe8 O48 -","8","2","","Oberle, Kjersti G.; Whitman, Elizabeth L.; Jolly, Charles S.; Webster, Katherine A.; Marx, Benjamin S.; Howard, Christopher M.; Hanger, Clara A.; Ramey, Erin E.; Zou, Yutong; Lowe, Jared C.; Turlington, Mark; Turlington, Christopher R.","Metallopolymers in minutes via organocatalysis at room temperature","Polymer Chemistry","2022","13","33","4747","4751","10.1039/D2PY00747A","","","0.71073","MoKα","","0.0445","0.0417","","","0.093","0.0941","","","","","","1.132","","","","has coordinates,has disorder","277681","2022-09-06","10:20:04",""
"1567535","9.7337","0.001","6.0539","0.0006","21.73","0.002","90","","101.532","0.003","90","","1254.6","0.2","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C28 H26 N4 O2 Zn -","- C28 H26 N4 O2 Zn -","- C56 H52 N8 O4 Zn2 -","2","0.5","","D'Aniello, Sara; Laviéville, Sidonie; Santulli, Federica; Simon, Malaury; Sellitto, Michele; Tedesco, Consiglia; Thomas, Christophe M.; Mazzeo, Mina","Homoleptic phenoxy-imine pyridine zinc complexes: efficient catalysts for solvent free synthesis and chemical degradation of polyesters","Catalysis Science & Technology","2022","12","20","6142","6154","10.1039/D2CY01092E","","","1.54178","CuKα","","0.0416","0.0388","","","0.1045","0.1071","","","","","","1.089","","","","has coordinates","278958","2022-11-07","05:03:52",""
"1567569","23.6848","0.0008","12.0981","0.0005","27.9247","0.0011","90","","113.046","0.001","90","","7363","0.5","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C75 H107 F6 N4 O4 Sb U -","- C75 H107 F6 N4 O4 Sb U -","- C300 H428 F24 N16 O16 Sb4 U4 -","4","1","","Löffler, Sascha T.; Hümmer, Julian; Scheurer, Andreas; Heinemann, Frank W.; Meyer, Karsten","Unprecedented pairs of uranium (iv/v) hydroxido and (iv/v/vi) oxido complexes supported by a seven-coordinate cyclen-anchored tris-aryloxide ligand","Chemical Science","2022","","","","","10.1039/D2SC02736D","","","0.71073","MoKα","","0.0521","0.0351","","","0.0657","0.0717","","","","","","1.089","","","","has coordinates,has disorder","277604","2022-09-02","22:17:09",""
"1567571","23.6833","0.0013","12.0691","0.0006","27.9262","0.0013","90","","113.169","0.002","90","","7338.5","0.7","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C75 H106 F6 N4 O4 Sb U -","- C75 H106 F6 N4 O4 Sb U -","- C300 H424 F24 N16 O16 Sb4 U4 -","4","1","","Löffler, Sascha T.; Hümmer, Julian; Scheurer, Andreas; Heinemann, Frank W.; Meyer, Karsten","Unprecedented pairs of uranium (iv/v) hydroxido and (iv/v/vi) oxido complexes supported by a seven-coordinate cyclen-anchored tris-aryloxide ligand","Chemical Science","2022","","","","","10.1039/D2SC02736D","","","0.71073","MoKα","","0.0525","0.039","","","0.0761","0.0802","","","","","","1.103","","","","has coordinates,has disorder","277604","2022-09-02","22:17:09",""
"1567904","16.9178","0.0013","13.6023","0.001","12.8848","0.001","90","","108.53","0.003","90","","2811.3","0.4","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C12 H40 F18 Fe4 N6 O2 -","- C12 H36 F18 Fe4 N6 O2 -","- C48 H144 F72 Fe16 N24 O8 -","4","1","","Li, Teng; Lightfoot, Philip","Layered Hybrid iron Fluorides","Crystals","2022","12","10","1443","","10.3390/cryst12101443","","","0.71075","MoKα","","0.0524","0.0331","","","0.0843","0.0913","","","","","","1.006","","","","has coordinates,has disorder","279032","2022-11-07","14:55:37",""
"1568141","20.388","0.004","7.7841","0.0016","15.311","0.003","90","","110.9","0.03","90","","2270","0.9","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Cu11.4 Na9.74 O2 S10 -","- Cu11.402 Na9.744 O2 S10 -","- Cu45.608 Na38.976 O8 S40 -","4","1","","Zhou, Xiuquan; Kolluru, Venkata Surya Chaitanya; Xu, Wenqian; Wang, Luqing; Chang, Tieyan; Chen, Yu-Sheng; Yu, Lei; Wen, Jianguo; Chan, Maria K. Y.; Chung, Duck Young; Kanatzidis, Mercouri G.","Discovery of chalcogenides structures and compositions using mixed fluxes","Nature","2022","612","7938","72","77","10.1038/s41586-022-05307-7","","","0.71073","MoKα","","0.145","0.0317","","","0.071","0.1091","","","","","","0.507","","","","has coordinates","279967","2022-12-21","13:06:11",""
"1568419","14.5261","0.0017","4.3104","0.0005","20.361","0.002","90","","102.088","0.005","90","","1246.6","0.2","300.91","","300.91","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C13 H10 Cl2 N2 O -","- C13 H10 Cl2 N2 O -","- C52 H40 Cl8 N8 O4 -","4","1","","Bhattacharya, Biswajit; Michalchuk, Adam A. L.; Silbernagl, Dorothee; Yasuda, Nobuhiro; Feiler, Torvid; Sturm, Heinz; Emmerling, Franziska","An atomistic mechanism for elasto-plastic bending in molecular crystals.","Chemical science","2023","14","13","3441","3450","10.1039/d2sc06470g","","","0.71073","MoKα","","0.0605","0.0392","","","0.1197","0.1443","","","","","","1.02","","","","has coordinates","282286","2023-04-04","09:55:56",""
"1568420","14.3805","0.0011","4.2807","0.0003","20.0178","0.0016","90","","101.319","0.003","90","","1208.3","0.16","100.91","","100.91","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C13 H10 Cl2 N2 O -","- C13 H10 Cl2 N2 O -","- C52 H40 Cl8 N8 O4 -","4","1","","Bhattacharya, Biswajit; Michalchuk, Adam A. L.; Silbernagl, Dorothee; Yasuda, Nobuhiro; Feiler, Torvid; Sturm, Heinz; Emmerling, Franziska","An atomistic mechanism for elasto-plastic bending in molecular crystals.","Chemical science","2023","14","13","3441","3450","10.1039/d2sc06470g","","","0.71073","MoKα","","0.056","0.0512","","","0.1339","0.147","","","","","","1.112","","","","has coordinates","282286","2023-04-04","09:56:07",""
"1568602","16.206","0.003","11.501","0.004","22.561","0.003","90","","107.876","0.006","90","","4002","1.7","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C34.5 H26.5 Mn2 N3.5 O9.5 S4 -","- C34.5 H26.5 Mn2 N3.5 O9.5 S4 -","- C138 H106 Mn8 N14 O38 S16 -","4","1","","Dubskikh, Vadim A.; Kolosov, Aleksei A.; Lysova, Anna A.; Samsonenko, Denis G.; Lavrov, Alexander N.; Kovalenko, Konstantin A.; Dybtsev, Danil N.; Fedin, Vladimir P.","A Series of Metal–Organic Frameworks with 2,2′-Bipyridyl Derivatives: Synthesis vs. Structure Relationships, Adsorption, and Magnetic Studies","Molecules","2023","28","5","2139","","10.3390/molecules28052139","","","0.79313","synchrotron","","0.0568","0.0516","","","0.1493","0.1533","","","","","","1.028","","","","has coordinates,has disorder","281639","2023-03-05","23:20:53",""
"1568699","9.457","0.003","11.427","0.003","7.298","0.002","90","","107.987","0.006","90","","750.1","0.4","295","","295","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","CPHTZ","5-(4-chlorophenyl)-1H-tetrazole","","- C7 H5 Cl N4 -","- C7 H5 Cl N4 -","- C28 H20 Cl4 N16 -","4","1","","Horiuchi, Sachio; Minemawari, Hiromi; Ishibashi, Shoji","Competition of polar and antipolar states hidden behind a variety of polarization switching modes in hydrogen-bonded molecular chains.","Materials horizons","2023","10","6","2149","2159","10.1039/d2mh01530g","","","0.71075","MoKα","","0.0447","0.0399","","","0.1119","0.1168","","","","","","1.074","","","","has coordinates","284983","2023-07-05","11:06:14",""
"1568792","4.93312","","5.7245","","4.95368","","90","","90.0857","","90","","139.89","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","light wolframite","","","- Fe O4 W -","- Fe O4 W -","- Fe2 O8 W2 -","2","0.5","","Patil, Amitkumar R.; Dongale, Tukaram D.; Namade, Lahu D.; Mohite, Santosh V.; Kim, Y.; Sutar,Santosh S.; Kamat, Rajanish K.; Rajpure, Keshav Y.","Sprayed FeWO4 thin film-based memristive device with negative differential resistance effect for non-volatile memory and synaptic learning applications","Journal of Colloid and Interface Science","2023","642","","540","","10.1016/j.jcis.2023.03.189","","","","","","","","","","","","","","","","","","","","","has coordinates","282391","2023-04-05","08:37:11",""
"1569163","23.3077","0.0017","25.5036","0.0018","22.5731","0.0017","90","","106.17","0.003","90","","12887.3","1.6","133","2","133","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C60 H72 Co F20 N6 O4 -","- C60 H72 Co F20 N6 O4 -","- C480 H576 Co8 F160 N48 O32 -","8","2","","Gupta, Sandeep K.; Rao, Shashank V.; Demeshko, Serhiy; Dechert, Sebastian; Bill, Eckhard; Atanasov, Mihail; Neese, Frank; Meyer, Franc","Air-stable four-coordinate cobalt(ii) single-ion magnets: experimental and <i>ab initio</i> ligand field analyses of correlations between dihedral angles and magnetic anisotropy.","Chemical science","2023","14","23","6355","6374","10.1039/d3sc00813d","","","0.71073","MoKα","","0.1696","0.0866","","","0.1888","0.2317","","","","","","1.038","","","","has coordinates,has disorder","284910","2023-07-05","09:55:30",""
"1569410","8.0781","0.001","4.793","0.0006","18.345","0.002","90","","90.223","0.008","90","","710.28","0.15","296","2","296","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Leucopterin hemihydrate","","- C12 H12 N10 O7 -","- C12 H12 N10 O7 -","- C24 H24 N20 O14 -","2","0.5","LT5058","Bravetti, Federica; Tapmeyer, Lukas; Skorodumov, Kathrin; Alig, Edith; Habermehl, Stefan; Hühn, Robert; Bordignon, Simone; Gallo, Angelo; Nervi, Carlo; Chierotti, Michele R.; Schmidt, Martin U.","Leucopterin, the white pigment in butterfly wings: structural analysis by PDF fit, FIDEL fit, Rietveld refinement, solid-state NMR and DFT-D.","IUCrJ","2023","10","4","448","463","10.1107/S2052252523004281","","","1.54178","CuKα","","0.1461","0.1413","","","0.4417","0.4451","","","","","","2.411","","","","has coordinates","284769","2023-07-04","01:53:56",""
"1569411","8.10257","0.0004","4.83656","0.00029","17.8289","0.0014","90","","88.531","0.0042","90","","698.46","0.08","296","2","296","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Leucopterin (variable hydrate) Remark: According to Rietveld refinement, the structure contains a partially occupied H2O molecule, which is represented by a single oxygen atom O1W. Its occupancy value Occ(O1W) = 0.421(8) corresponds to 0.17 H2O per leucopterin molecule. But this value is very uncertain (Powder data of limited quality). Hence, the water content of this structure should be regarded as being between 0 and 0.2 molecules of water per leucopterin molecule. The crystal structure and the tautomeric state were confirmed by DFT-D and SSNMR.","","","- C6 H5.34 N5 O3.17 -","- C6 H5 N5 O3.2106 -","- C24 H20 N20 O12.8424 -","4","1","LT5058","Bravetti, Federica; Tapmeyer, Lukas; Skorodumov, Kathrin; Alig, Edith; Habermehl, Stefan; Hühn, Robert; Bordignon, Simone; Gallo, Angelo; Nervi, Carlo; Chierotti, Michele R.; Schmidt, Martin U.","Leucopterin, the white pigment in butterfly wings: structural analysis by PDF fit, FIDEL fit, Rietveld refinement, solid-state NMR and DFT-D.","IUCrJ","2023","10","4","448","463","10.1107/S2052252523004281","powder diffraction","","1.54056","CuKα~1~","","0.01192","","","","","","","","1.591","","","","","","","has coordinates","287932","2023-12-01","13:55:15",""
"1569754","14.77","0.003","19.188","0.004","25.019","0.005","90","","106.906","0.003","90","","6784","2","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C132 H202 Cs2 O25 Si4 -","- C128 H194 Cs2 O24 Si4 -","- C256 H388 Cs4 O48 Si8 -","2","0.5","","Lirette, Frédéric; Darvish, Ali; Zhou, Zheng; Wei, Zheng; Renn, Lukas; Petrukhina, Marina A.; Weitz, R. Thomas; Morin, Jean-François","Dibenzannulated <i>peri</i>-acenoacenes from anthanthrene derivatives.","Chemical science","2023","14","37","10184","10193","10.1039/d3sc02898d","","x-ray","0.49594","synchrotron","","0.1778","0.1172","","","0.3336","0.3795","","","","","","1.278","","","","has coordinates,has disorder","286697","2023-10-05","23:43:34",""
"1569900","14.1895","0.001","14.8309","0.0009","22.402","0.0015","90","","92.676","0.006","90","","4709.2","0.5","113.15","","113.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C50 H48 N8 O14 Zn -","- C50 H48 N8 O14 Zn -","- C200 H192 N32 O56 Zn4 -","4","1","","Guan, Lei; Wang, Ying; Jin, Hongzhe; Yin, Pengpeng","A new route for the syntheses of coordination polymers using magnetic influence: syntheses, crystal structures and fluorescence properties.","IUCrJ","2023","10","6","","","10.1107/S2052252523007650","","x-ray","0.71073","MoKα","","0.1433","0.0647","","","0.1039","0.1312","","","","","","1.002","","","","has coordinates","286397","2023-09-19","01:48:01",""
"1570070","7.8066","0.0001","9.8765","0.0002","16.3671","0.0003","90","","92.361","0.001","90","","1260.86","0.04","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C30 H18 F2 N2 O4 Zn -","- C30 H18 F2 N2 O4 Zn -","- C60 H36 F4 N4 O8 Zn2 -","2","0.5","","Jena, Rohan; Laha, Subhajit; Dwarkanath, Nimish; Hazra, Arpan; Haldar, Ritesh; Balasubramanian, Sundaram; Maji, Tapas Kumar","Noncovalent interaction guided selectivity of haloaromatic isomers in a flexible porous coordination polymer.","Chemical science","2023","14","43","12321","12330","10.1039/d3sc03079b","","","0.71073","MoKα","","0.0302","0.028","","","0.0786","0.0799","","","","","","1.073","","","","has coordinates","288080","2023-12-06","14:30:18",""
"1570071","7.8873","0.0003","9.9771","0.0004","16.0181","0.0007","90","","93.433","0.002","90","","1258.24","0.09","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C30 H18 F2 N2 O4 Zn -","- C30 H18 F2 N2 O4 Zn -","- C60 H36 F4 N4 O8 Zn2 -","2","0.5","","Jena, Rohan; Laha, Subhajit; Dwarkanath, Nimish; Hazra, Arpan; Haldar, Ritesh; Balasubramanian, Sundaram; Maji, Tapas Kumar","Noncovalent interaction guided selectivity of haloaromatic isomers in a flexible porous coordination polymer.","Chemical science","2023","14","43","12321","12330","10.1039/d3sc03079b","","","0.71073","MoKα","","0.104","0.0461","","","0.0961","0.1133","","","","","","1.012","","","","has coordinates","288080","2023-12-06","14:30:18",""
"1570073","7.621","0.0001","9.8308","0.0002","17.4204","0.0004","90","","91.107","0.001","90","","1304.9","0.04","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C30 H18 Br2 N2 O4 Zn -","- C30 H18 Br2 N2 O4 Zn -","- C60 H36 Br4 N4 O8 Zn2 -","2","0.5","","Jena, Rohan; Laha, Subhajit; Dwarkanath, Nimish; Hazra, Arpan; Haldar, Ritesh; Balasubramanian, Sundaram; Maji, Tapas Kumar","Noncovalent interaction guided selectivity of haloaromatic isomers in a flexible porous coordination polymer.","Chemical science","2023","14","43","12321","12330","10.1039/d3sc03079b","","","0.71073","MoKα","","0.0665","0.0507","","","0.1234","0.1323","","","","","","1.05","","","","has coordinates","288080","2023-12-06","14:30:18",""
"1570074","7.6348","0.0001","9.8825","0.0002","17.0598","0.0004","90","","90.083","0.001","90","","1287.18","0.04","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C30 H18 Cl2 N2 O4 Zn -","- C30 H18 Cl2 N2 O4 Zn -","- C60 H36 Cl4 N4 O8 Zn2 -","2","0.5","","Jena, Rohan; Laha, Subhajit; Dwarkanath, Nimish; Hazra, Arpan; Haldar, Ritesh; Balasubramanian, Sundaram; Maji, Tapas Kumar","Noncovalent interaction guided selectivity of haloaromatic isomers in a flexible porous coordination polymer.","Chemical science","2023","14","43","12321","12330","10.1039/d3sc03079b","","","0.71073","MoKα","","0.0426","0.0349","","","0.0975","0.1029","","","","","","1.048","","","","has coordinates","288080","2023-12-06","14:30:18",""
"1570076","7.5498","0.0003","9.7529","0.0003","17.1831","0.0006","90","","91.296","0.001","90","","1264.91","0.08","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C30 H18 Cl2 N2 O4 Zn -","- C30 H18 Cl2 N2 O4 Zn -","- C60 H36 Cl4 N4 O8 Zn2 -","2","0.5","","Jena, Rohan; Laha, Subhajit; Dwarkanath, Nimish; Hazra, Arpan; Haldar, Ritesh; Balasubramanian, Sundaram; Maji, Tapas Kumar","Noncovalent interaction guided selectivity of haloaromatic isomers in a flexible porous coordination polymer.","Chemical science","2023","14","43","12321","12330","10.1039/d3sc03079b","","","0.71073","MoKα","","0.1778","0.0534","","","0.0872","0.1093","","","","","","0.986","","","","has coordinates","288080","2023-12-06","14:30:18",""
"1570078","7.5558","0.0002","9.7064","0.0002","17.3881","0.0004","90","","92.212","0.001","90","","1274.29","0.05","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C30 H18 Br2 N2 O4 Zn -","- C30 H18 Br2 N2 O4 Zn -","- C60 H36 Br4 N4 O8 Zn2 -","2","0.5","","Jena, Rohan; Laha, Subhajit; Dwarkanath, Nimish; Hazra, Arpan; Haldar, Ritesh; Balasubramanian, Sundaram; Maji, Tapas Kumar","Noncovalent interaction guided selectivity of haloaromatic isomers in a flexible porous coordination polymer.","Chemical science","2023","14","43","12321","12330","10.1039/d3sc03079b","","","0.71073","MoKα","","0.0588","0.0441","","","0.1172","0.1435","","","","","","1.113","","","","has coordinates","288080","2023-12-06","14:30:18",""
"1570313","17.954","0.004","9.494","0.002","26.01","0.005","90","0.03","102.93","0.03","90","0.03","4321.1","1.6","150","2","150","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C38 H46 Cl3 F3 Ge O3 P2 S -","- C38 H46 Cl3 F3 Ge O3 P2 S -","- C152 H184 Cl12 F12 Ge4 O12 P8 S4 -","4","1","","Peddi, Balakrishna; Khan, Souvik; Gonnade, Rajesh G.; Yildiz, Cem B.; Majumdar, Moumita","Intramolecular donor-stabilized tetra-coordinated germanium(iv) di-cations and their Lewis acidic properties.","Chemical science","2023","14","47","13755","13764","10.1039/d3sc03717g","","","0.71073","MoKα","","0.0911","0.0484","","","0.1052","0.1234","","","","","","1.025","","","","has coordinates","288746","2024-01-06","07:23:56",""
"1570315","17.3764","0.0016","9.2749","0.0009","25.485","0.002","90","","103.688","0.003","90","","3990.6","0.6","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C41 H52 F4 Ge O4 P2 S -","- C41 H52 F4 Ge O4 P2 S -","- C164 H208 F16 Ge4 O16 P8 S4 -","4","1","","Peddi, Balakrishna; Khan, Souvik; Gonnade, Rajesh G.; Yildiz, Cem B.; Majumdar, Moumita","Intramolecular donor-stabilized tetra-coordinated germanium(iv) di-cations and their Lewis acidic properties.","Chemical science","2023","14","47","13755","13764","10.1039/d3sc03717g","","","1.54178","CuKα","","0.0437","0.0307","","","0.0767","0.0789","","","","","","1.05","","","","has coordinates","288746","2024-01-06","07:23:56",""
"1570417","22.8294","0.0003","9.4458","0.0001","31.1842","0.0005","90","","90.301","0.002","90","","6724.53","0.16","173","0.1","173","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C73 H57 Cl3 F14 N6 O4 -","- C73 H57 Cl3 F14 N6 O4 -","- C292 H228 Cl12 F56 N24 O16 -","4","1","","Cheng, Qiuhong; Hao, Aiyou; Xing, Pengyao","Selective chiral dimerization and folding driven by arene-perfluoroarene force.","Chemical science","2024","15","2","618","628","10.1039/d3sc05212e","","x-ray","1.54184","CuKα","","0.1445","0.1282","","","0.3922","0.4079","","","","","","1.708","","","","has coordinates","289414","2024-02-04","11:31:13",""
"1570701","20.652","0.0017","4.902","0.0014","21.645","0.0014","90","","109.11","0.011","90","","2070.5","0.6","100","2","100","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C34 H19 B -","- C34 H19 B -","- C136 H76 B4 -","4","1","","Schnitzlein, Matthias; Shoyama, Kazutaka; Würthner, Frank","A highly fluorescent bora[6]helicene exhibiting circularly polarized light emission.","Chemical science","2024","15","8","2984","2989","10.1039/d3sc05171d","","","0.61992","synchrotron","","0.0794","0.0738","","","0.2748","0.2818","","","","","","1.164","","","","has coordinates","290114","2024-03-04","19:59:06",""
"1570834","7.6542","0.0002","8.5911","0.0003","16.6247","0.0005","90","","94.622","0.003","90","","1089.65","0.06","100.01","0.1","100.01","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C6 H12 Cd Cl3 N3 -","- C6 H12 Cd Cl3 N3 -","- C24 H48 Cd4 Cl12 N12 -","4","1","","Xiao, Guowei; Ma, Yu-Juan; Qi, Zhenhong; Fang, Xiaoyu; Chen, Tianhong; Yan, Dongpeng","A flexible ligand and halogen engineering enable one phosphor-based full-color persistent luminescence in hybrid perovskitoids.","Chemical science","2024","15","10","3625","3632","10.1039/d3sc06845e","","","1.54178","CuKα","","0.0497","0.0494","","","0.1297","0.1299","","","","","","1.024","","","","has coordinates","290841","2024-04-04","22:46:36",""
"1570835","7.9948","0.0001","8.6736","0.0001","16.9504","0.0003","90","","95.696","0.002","90","","1169.6","0.03","100","0.1","100","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C6 H12 Br3 Cd N3 O0 -","- C6 H12 Br3 Cd N3 -","- C24 H48 Br12 Cd4 N12 -","4","1","","Xiao, Guowei; Ma, Yu-Juan; Qi, Zhenhong; Fang, Xiaoyu; Chen, Tianhong; Yan, Dongpeng","A flexible ligand and halogen engineering enable one phosphor-based full-color persistent luminescence in hybrid perovskitoids.","Chemical science","2024","15","10","3625","3632","10.1039/d3sc06845e","","","1.54178","CuKα","","0.055","0.054","","","0.1596","0.161","","","","","","1.041","","","","has coordinates","290841","2024-04-04","22:46:36",""
"1570843","6.774","0.002","13.257","0.004","20.637","0.006","90","","97.183","0.008","90","","1838.7","0.9","300","2","300","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C24 H15 N3 O3 -","- C24 H15 N3 O3 -","- C96 H60 N12 O12 -","4","1","","Pandit, Sulekha Kumari KUMARI; Das, Sanjana; Das, Gopal","Self-assembled Emissive Probe for Efficient Sensing of Fe(III) and Cysteine in the Physiological Medium: Application in Real Water and Food Sample","Sensors & Diagnostics","2024","","","","","10.1039/D3SD00306J","","","0.71073","MoKα","","0.2365","0.1464","","","0.4017","0.4682","","","","","","1.51","","","","has coordinates","289228","2024-01-31","02:47:59",""
"1570917","20.3737","0.0006","12.9319","0.0003","20.6857","0.0006","90","","106.129","0.001","90","","5235.6","0.2","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C45.5 H25 Al Eu F18 N3 O12 -","- C46.5 H25 Al Eu F18 N3 O12 -","- C186 H100 Al4 Eu4 F72 N12 O48 -","4","1","","Gallo, Elisa; Bellucci, Luca; Carlotto, Silvia; Bottaro, Gregorio; Babetto, Luca; Giordano, Luca; Marchetti, Fabio; Samaritani, Simona; Armelao, Lidia; Labella, Luca","Aluminium 8-Hydroxyquinolinate <i>N</i>-Oxide as a Precursor to Heterometallic Aluminium-Lanthanide Complexes.","Molecules (Basel, Switzerland)","2024","29","2","451","","10.3390/molecules29020451","","","0.71073","MoKα","","0.0791","0.0512","","","0.129","0.145","","","","","","1.054","","","","has coordinates,has disorder","289671","2024-02-05","05:10:30",""
"1571439","11.6463","0.0003","6.9742","0.0002","26.5047","0.0008","90","","95.4","0.001","90","","2143.25","0.1","150","2","150","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","4","","- C22 H23 B11 -","- C22 H23 B11 -","- C88 H92 B44 -","4","1","","","","","","","","","","10.1039/D4SC00990H","","","0.71073","MoKα","","0.072","0.0541","","","0.1269","0.148","","","","","","1.07","","","","has coordinates","291233","2024-04-16","22:22:01",""
"1571591","4.7537","","5.7244","","4.9738","","90","","90.0801","","90","","135.347","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","light wolframite","","","- Fe O4 W -","- Fe0.5 O4 W0.5 -","- Fe O8 W -","2","0.5","","Patil, Amitkumar R.; Dongale, Tukaram D.; Pedanekar, Rupesh S.; Sutar,Santosh S.; Kamat, Rajanish K.; Rajpure, Keshav Y.","Multilevel resistive switching in hydrothermally synthesized FeWO4 thin film-based memristive device for non-volatile memory application","Journal of Colloid and Interface Science","2024","669","","444","","10.1016/j.jcis.2024.04.222","","","","","","","","","","","","","","","","","","","","","has coordinates","291791","2024-05-09","05:04:28",""
"2000730","8.293","0.001","6.703","0.001","33.02","0.008","90","","91.87","0.02","90","","1834.5","0.6","293","","293","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","ζ-di[3,4;3',4'-bis(ethylenedithio)-2,2',5,5'-tetrathiafulvalenium] hexafluorophosphate","","- C24 H24 F6 O P S16 -","- C24 H24 F6 O2 P S16 -","- C48 H48 F12 O4 P2 S32 -","2","0.5","CR1003","Bu, X.; Cisarova, I.; Coppens, P.","Structure of ζ-(BEDT-TTF)~2~PF~6~.C~4~H~8~O~2~","Acta Crystallographica Section C","1992","48","8","1563","1565","10.1107/S0108270192005286","","","0.71073","MoKα","","","0.119","","","0.141","","","","","3.39","3.39","","","","","has coordinates","190435","2020-10-21","18:00:00",""
"2001148","13.033","0.001","22.608","0.003","16.703","0.001","90","","90.76","0.01","90","","4921.1","0.8","298","2","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C60 H68 Cu2 N2 O8 -","- C27 H31 Cu N O4 -","- C108 H124 Cu4 N4 O16 -","4","1","AS1036","Fujita, T.; Ohba, S.; Nagamatsu, M.; Tokii, T.; Jury, C. F.; Steward, O. W.; Kato, M.","Dimeric copper(II) 2-methyl-2-phenylpropanoate adducts with water or 2,6-lutidine and a monomeric copper(II) triphenylacetate adduct with 2,6-lutidine","Acta Crystallographica Section C","1993","49","12","2095","2100","10.1107/S0108270193005359","","","0.71073","MoKα","","","0.047","","","0.041","","","","","1.57","1.57","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2001453","26.119","0.009","4.989","0.002","11.91","0.007","90","","106.29","0.04","90","","1489.7","1.2","293","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H12 Cl2 O6 Zn -","- C7 H6 Cl O3 Zn0.5 -","- C28 H24 Cl4 O12 Zn2 -","4","1","KA1020","Potočňák, I.; Dunaj-Jurčo, M.; Černák, J.","Structure of diaquabis(4-chlorobenzoato)zinc(II)","Acta Crystallographica Section C","1993","49","8","1496","1498","10.1107/S0108270193001398","","","0.71069","MoKα","","","0.04","","","0.0409","","","","","0.363","0.363","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2001454","24.375","0.009","9.791","0.006","16.127","0.006","90","","115.66","0.03","90","","3469","3","293","","","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C36 H30 Cl I2 O P2 Re -","- C18 H15 Cl0.5 I O0.5 P Re0.5 -","- C72 H60 Cl2 I4 O2 P4 Re2 -","4","1","CD1027","Rossi, S.; Bélanger, S.; Lebuis, A.-M.; Beauchamp, A. L.","Structure of (<i>OC</i>-6-14)-chlorodiiodooxobis(triphenylphosphine)rhenium(V)","Acta Crystallographica Section C","1993","49","8","1498","1500","10.1107/S0108270193001441","","","0.71069","MoKα","","","0.038","","","0.048","","","","","1.2","1.2","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2002079","8.455","0.003","13.052","0.002","9.267","0.003","90","","124.89","0.03","90","","838.8","0.9","294","","","","","","","","","","","1","P 1 2/c 1","","","","gamma sulfur","","- S8 -","- S8 -","- S32 -","4","1","AB1021","Gallacher, A. C.; Pinkerton, A. A.","A redetermination of monclinic γ-sulfur","Acta Crystallographica Section C","1993","49","1","125","126","10.1107/S0108270192009661","","","0.71073","Mo_Kα","","","0.036","","","0.041","","","","","1.222","1.222","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2002471","10.0101","0.0037","8.8454","0.0051","10.1899","0.0019","90","","91.032","0.017","90","","902.1","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Calcium copper divanadate","","- Ca Cu O7 V2 -","- Ca Cu O7 V2 -","- Ca6 Cu6 O42 V12 -","6","1.5","","Vogt, R; Mueller-Buschbaum, Hk","Der Uebergang von planaren zu tetraedrischen Cu O4-Baugruppen in Ca Cu V2 O7","Zeitschrift fuer Anorganische und Allgemeine Chemie","1991","594","","119","126","10.1002/zaac.19915940114","","","","","","0.052","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002821","13.345","0.004","5.711","0.002","15.859","0.004","90","","113.69","0.02","90","","1106.8","","","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Barium magnesium manganese divanadate chloride (5/0.4/1.6/2/6)","","- Ba5 Cl6 Mg0.4 Mn1.6 O14 V4 -","- Ba5 Cl6 Mg0.4 Mn1.6 O14 V4 -","- Ba10 Cl12 Mg0.8 Mn3.2 O28 V8 -","2","0.5","","Mueller-Buschbaum, Hk; Rettich, R","Isolierte MnCl6-Oktaeder im Oxohalogeno-Vanadat Ba5 (Mg0.4 Mn0.6) (V2 O7)2 Mn Cl6","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1997","52","","457","461","","","","","","","0.125","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002903","13.044","0.003","6.847","0.002","9.465","0.004","90","","98.46","0.03","90","","836.1","0.5","294","2","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C7 H13 N O2 -","- C7 H13 N O2 -","- C28 H52 N4 O8 -","4","1","","Larsen, Ingrid Kjoller; Trickey, Peter","Cyclohexanecarbohydroxamic Acid","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","1","125","127","10.1107/S0108270194008413","","","0.71073","MoKα","","","0.0546","","0.2005","0.1446","","","","0.94","0.97","0.97","","","","","has coordinates","200786","2020-10-21","18:00:00",""
"2003393","18.06","0.002","10.716","0.001","22.338","0.002","90","","112.89","0.02","90","","3982.7","0.9","295","","295","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","1,2-Bis-crown-5-calix [4] arene","","- C44 H52 O10 -","- C44 O10 -","- C176 O40 -","4","1","PA1099","Pèpe, G.; Astier, J.-P.; Estienne, J.; Bressot, C.; Asfari, Z.; Vicens, J.","1,2-Bis-crown-5-calix[4]arene","Acta Crystallographica Section C","1995","51","4","726","729","10.1107/S0108270194002994","","","1.5416","CuKα","","0.11","0.11","","0.11","0.11","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003931","24.096","0.005","10.692","0.002","20.188","0.004","90","","98.36","0.02","90","","5145.9","1.8","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","The tetraethylammonium salt of the Eu(dipic)3","tris(tetraethylammonium)tris(dipicolinato)europium(III) tetrahydrate","","- C45 H77 Eu N6 O16 -","- C45 H77 Eu N6 O16 -","- C180 H308 Eu4 N24 O64 -","4","1","NA1151","Brayshaw, P. A.; Harrowfield, J. M.; Sobolev, A. N.","A Strongly Luminescent Organic-Solvent-Soluble Salt of the Tris(dipicolinato)europium(III) Trianion","Acta Crystallographica Section C","1995","51","9","1799","1802","10.1107/S0108270195002897","","","0.71073","MoKα","","0.0673","0.0417","","0.0975","0.086","","","","1.064","1.108","1.108","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2004505","18.262","0.004","12.956","0.007","26.52","0.02","90","","90.4","0.03","90","","6275","6","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C10 H6 Ca O6 -","- C10 H6 Ca O6 -","- C240 H144 Ca24 O144 -","24","6","JZ1058","Paluchowska, B.; Maurin, J. K.; Leciejewicz, J.","Carboxylate and Furan-Ring Oxygen Bonded to Calcium in Polymeric Calcium Furoate","Acta Crystallographica Section C","1996","52","2","347","351","10.1107/S0108270195009553","","","1.54183","CuKα","","0.2021","0.0548","","0.1483","0.1156","","","","0.93","1.175","1.175","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004725","19.403","0.005","6.555","0.001","19.512","0.006","90","","97.38","0.02","90","","2461.1","1.1","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","triaquabis(O,O'-hydrogenoxalate) (O,O'-oxalate)(μ^3^-sulfide)tris(μ^2^-sulfide)trimolybdenum(IV)","","- C10 H20 Mo3 O17 S4 -","- C10 H4 Mo3 O17 S4 -","- C40 H16 Mo12 O68 S16 -","4","1","FG1088","Cotton, F. A.; Daniels, L. M.; Shang, M.; Llusar, R.; Schwotzer, W.","A Trinuclear Cluster of Molybdenum(IV), Mo~3~(μ~3~-S)(μ~2~-S)~3~(HC~2~O~4~)~2~(C~2~O~4~)(H~2~O)~3~","Acta Crystallographica Section C","1996","52","4","835","838","10.1107/S0108270195013928","","","0.71073","MoKα","","0.1637","0.0514","","0.1027","0.0931","","","","0.825","1.096","1.096","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004910","9.431","0.002","11.27","0.002","15.781","0.003","90","","91.13","0.03","90","","1677","0.6","193","2","193","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","Dichlorophenyl imino Zirconium dimer THF adduct","Zr,Zr,Zr',Zr'-TetrachloroDi(μ-Phenyl-imino)Zr,Zr,Zr',Zr'- Tetrakis(Tetrahydrofurane)DiZirconium(IV)","","- C28 H42 Cl4 N2 O4 Zr2 -","- C28 H42 Cl4 N2 O4 Zr2 -","- C56 H84 Cl8 N4 O8 Zr4 -","2","0.5","MU1234","Polamo, M.; Mutikainen, I.; Leskelä, M.","A 1:4 Adduct of Tetrachlorobis(μ-phenylimido)dizirconium(IV) and Tetrahydrofuran","Acta Crystallographica Section C","1996","52","5","1082","1084","10.1107/S0108270195016891","","","0.71069","MoKα","","0.0408","0.0362","","0.0896","0.0871","","","","1.037","1.064","1.064","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005568","8.807","0.003","11.447","0.003","10.644","0.003","90","","98.54","0.03","90","","1061.2","0.6","291","","291","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C10 H14 F6 -","- C10 H14 F6 -","- C20 H28 F12 -","2","0.5","BK1152","Swenson, D. C.; Davis, C. R.; Burton, D. J.","Three 1,4-<i>trans</i>-Substituted Cyclohexanes","Acta Crystallographica Section C","1996","52","11","2844","2847","10.1107/S0108270196008104","","","0.71073","MoKα","","","0.038","","","0.049","","","","","1.088","1.088","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005979","11.715","0.004","5.8","0.002","24.694","0.009","90","","102.1","0.03","90","","1640.6","1","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Lead - dodecabismuth - pentamolybdenum - oxide","","- Bi12 Mo5 O34 Pb -","- Bi12 Mo5 O34 Pb -","- Bi24 Mo10 O68 Pb2 -","2","0.5","BR1164","Enjalbert, R.; Hasselmann, G.; Galy, J.","A New Mixed Oxide with (Bi~12~O~14~)~<i>n~</i> Columns: PbBi~12~Mo~5~O~34~","Acta Crystallographica Section C","1997","53","3","269","272","10.1107/S0108270196013698","","","0.71069","MoKα","","0.0673","0.0643","","0.1675","0.164","","","","0.904","0.9","0.9","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006324","11.52","0.001","4.7","0.001","12.04","0.001","90","","95.44","0.01","90","","648.96","0.16","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C13 H24 N2 O -","- C13 H24 N2 O -","- C26 H48 N4 O2 -","2","0.5","NA1270","Govindasamy, L.; Subramanian, E.","<i>N</i>,<i>N</i>'-Dicyclohexylurea","Acta Crystallographica Section C","1997","53","7","927","928","10.1107/S0108270197003399","","","1.5418","CuKα","","0.123","0.0646","","0.1807","0.161","","","","0.93","1.127","1.127","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006472","13.847","0.003","9.232","0.002","14.681","0.003","90","","108.57","0.03","90","","1779","0.7","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","bis(triphenylphosphinesulfide-S)gold(I) difluorophosphate(V)","","- C36 H30 Au F2 O2 P3 S2 -","- C36 H30 Au F2.024 O2.024 P3 S2 -","- C72 H60 Au2 F4.048 O4.048 P6 S4 -","2","0.5","FG1269","LeBlanc, Daren J.; Britten, James F.; Lock, Colin J.L.","Bis(triphenylphosphine sulfide-<i>S</i>)gold(I) Difluorophosphate(V)","Acta Crystallographica Section C","1997","53","9","1204","1206","10.1107/S0108270197005209","","","0.56086","AgKα","","0.0728","0.0496","","0.1164","0.1095","","","","0.912","1.025","1.025","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007663","9.92","0.002","10.631","0.002","19.413","0.004","90","","92.35","0.03","90","","2045.6","0.7","193","2","193","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","Octakis(dimethylsulfoxide-O)gadolinium(III) hexacyanoferrate(III)","","","- C22 H48 Fe Gd N6 O8 S8 -","- C22 H48 Fe Gd N6 O8 S8 -","- C44 H96 Fe2 Gd2 N12 O16 S16 -","2","0.5","OS1014","Martti Klinga; Rafael Cuesta; José María Moreno; José Manuel Dominguez-Vera; Enrique Colacio; Raikko Kivekäs","Octakis(dimethyl sulfoxide-<i>O</i>)gadolinium(III) Hexacyanoferrate(III)","Acta Crystallographica Section C","1998","54","9","1275","1277","10.1107/S0108270198004545","","","0.71073","MoKα","","0.065","0.052","","0.121","0.116","","","","1.169","1.213","1.213","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007829","9.0498","0.0002","5.2275","0.0001","25.0771","0.0002","90","","97.71","","90","","1175.62","0.04","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","o-Phenylenediamine and Pyrocatechol (1:1) monohydrate complex","","- C12 H15 N2 O2.5 -","- C12 H15 N2 O2.5 -","- C48 H60 N8 O10 -","4","1","HA1221","Shyamaprosad Goswami; Reshmi Mukherjee; Gur Dayal Nigam; Kandasamy Chinnakali; Hoong-Kun Fun","<i>o</i>-Phenylenediamine Pyrocatechol Hemihydrate Complex","Acta Crystallographica Section C","1998","54","11","1647","1649","10.1107/S0108270198006751","","","0.71073","MoKα","","0.0601","0.0411","","0.1066","0.0959","","","","1.057","1.113","1.113","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008227","15.181","0.009","5.0319","0.0008","20.76","0.004","90","","109.07","0.03","90","","1498.8","1","293","2","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","sodium vanadate","","- Na4.5 O17.5 V7 -","- Na4.5 O17.5 V7 -","- Na18 O70 V28 -","4","1","BR1224","Millet, Patrice; Henry, Jean-Yves; Galy, Jean","The vanadium oxide bronze η-Na~<i>x~</i>V~2~O~5~ (<i>x</i> = 1.286)","Acta Crystallographica Section C","1999","55","3","276","279","10.1107/S010827019801587X","","","0.71069","MoKα","","0.106","0.045","","0.127","0.112","","","","0.963","1.176","1.176","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009310","10.586","0.002","11.925","0.002","7.803","0.002","90","","105.64","0.03","90","","948.6","0.4","193","2","193","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Diaqua{hydrogen bis[1-(pyridin-2-yl)ethanone oximato-N,N']}nickel(II) perchlorate hydrate.","","- C14 H21 Cl N4 Ni O9 -","- C14 H21 Cl N4 Ni O9 -","- C28 H42 Cl2 N8 Ni2 O18 -","2","0.5","OS1079","Pajunen, Aarne; Orama, Marjatta; Saarinen, Heikki","Diaqua{hydrogen bis[1-(2-pyridyl)ethanone oximato-<i>N</i>,<i>N</i>']}nickel(II) perchlorate hydrate","Acta Crystallographica Section C","1999","55","12","2075","2077","10.1107/S010827019901166X","","","0.71073","MoKα","","0.03","0.03","","","","0.084","","","","","","1.115","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2009339","13.919","0.004","9.211","0.004","14.856","0.004","90","","107.7","0.02","90","","1814.5","1.1","296.2","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","[1,3-dithiol-4,5-(3,4,5,6-tetramethylthio)-benzo-2-ylidnene, dichloro-Copper(II)]","","- C11 H12 Cl2 Cu S7 -","- C11 H12 Cl2 Cu S7 -","- C44 H48 Cl8 Cu4 S28 -","4","1","QB0149","Dai, Jie; Bian, Guo-qing; Zhou, Min-Yan; Maekawa, Masahiko; Munakata, Megumu","Dichloro(3,4,5,6-tetramethylthio-1,3-benzodithiazole-2-thione-<i>S</i>^5^,<i>S</i>^6^)copper(II)","Acta Crystallographica Section C","1999","55","12","IUC9900166","","10.1107/S0108270199098364","","","0.7107","MoKα","","","0.05","","","","0.1281","","","","","","1.011","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2010541","10.031","0.003","8.2799","0.0017","10.968","0.002","90","","99.274","0.002","90","","899","0.4","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Ammonium hydrogen squarate‒water (3/2)","","- C4 H6.33 N O4.67 -","- C4 H6.33333 N O4.66667 -","- C24 H38 N6 O28 -","6","1.5","LN1082","Kolev, Tsonko; Glavcheva, Zornitza; Petrova, Rosica; Angelova, Olyana","Ammonium hydrogen squarate‒water (3/2)","Acta Crystallographica Section C","2000","56","1","110","112","10.1107/S0108270199009415","","","0.71073","MoKα","","0.089","0.053","","","","0.146","","","","","","1.009","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2010985","6.297","0.004","4.951","0.003","12.751","0.006","90","","91.65","0.06","90","","397.4","0.4","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Lithium Rubidium Gallium Borate","","","- B3 Ga2 Li2 O9 Rb -","- B3 Ga2 Li2 O9 Rb -","- B6 Ga4 Li4 O18 Rb2 -","2","0.5","BR1279","Judith L. Kissick; Douglas A. Keszler","RbLi~2~Ga~2~(BO~3~)~3~","Acta Crystallographica Section C","2000","56","6","631","632","10.1107/S0108270100004078","","","0.71069","MoKα","","0.0414","0.026","","","","0.0724","","","","","","1.05","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2011217","21.387","0.005","7.9328","0.001","15.184","0.003","90","","90.657","0.01","90","","2575.9","0.9","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Cerous sodium nitrate monohydrate","disodium cerium pentanitrate monohydrate","","- Ce N5 Na2 O16 -","- Ce N5 Na2 O16 -","- Ce8 N40 Na16 O128 -","8","2","GS1089","Audebrand, Nathalie; Louër, Daniel","Cerous sodium nitrate monohydrate, Na~2~Ce(NO~3~)~5~·H~2~O","Acta Crystallographica Section C","2000","56","8","913","915","10.1107/S0108270100006211","","","0.71073","MoKα","","0.088","0.026","","","","0.062","","","","","","1.032","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2012121","5.1456","0.0005","6.0794","0.0005","5.1291","0.0006","90","","108.859","0.008","90","","151.84","0.03","293","2","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Li3 O4 Sb -","- Li3 O4 Sb -","- Li6 O8 Sb2 -","2","0.5","BR1318","Bernès, Sylvain; Trujillo Tovar, Sonia; Castellanos R., María A.","A comparison of the X-ray single-crystal structure of Li~3~SbO~4~ with the Rietveld refinement","Acta Crystallographica Section C","2001","57","8","883","884","10.1107/S0108270101007569","","","0.71073","MoKα","","0.0163","0.0149","","","","0.0355","","","","","","1.043","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2012256","6.1401","0.0007","15.6358","0.0012","10.7154","0.0008","90","","106.934","0.008","90","","984.13","0.16","223","2","223","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","6-carboxy-5-carboxylatopyrazine-2,3-diyldi-2-pyridinium perchlorate trihydrate","","- C16 H17 Cl N4 O11 -","- C16 H17 Cl N4 O11 -","- C32 H34 Cl2 N8 O22 -","2","0.5","GD1159","Alfonso, Montserrat; Wang, Yi; Stoeckli-Evans, Helen","Hydrogen bonding in the inner-salt zwitterion and in two different charged forms of 5,6-bis(2-pyridyl)pyrazine-2,3-dicarboxylic acid","Acta Crystallographica Section C","2001","57","10","1184","1188","10.1107/S0108270101010757","","","0.71073","MoKα","","0.057","0.04","","","","0.115","","","","","","1.017","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2012257","6.191","0.0006","15.6564","0.0011","10.8349","0.001","90","","106.4","0.011","90","","1007.48","0.16","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","6-carboxy-5-carboxylatopyrazine-2,3-diyldi-2-pyridinium hexafluorophosphate trihydrate","","- C16 H17 F6 N4 O7 P -","- C16 H17 F6 N4 O7 P -","- C32 H34 F12 N8 O14 P2 -","2","0.5","GD1159","Alfonso, Montserrat; Wang, Yi; Stoeckli-Evans, Helen","Hydrogen bonding in the inner-salt zwitterion and in two different charged forms of 5,6-bis(2-pyridyl)pyrazine-2,3-dicarboxylic acid","Acta Crystallographica Section C","2001","57","10","1184","1188","10.1107/S0108270101010757","","","0.71073","MoKα","","0.05","0.044","","","","0.152","","","","","","1.197","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2012333","5.7971","0.0012","6.5933","0.0014","5.4179","0.0012","90","","109.394","0.004","90","","195.33","0.07","293","2","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Tripotassium oxoantimonate(V)","","- K3 O4 Sb -","- K3 O4 Sb -","- K6 O8 Sb2 -","2","0.5","JZ1475","Hirschle, Christian; Rosstauscher, Jürgen; Röhr, Caroline","Potassium oxoantimonate(V), K~3~[SbO~4~]","Acta Crystallographica Section C","2001","57","11","1239","1241","10.1107/S0108270101014342","","","0.7107","MoKα","","0.05","0.048","","","","0.122","","","","","","1.238","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2012729","15.684","0.004","8.64","0.002","14.916","0.004","90","","104.528","0.005","90","","1956.6","0.9","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Dichlorobis(N-propylimidazolidine-S)cobalt(II)","","- C12 H24 Cl2 Co N4 S2 -","- C12 H24 Cl2 Co N4 S2 -","- C48 H96 Cl8 Co4 N16 S8 -","4","1","TR1016","Castro, Jesús; Pérez Lourido, Paulo; Sousa-Pedrares, Antonio; Labisbal, Elena; Piso, José; García-Vázquez, José Arturo","Dichlorobis(1-propylimidazolidine-2-thione-κ<i>S</i>)cobalt(II)","Acta Crystallographica Section C","2002","58","5","m319","m322","10.1107/S0108270102006285","","","0.71073","MoKα","","0.1751","0.0485","","","0.1304","0.1733","","","","","","0.857","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2013129","13.021","0.003","5.516","0.002","7.358","0.002","90","","106.5","0.03","90","","506.7","0.3","85","2","85","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","calcium bis(2-phosphonoacetate)","poly[calcium(II)-di-μ-carboxymethylphosphonato]","","- C4 H8 Ca O10 P2 -","- C4 H8 Ca O10 P2 -","- C8 H16 Ca2 O20 P4 -","2","0.5","FA1003","Ślepokura, Katarzyna; Lis, Tadeusz","Polymeric bis(phosphonomethylcarboxylato)calcium(II) at 85K","Acta Crystallographica Section C","2003","59","3","m76","m78","10.1107/S0108270102023302","","","0.71073","MoKα","","0.023","0.02","","","0.05","0.051","","","","","","1.127","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2013381","9.862","0.006","16.541","0.005","10.21","0.012","90","","113.84","0.04","90","","1523","2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","amminebis(1,4-diaminobutane)tetrakis[dicyanoargentato(I)]dicopper(II) dihydrate","","- C16 H31 Ag4 Cu2 N13 O2 -","- C16 H31 Ag4 Cu2 N13 O2 -","- C32 H62 Ag8 Cu4 N26 O4 -","2","0.5","TR1059","Potočňák, Ivan; Triščíková, Ľubica; Wagner, Christoph","Low-dimensional compounds containing cyano groups. VI. A unique two- and one-dimensional structure in amminebis(1,4-diaminobutane)tetrakis[dicyanoargentato(I)]dicopper(II) dihydrate","Acta Crystallographica Section C","2003","59","6","m249","m251","10.1107/S0108270103010151","","","0.71073","MoKα","","0.058","0.0422","","","0.0998","0.1133","","","","","","1.047","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2013528","12.264","0.003","10.111","0.002","22.65","0.005","90","","96.89","0.03","90","","2788.3","1.1","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","di-μ-fumatato-bis(o-phenanthroline)dicobalt(II)","","- C32 H20 Co2 N4 O8 -","- C32 H20 Co2 N4 O8 -","- C128 H80 Co8 N16 O32 -","4","1","TA1410","Jian-Fang Ma; Jin Yang; Jing-Fu Liu","A novel cobalt(II) coordination polymer containing the fumarate anion and <i>o</i>-phenanthroline","Acta Crystallographica Section C","2003","59","8","m304","m306","10.1107/S0108270103012101","","","0.71073","MoKα","","0.0336","0.0275","","","0.0769","0.0858","","","","","","1.073","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2013688","22.361","0.006","7.939","0.002","31.754","0.009","90","","98.621","0.005","90","","5573","3","100","2","100","2","","","","","","","","9","P 1 2/c 1","-P 2yc","13","","","","- C49.196 H24 B Cl6.392 D2.392 F20 Li N4 Pd2 -","- C49.196 H25.274 B Cl6.392 D1.118 F20 Li N4 Pd2 -","- C196.784 H101.096 B4 Cl25.568 D4.472 F80 Li4 N16 Pd8 -","4","1","SQ1023","Han Shen; Ian M. Steele; Richard F. Jordan","Tetra-μ-chloro-1:2κ^4^<i>Cl</i>;1:3κ^4^<i>Cl</i>-bis(4,4'-dimethyl-2,2'-bipyridine)-2κ^2^<i>N</i>,3κ^2^<i>N</i>-lithium(I)dipalladium(II) tetrakis(pentafluorophenyl)borate dichloromethane 1.196-solvate","Acta Crystallographica Section C","2003","59","10","m405","m406","10.1107/S0108270103018365","","","0.71073","MoKα","","0.083","0.0764","","","0.1783","0.1817","","","","","","1.246","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2013765","5.9194","0.0008","5.9245","0.0008","10.5821","0.0014","90","","94.326","0.003","90","","370.05","0.09","208","2","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","acetone peroxide","3,3,6,6-tetramethyl-1,2,4,5-tetroxane","","- C6 H12 O4 -","- C6 H12 O4 -","- C12 H24 O8 -","2","0.5","FG1722","Gelalcha, Feyissa Gadissa; Schulze, Bärbel; Lönnecke, Peter","3,3,6,6-Tetramethyl-1,2,4,5-tetroxane: a twinned crystal structure","Acta Crystallographica Section C","2004","60","3","o180","o182","10.1107/S010827010400112X","","","0.71073","MoKα","","","0.0447","","","","0.1127","","","","","","1.11","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2013933","17.999","0.003","12.614","0.002","13.063","0.002","90","","110.834","0.002","90","","2771.9","0.8","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","trans-endo-threo-norbormide ethyl acetate hemi-solvate","5-[hydroxy(phenyl)(2-pyridyl)methyl]-8-[phenyl(2-pyridyl)methylene]- 3a,4,7,7a-tetrahydro-4,7-methano-1H-isoindole-1,3(2H)-dione ethyl acetate hemisolvate","","- C35 H29 N3 O4 -","- C35 H29 N3 O4 -","- C140 H116 N12 O16 -","4","1","BM1563","Steel, Peter J.; Brimble, Margaret A.; Hopkins, Brian; Rennison, David","Two stereoisomers of the rat toxicant norbormide","Acta Crystallographica Section C","2004","60","5","o374","o376","10.1107/S0108270104006845","","","0.71073","MoKα","","0.1853","0.0616","","","0.1012","0.125","","","","","","0.885","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2014197","18.737","0.003","3.727","0.001","16.617","0.002","90","","114.57","0.02","90","","1055.3","0.4","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C3 H3 N3 O2 S -","- C3 H3 N3 O2 S -","- C24 H24 N24 O16 S8 -","8","2","NA1637","Jacek Zaleski; Grzegorz Spaleniak; Kyzioł, Janusz B.","<i>N</i>-(3<i>H</i>-Thiazol-2-ylidene)nitramine and <i>N</i>-methyl-<i>N</i>-(thiazol-2-yl)nitramine","Acta Crystallographica Section C","2004","60","9","o627","o629","10.1107/S0108270104001428","","","0.71073","MoKα","","0.0536","0.0326","","","0.079","0.093","","","","","","1.041","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2014480","5.5805","0.0005","8.9808","0.0009","21.955","0.002","90","","94.976","0.003","90","","1096.18","0.18","193","2","193","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","[4-[(4-aminophenyl)methyl]benzenamine]-bis(2,4-pentanedionato)Cobalt(II)","catena-Poly[(μ-4,4'-diaminodiphenylmethane-κ^2^N:N')bis(2,4-pentanedionato- κ^2^O,O')cobalt(II)]","","- C23 H28 Co N2 O4 -","- C23 H28 Co N2 O4 -","- C46 H56 Co2 N4 O8 -","2","0.5","GA1073","Zhi, Xin-Lei; Zhang, Wen-Hua; Zhang, Yong; Lang, Jian-Ping","<i>catena</i>-Poly[[bis(pentane-2,4-dionato-κ^2^<i>O</i>,<i>O</i>')cobalt(II)]-μ-4,4'-methylenedianiline-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section C","2004","60","11","m554","m556","10.1107/S0108270104022073","","","0.7107","MoKα","","0.0334","0.0306","","","0.0721","0.0739","","","","","","1.107","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2015357","23.988","0.005","8.754","0.005","37.986","0.005","90","","95.718","0.005","90","","7937","5","173","2","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Octakis(3-propylammonium) octadecaiodopentaplumbate(II)","","- C24 H80 I18 N8 Pb5 -","- C24 H80 I18 N8 Pb5 -","- C96 H320 I72 N32 Pb20 -","4","1","FG3016","Billing, David G.; Lemmerer, Andreas","Octakis(3-propylammonium) octadecaiodopentaplumbate(II): a new layered stucture based on layered perovskites","Acta Crystallographica Section C","2006","62","6","m238","m240","10.1107/S0108270106014417","","","0.71069","MoKα","","","0.0448","","","","0.108","","","","","","0.997","","","","has coordinates,has disorder","176760","2020-10-21","18:00:00",""
"2015361","8.528","0.002","6.2456","0.0013","10.059","0.002","90","","105.462","0.019","90","","516.4","0.2","292","2","292","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","catena-poly[[chlorocopper(I)]-μ-1,2-bis(1-methyl-1H-tetrazol-5-yl)diazene- κ^4^N',N^4^:N,N^4'^]]","","- C4 H6 Cl Cu N10 -","- C4 H6 Cl Cu N10 -","- C8 H12 Cl2 Cu2 N20 -","2","0.5","GD3013","Lyakhov, Alexander S.; Serebryanskaya, Tatiyana V.; Gaponik, Pavel N.; Voitekhovich, Sergei V.; Ivashkevich, Ludmila S.","Bis(1-methyl-1<i>H</i>-tetrazol-5-yl)diazene and two its copper(I) chloride complexes poly[[[μ-1,2-bis(1-methyl-1<i>H</i>-tetrazol-5-yl)diazene-κ^4^<i>N</i>',<i>N</i>^4^:<i>N</i>,<i>N</i>^4'^]dicopper(I)]-di-μ-chloro] and <i>catena</i>-poly[[chlorocopper(I)]-μ-1,2-bis(1-methyl-1<i>H</i>-tetrazol-5-yl)diazene-κ^4^<i>N</i>',<i>N</i>^4^:<i>N</i>,<i>N</i>^4'^]","Acta Crystallographica Section C","2006","62","6","m223","m226","10.1107/S0108270106013199","","","0.71073","MoKα","","0.0579","0.0457","","","0.1174","0.127","","","","","","1.065","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2015413","12.442","0.003","8.333","0.0017","7.66","0.0015","90","","90.14","0.03","90","","794.2","0.3","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","2,4,6-triamino-1,3,5-triazin-1,3-dium bis(trifluoroacetate) trihydrate","","- C7 H14 F6 N6 O7 -","- C7 H14 F6 N6 O7 -","- C14 H28 F12 N12 O14 -","2","0.5","FA3013","Genivaldo Júlio Perpétuo; Jan Janczak","Two crystals of doubly protonated melaminium salts: melaminium bis(trifluoroacetate) trihydrate and melaminium bis(trichloroacetate) dihydrate","Acta Crystallographica Section C","2006","62","7","o372","o375","10.1107/S0108270106015873","","","0.71073","MoKα","","0.1074","0.0445","","","0.0892","0.1048","","","","","","1.001","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015955","6.4669","0.0002","7.0797","0.0003","18.8278","0.0006","90","","97.372","0.002","90","","854.88","0.05","120","2","120","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","hydrazinium(2+) diaqua(4-oxo-4H-pyran-2,6-dicarboxylato)calcate","","- C14 H14 Ca N2 O14 -","- C14 H14 Ca N2 O14 -","- C28 H28 Ca2 N4 O28 -","2","0.5","LN3043","Yasodha, Vaduganathan; Govindarajan, Subbaiah; Low, John N.; Glidewell, Christopher","Cationic, neutral and anionic metal(II) complexes derived from 4-oxo-4<i>H</i>-pyran-2,6-dicarboxylic acid (chelidonic acid)","Acta Crystallographica Section C","2007","63","5","m207","m215","10.1107/S010827010701459X","","","0.71073","MoKα","","0.0378","0.0363","","","0.1111","0.1161","","","","","","1.204","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015974","13.307","0.002","5.0336","0.0005","12.1142","0.0018","90","","116.218","0.005","90","","727.95","0.17","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","catena-Poly[[diaquazinc(II)]-μ-4,4'-sulfonyldibenzoato-κ^2^O:O']","","- C14 H12 O8 S Zn -","- C14 H12 O8 S Zn -","- C28 H24 O16 S2 Zn2 -","2","0.5","BM3026","Peng-Bin Pan; Lei Zhang; Zhao-Ji Li; Xin-Yi Cao; Yuan-Gen Yao","<i>catena</i>-Poly[[diaquazinc(II)]-μ-4,4'-sulfonyldibenzoato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section C","2007","63","6","m270","m272","10.1107/S0108270107008244","","","0.71073","MoKα","","0.0453","0.037","","","0.0844","0.0897","","","","","","1.018","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016361","10.392","0.002","10.224","0.002","8.7073","0.0017","90","","109.43","0.03","90","","872.4","0.3","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","poly[triaquabis(dimethylformamide)di-μ~3~-oxalato-μ~2~-oxalato-\ dilanthanum(III)]","","- C9 H13 La2 N O16 -","- C9 H13 La2 N O16 -","- C18 H26 La4 N2 O32 -","2","0.5","SQ3099","Wang, Jingen; Huang, Xihe; Huang, Changcang; Song, Haiyan; Yang, Duoping","A new three-dimensional neutral framework of lanthanum oxalate: [La~2~(C~2~O~4~)~3~(DMF)(H~2~O)~3~]~<i>n~</i>","Acta Crystallographica Section C","2007","63","12","m583","m585","10.1107/S0108270107053292","","","0.71073","MoKα","","0.0303","0.0261","","","0.056","0.0579","","","","","","1.059","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016410","24.4198","0.0007","7.4511","0.0002","23.1654","0.0006","90","","115.772","0.001","90","","3795.78","0.18","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Tetraphenylphosphonium bis(2-thioxo-1,3-dithiole-4,5-dithiolato)aurate(III) acetone solvate","","- C33 H26 Au O P S10 -","- C33 H26 Au O P S10 -","- C132 H104 Au4 O4 P4 S40 -","4","1","SK3168","Wang, Xin-Qiang; Yu, Wen-Tao; Xu, Dong; Fan, Jian-Dong; Zhang, Guang-Hui; Ren, Quan","Tetraphenylphosphonium bis(2-thioxo-1,3-dithiole-4,5-dithiolato)aurate(III) acetone solvate and ethyltriphenylphosphonium bis(2-thioxo-1,3-dithiole-4,5-dithiolato)aurate(III)","Acta Crystallographica Section C","2008","64","1","m46","m49","10.1107/S010827010706074X","","","0.71073","MoKα","","0.0304","0.0226","","","0.0496","0.0536","","","","","","1.026","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016418","13.4079","0.0008","6.5765","0.0004","16.039","0.0009","90","","106.283","0.001","90","","1357.54","0.14","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","poly[bis(μ-6-mercaptonicotinato-κ^2^S:O)zinc(II)]","","- C12 H8 N2 O4 S2 Zn -","- C12 H8 N2 O4 S2 Zn -","- C48 H32 N8 O16 S8 Zn4 -","4","1","SQ3111","Yong Wang; Dong-Xia Zhu; Zhong-Min Su; Kui-Zhan Shao; Ya-Hui Zhao","A novel two-dimensional zinc(II) coordination polymer with 6-mercaptonicotinic acid","Acta Crystallographica Section C","2008","64","1","m70","m72","10.1107/S0108270107063962","","","0.71073","MoKα","","0.0474","0.0336","","","0.0851","0.0942","","","","","","1","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016926","10.5688","0.0017","12.1887","0.0019","12.6816","0.0015","90","","114.696","0.01","90","","1484.2","0.4","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","4-nitro-1-oxo-2-{(<i>E</i>)-[2-(piperidin-1- yl)ethyl]iminiomethyl}cyclohexadienide","","- C14 H19 N3 O3 -","- C14 H19 N3 O3 -","- C56 H76 N12 O12 -","4","1","GD3261","Santos-Contreras, Rocio J.; Ramos-Organillo, Angel; García-Báez, Efrén V.; Padilla-Martínez, Itzia I.; Martínez-Martínez, Francisco J.","The zwitterion of 4-nitro-2-{(<i>E</i>)-[2-(piperidin-1-yl)ethyl]iminomethyl}phenol","Acta Crystallographica Section C","2009","65","1","o8","o10","10.1107/S0108270108040407","","","0.71073","MoKα","","0.0774","0.0659","","","0.1444","0.1506","","","","","","1.198","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2017035","15.663","0.005","4.4319","0.0014","18.221","0.004","90","","124.517","0.018","90","","1042.2","0.6","298","2","298","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","2,2'-biimidazol-1-ium malonate","","- C9 H10 N4 O4 -","- C9 H10 N4 O4 -","- C36 H40 N16 O16 -","4","1","FG3076","Gao, Xiao-Li; Lu, Li-Ping; Zhu, Miao-Li","The crucial role of C—H···O and C=O···π interactions in the building of three-dimensional structures of dicarboxylic acid‒biimidazole compounds","Acta Crystallographica Section C","2009","65","4","o123","o127","10.1107/S0108270109005836","","","0.71073","MoKα","","0.0471","0.0408","","","0.1185","0.1223","","","","","","1.071","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2017320","14.8094","0.0011","6.4226","0.0007","7.0194","0.0008","90","","90.949","0.009","90","","667.56","0.12","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Poly[[aqua(4,4'-diazenediyldibenzoato- κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>''')cadmium(II)]","","- C14 H10 Cd N2 O5 -","- C14 H10 Cd N2 O5 -","- C28 H20 Cd2 N4 O10 -","2","0.5","DN3124","Wang, Ru-Guo; Qiao, Qian; Tang, Tian-Di","Poly[[aqua(4,4'-diazenediyldibenzoato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>''')cadmium(II)]: a twofold interpenetrated three-dimensional coordination polymer of PtS topology","Acta Crystallographica Section C","2009","65","10","m388","m390","10.1107/S0108270109035501","","","0.71073","MoKα","","0.0487","0.0343","","","0.0687","0.0722","","","","","","0.956","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2018278","8.555","0.002","7.585","0.002","24.56","0.005","90","","94.32","0.03","90","","1589.2","0.6","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","bis(6-chloropyridin-3-aminium) [hydrogen bis({[2-chloropyridin-1-ium-3-yl(0.5+)]amino}methylenediphosphonate)]","","- C22 H28 Cl4 N8 O12 P4 -","- C22 H28 Cl4 N8 O12 P4 -","- C44 H56 Cl8 N16 O24 P8 -","2","0.5","FG3227","Matczak-Jon, Ewa; Ślepokura, Katarzyna","Conformations and resulting hydrogen-bonded networks of hydrogen {phosphono[(pyridin-1-ium-3-yl)amino]methyl}phosphonate and related 2-chloro and 6-chloro derivatives","Acta Crystallographica Section C","2011","67","11","o450","o456","10.1107/S0108270111040650","","","0.71073","MoKα","","0.0677","0.0412","","","0.0851","0.0897","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2018335","10.8128","0.0008","8.4293","0.0004","10.9321","0.0009","90","","118.192","0.008","90","","878.2","0.12","120","","120","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","(3a<i>RS</i>,7a<i>RS</i>)-1,3-dinitroso-2,3,3a,4,5,6,7,7a- octahydro-1<i>H</i>-benzimidazole","","- C7 H12 N4 O2 -","- C7 H12 N4 O2 -","- C28 H48 N16 O8 -","4","1","UK3034","Rivera, Augusto; Quiroga, Diego; Ríos-Motta, Jaime; Fejfarová, Karla; Dušek, Michal","The disordered molecular structure of (3a<i>RS</i>,7a<i>RS</i>)-1,3-dinitrosooctahydro-1<i>H</i>-benzimidazole","Acta Crystallographica Section C","2011","67","12","o505","o508","10.1107/S0108270111046397","","","1.5418","CuKα","","0.0475","0.0403","","","0.1103","0.1147","","","","","","1.92","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2018712","10.208","0.003","6.875","0.002","11.769","0.003","90","","102.2","0.04","90","","807.3","0.4","120","2","120","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Pentapotassium hydrogen hypodiphosphate dihydrogen hypodiphosphate dihydrate","","- H7 K5 O14 P4 -","- H6.748 K5 O14 P4 -","- H13.496 K10 O28 P8 -","2","0.5","FN3115","Szafranowska, Barbara; Ślepokura, Katarzyna; Lis, Tadeusz","Potassium salts of hypodiphosphoric acid","Acta Crystallographica Section C","2012","68","12","i71","i82","10.1107/S010827011204317X","","","0.71073","MoKα","","0.045","0.0239","","","0.0454","0.0466","","","","","","1.08","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2018756","14.424","0.004","6.3401","0.0016","7.234","0.002","90","","92.51","0.03","90","","660.9","0.3","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Poly[aqua[μ~4~-3,3'-(diazenediyl)dibenzoato]zinc]","","- C14 H10 N2 O5 Zn -","- C14 H10 N2 O5 Zn -","- C28 H20 N4 O10 Zn2 -","2","0.5","MX3089","Liu, Lei-Lei; Zhao, Feng","Poly[aqua[μ~4~-3,3'-(diazenediyl)dibenzoato]zinc]","Acta Crystallographica Section C","2013","69","1","29","32","10.1107/S0108270112048974","","","0.71073","MoKα","","0.0326","0.0295","","","0.069","0.0716","","","","","","1.095","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2018794","9.7137","0.0019","8.0745","0.0016","15.396","0.003","90","","98.73","0.03","90","","1193.6","0.4","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","poly[[μ-4,4'-(diazenediyl)dipyridine]-μ~2~-iodido-copper(I)]","","- C10 H8 Cu I N4 -","- C10 H8 Cu I N4 -","- C40 H32 Cu4 I4 N16 -","4","1","SK3470","Huang, Wenjiang; Zhang, Jinfang; Li, Jianghua; Zhang, Chi","A twofold interwoven two-dimensional→two-dimensional (2-D→2-D) cluster‒organic network based on the [Cu~2~I~2~] cluster and the 4,4'-(diazenediyl)dipyridine ligand: poly[[μ~2~-4,4'-(diazenediyl)dipyridine]-μ~2~-iodido-copper(I)]","Acta Crystallographica Section C","2013","69","2","123","126","10.1107/S0108270113000942","","","0.71073","MoKα","","0.0876","0.0603","","","0.0838","0.0934","","","","","","1.169","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019108","10.6408","0.0005","15.8571","0.0004","24.8678","0.0009","90","","93.534","0.004","90","","4188","0.3","289","2","289","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","<i>N</i>-<i>tert</i>-Butyl-<i>N</i>'-[5-cyano-2-(4-methylphenoxy)phenylsulfonyl]urea","","- C19 H21 N3 O4 S -","- C19 H21 N3 O4 S -","- C152 H168 N24 O32 S8 -","8","2","UK3071","Bambi-Nyanguile, Sylvie-Mireille; Mangwala Kimpende, Peter; Pirotte, Bernard; Van Meervelt, Luc","<i>N</i>-<i>tert</i>-Butyl-<i>N</i>'-[5-cyano-2-(4-methylphenoxy)phenylsulfonyl]urea, a new TXA~2~ receptor antagonist","Acta Crystallographica Section C","2013","69","8","901","903","10.1107/S010827011301771X","","","0.71073","MoKα","","0.0989","0.0733","","","0.1633","0.1742","","","","","","1.062","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019560","10.82","0.006","10.69","0.006","22.803","0.012","90","","94.628","0.01","90","","2629","2","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Poly[hexaaquatetrakis(μ~5~-pyridine-2,6-dicarboxylato)bis(μ~4~-pyridine-2,6-dicarboxylato)(μ~7~-sulfato)heptastrontium(II)]","","- C42 H30 N6 O34 S Sr7 -","- C42 H30 N6 O34 S Sr7 -","- C84 H60 N12 O68 S2 Sr14 -","2","0.5","WQ3061","Zhang, Wei; Qi, Shu-Guang; Feng, Yu-Quan","A novel alkaline earth strontium(II) coordination polymer: poly[hexaaquatetrakis(μ~5~-pyridine-2,6-dicarboxylato)bis(μ~4~-pyridine-2,6-dicarboxylato)(μ~7~-sulfato)heptastrontium(II)]","Acta Crystallographica Section C","2014","70","6","584","587","10.1107/S205322961401002X","","","0.71073","MoKα","","0.0904","0.0492","","","0.0911","0.0986","","","","","","1.009","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2019886","10.252","0.002","5.8362","0.0012","12.656","0.003","90","","106.29","0.03","90","","726.8","0.3","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","2-Carboxypyridinium perchlorate‒pyridinium-2-carboxylate (1/1)","","- C12 H11 Cl N2 O8 -","- C12 H11 Cl N2 O8 -","- C24 H22 Cl2 N4 O16 -","2","0.5","KU3149","Wang, Bi-Qin; Yan, Hai-Biao; Huang, Zheng-Qing; Zhang, Yun-Hua; Sun, Jing","Reversible phase transition of 2-carboxypyridinium perchlorate‒pyridinium-2-carboxylate (1/1)","Acta Crystallographica Section C","2015","71","4","","","10.1107/S2053229615003691","","","0.71073","MoKα","","0.0824","0.0785","","","0.2523","0.2578","","","","","","1.115","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019928","10.366","0.003","8.774","0.003","27.071","0.007","90","","101.48","0.01","90","","2412.9","1.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Poly[diaquatris(μ~3~-cyclohexane-1,4-dicarboxylato)bis[2-(pyridin-4-yl)benzimidazole]tricadmium(II)","","- C48 H52 Cd3 N6 O14 -","- C48 H52 Cd3 N6 O14 -","- C96 H104 Cd6 N12 O28 -","2","0.5","LY3010","Yang, Xiu-Hong; Yang, Ming-Xing; Chen, Li-Juan; Guo, Jing; Lin, Shen","A novel two-dimensional cadmium(II) complex: poly[diaquatris(μ~4~-cyclohexane-1,4-dicarboxylato)bis[2-(pyridin-4-yl)-1<i>H</i>-benzimidazole]tricadmium(II)","Acta Crystallographica Section C","2015","71","5","","","10.1107/S2053229615005823","","","0.71073","MoKα","","0.044","0.0384","","","0.1036","0.1094","","","","","","1.094","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2020201","7.926","","3.651","","13.776","","90","","108.27","","90","","378.552","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","H2 Al F5 (H2 O)5","","- Al F5 H12 O5 -","- Al F5 H12 O5 -","- Al2 F10 H24 O10 -","2","0.5","","Mootz, D.; Oellers, E.J.; Wiebcke, M.","Structures of (I) hexafluoroaluminic acid hexahydrate and (II) pentafluoroaluminic acid pentahydrate","Acta Crystallographica C (39,1983-)","1988","44","","1334","1337","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2020225","4.57","","8.937","","6.441","","90","","134.76","","90","","186.792","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Ba Co S2 -","- Ba Co S2 -","- Ba2 Co2 S4 -","2","0.5","","Baenziger, N.C.; Schweitzer, J.W.; Martinson, L.S.; Grout, L.","Ba Co S2","Acta Crystallographica C (39,1983-)","1994","50","","1375","1377","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2020292","18.0782","0.0007","5.8922","0.0003","15.8365","0.0003","90","","93.7245","0.0007","90","","1683.35","0.11","296","","296","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","<i>catena</i>-Poly[[[bis(ethylenediamine-κ^2^<i>N</i>,<i>N</i>')platinum(II)]-μ-chlorido-[bis(ethylenediamine)platinum(IV)]-μ-chlorido] tetrakis{4-[(4-hydroxyphenyl)diazenyl]benzenesulfonate} dihydrate]","","- C56 H72 Cl2 N16 O18 Pt2 S4 -","- C56 H72 Cl2 N16 O18 Pt2 S4 -","- C56 H72 Cl2 N16 O18 Pt2 S4 -","1","0.25","UK3120","Matsushita, Nobuyuki; Taira, Ayako","A one-dimensional chloride-bridged PtII/PtIVmixed-valence complex with a 4-[(4-hydroxyphenyl)diazenyl]benzenesulfonate counter-ion","Acta Crystallographica Section C Structural Chemistry","2015","71","12","","","10.1107/S2053229615019877","","","0.7107","MoKα","","0.0512","0.0303","","","0.0552","0.0615","","","","","","1.042","","","","has coordinates,has Fobs","176429","2020-10-21","18:00:00",""
"2020791","13.1813","0.0007","7.2661","0.0004","15.6283","0.0008","90","","96.933","0.003","90","","1485.88","0.14","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","2,2'-(Disulfanediylbis{5-[(1<i>E</i>)-(2-hydroxybenzylidene)amino]-1,3-thiazole-4,2-diyl})diphenol","2-[5-[(<i>E</i>)-(2-Hydroxybenzylidene)amino]-4-(2-{5-[(<i>E</i>)-(2-hydroxybenzylidene)amino]-2-(2-hydroxyphenyl)-1,3-thiazol-4-yl}disulfanyl)-1,3-thiazol-2-yl]phenol","","- C32 H22 N4 O4 S4 -","- C32 H22 N4 O4 S4 -","- C64 H44 N8 O8 S8 -","2","0.5","UK3134","Zarei, Seyed Amir; Piltan, Mohammad; Mashhun, Asmar; Rudbari, Hadi Amiri; Bruno, Giuseppe","2,2'-[(Disulfanediyl)bis{5-[(1<i>E</i>)-(2-hydroxybenzylidene)amino]-1,3-thiazole-4,2-diyl}]diphenol: synthesis, crystal structure and calculation of molecular hyperpolarizability","Acta Crystallographica Section C","2017","73","8","","","10.1107/S2053229617008257","","","0.71073","MoKα","","0.0641","0.0413","","","0.1116","0.1296","","","","","","1.041","","","","has coordinates,has Fobs","199082","2020-10-21","18:00:00",""
"2020932","16.2905","0.0005","6.751","0.0002","18.9112","0.0006","90","","98.2024","0.0011","90","","2058.52","0.11","150","2","150","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","2-[Bis(diisopropylphosphanyl)methyl]-6-methylpyridine","","- C19 H35 N P2 -","- C19 H35 N P2 -","- C76 H140 N4 P8 -","4","1","OV3095","Han, Delong; Andres, Benjamin; Spannenberg, Anke; Beweries, Torsten","Synthesis and coordination chemistry of the PPN ligand 2-[bis(diisopropylphosphanyl)methyl]-6-methylpyridine","Acta Crystallographica Section C","2017","73","11","917","922","10.1107/S205322961701261X","","","0.71073","MoKα","","0.0429","0.0345","","","0.0889","0.0959","","","","","","1.023","","","","has coordinates,has Fobs","205320","2020-10-21","18:00:00",""
"2021455","9.198","0.006","10.586","0.007","15.223","0.011","90","","105.56","0.02","90","","1427.9","1.7","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","(4a<i>RS</i>,6<i>SR</i>)-9-chloro-6-hydroxy-3-(2-hydroxyethyl)-2,3,4a,5,6,7-hexahydrobenzo[<i>f</i>]pyrazino[1,2-<i>a</i>]azepine-1,4-dione","","- C15 H17 Cl N2 O4 -","- C15 H17 Cl N2 O4 -","- C60 H68 Cl4 N8 O16 -","4","1","FN3291","Guerrero, Sergio A.; Ramírez, Juan E.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher","A concise and versatile route to tetrahydro-1-benzazepines carrying [<i>a</i>]-fused heterocyclic units: synthetic sequence and spectroscopic characterization, and the molecular and supramolecular structures of one intermediate and two products","Acta Crystallographica Section C","2019","75","2","","","10.1107/S2053229619000871","","","0.71073","MoKα","","0.0348","0.031","","","0.0751","0.0773","","","","","","1.071","","","","has coordinates,has Fobs","213349","2020-10-21","18:00:00",""
"2021840","16.2511","0.0014","11.612","0.0011","20.2609","0.0018","90","","124.02","0.005","90","","3169","0.5","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Poly[[diaqiabis(μ-4,4'-bipyridine)bis{μ~3~-5-[(2-carboxyphenoxy)methyl]isophthalato}tricadmium(III)] dimethylformamide monosolvate 2.5-hydrate]","","- C58 H62 Cd3 N6 O23 -","- C52 H38 Cd3 N4 O16 -","- C104 H76 Cd6 N8 O32 -","2","0.5","","Yu, Yu'e; Chen, Yuqian; Mi, Xiuna; Wang, Suna; Lu, Jing","A novel (3,6)-connected Cd^II^ coordination polymer based on an ether-linked tricarboxylate ligand: synthesis, topology and luminescence sensing properties in aqueous solution","Acta Crystallographica Section C","2019","75","12","","","10.1107/S2053229619015560","","","0.71073","MoKα","","0.1074","0.0694","","","0.1652","0.1791","","","","","","1.017","","","","has coordinates,has Fobs","243777","2020-10-21","18:00:00",""
"2022778","10.4134","0.0002","6.9167","0.0002","20.4801","0.0005","90","","90.308","0.002","90","","1475.09","0.06","293","2","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","1-[4-(1-Hydroxycyclohexan-1-yl)buta-1,3-diyne-1-yl]cyclohexan-1-ol","1,1'-(Buta-1,3-diyne-1,4-diyl)bis(cyclohexan-1-ol)","","- C16 H22 O2 -","- C16 H22 O2 -","- C64 H88 O8 -","4","1","ZV2024","Tirkasheva, Sarvinoz I.; Ziyadullaev, Odiljon E.; Eshimbetov, Alisher G.; Ibragimov, Bakhtiyar T.; Ashurov, Jamshid M.","Synthesis, crystal structure, Hirshfeld surface analysis and DFT study of the 1,1′-(buta-1,3-diyne-1,4-diyl)bis(cyclohexan-1-ol)","Acta Crystallographica Section E Crystallographic Communications","2023","79","7","","","10.1107/S2056989023004772","","x-ray","1.54184","CuKα","","0.0594","0.0444","","","0.1181","0.1291","","","","","","1.066","","","","has coordinates,has Fobs","284686","2023-06-29","15:39:29",""
"2022935","5.96605","0.00017","5.13977","0.00012","9.9308","0.0003","90","","107.275","0.003","90","","290.783","0.015","99.99","0.1","99.99","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Calcium hexafluoridosilicate dihydrate","","- Ca F6 H4 O2 Si -","- Ca F6 H4 O2 Si -","- Ca2 F12 H8 O4 Si2 -","2","0.5","HB8080","Motaln, Klemen; Lozinšek, Matic","Crystal structure of CaSiF6·2H2O(mP2) and reevaluation of the SiIV–F bond-valence parameter R 0","Acta Crystallographica Section E Crystallographic Communications","2023","79","12","1121","1126","10.1107/S2056989023009349","","x-ray","1.54184","CuKα","","0.025","0.0247","","","0.0691","0.0696","","","","","","1.142","","","","has coordinates,has disorder,has Fobs","288944","2024-01-07","11:50:52",""
"2023043","6.9143","0.0014","6.2111","0.0012","17.169","0.003","90","","90.05","0.03","90","","737.3","0.2","100","","100","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","<i>catena</i>-Poly[[[aquacopper(II)]-bis(μ-4-aminobenzoato)-κ^2^<i>N</i>:<i>O</i>;κ^2^<i>O</i>:<i>N</i>] monohydrate]","","- C14 H16 Cu N2 O6 -","- C14 H16 Cu N2 O6 -","- C28 H32 Cu2 N4 O12 -","2","0.5","ZV2032","Gogia, Alisha; Novikov, Egor M.; Guzei, Ilia A.; Fonari, Marina S.; Timofeeva, Tatiana V.","Crystal structure and characterization of a new one-dimensional copper(II) coordination polymer containing a 4-amino-benzoic acid ligand.","Acta crystallographica. Section E, Crystallographic communications","2024","80","Pt 3","330","334","10.1107/S2056989024001336","","x-ray","0.71073","MoKα","","0.0391","0.0329","","","0.0838","0.0865","","","","","","1.087","","","","has coordinates,has disorder,has Fobs","291127","2024-04-05","23:44:20",""
"2100243","4.8022","0.0005","5.6318","0.0006","5.0803","0.0006","90","","92.762","0.009","90","","137.24","0.03","304","1","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Mn O4 Re -","- Mn O4 Re -","- Mn2 O8 Re2 -","2","0.5","WS5018","Bramnik, Kirill G.; Ehrenberg, Helmut; Buhre, Stephan; Fuess, Hartmut","Preparation, crystal structure and magnetic properties of the high-pressure phase MnReO~4~ with a wolframite-type structure","Acta Crystallographica Section B","2005","61","3","246","249","10.1107/S0108768105005380","","","0.71073","MoKα","","0.0293","0.0276","","","0.0649","0.0659","","","","","","1.174","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2101218","12.189","0.003","3.865","0.003","16.022","0.005","90","","90.79","0.02","90","","754.7","0.7","","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","","","","","- C6 H6 N2 O2 S -","- C6 H6 N2 O2 S -","- C24 H24 N8 O8 S4 -","4","1","AN0501","Chertanova, L.; Pascard, C.; Sheremetev, A.","X-ray investigation of glyoxime derivatives. V. Two isomers of 2-(thienyl)glyoxime. A database study of the geometry and hydrogen bonding of the oxime group","Acta Crystallographica Section B","1994","50","6","708","716","10.1107/S0108768194004179","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2101674","4.69263","0.00005","5.72129","0.00007","4.92805","0.00005","90","","90.6321","0.0009","90","","132.3","0.003","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- O4 W Zn -","- O4 W Zn -","- O8 W2 Zn2 -","2","0.5","HA0150","Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G.","Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~","Acta Crystallographica Section B","1997","53","1","102","112","10.1107/S0108768196010403","","neutron","1.227","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2101675","4.69114","0.00006","5.72608","0.00007","4.92536","0.00006","90","","90.7507","0.0009","90","","132.293","0.003","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Cu0.1 O4 W Zn0.9 -","- O4 W Zn -","- O8 W2 Zn2 -","2","0.5","HA0150","Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G.","Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~","Acta Crystallographica Section B","1997","53","1","102","112","10.1107/S0108768196010403","","neutron","1.227","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2101676","4.68766","0.00008","5.72752","0.0001","4.92052","0.00008","90","","90.8566","0.0013","90","","132.095","0.004","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Cu0.15 O4 W Zn0.85 -","- O4 W Zn -","- O8 W2 Zn2 -","2","0.5","HA0150","Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G.","Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~","Acta Crystallographica Section B","1997","53","1","102","112","10.1107/S0108768196010403","","neutron","1.227","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2101677","4.68502","0.00005","5.73194","0.00007","4.9156","0.00005","90","","91.0026","0.0009","90","","131.985","0.003","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Cu0.2 O4 W Zn0.8 -","- O4 W Zn -","- O8 W2 Zn2 -","2","0.5","HA0150","Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G.","Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~","Acta Crystallographica Section B","1997","53","1","102","112","10.1107/S0108768196010403","","neutron","1.227","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102072","10.033","0.002","7.9745","0.0016","29.552","0.006","90","","88.742","0.004","90","","2363.8","0.8","293","2","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","Arppe compound","","","- Bi24 Cl10 O31 -","- Bi24 Cl10 O31 -","- Bi48 Cl20 O62 -","2","0.5","JZ0008","Eggenweiler, U.; Keller, E.; Krämer, V.","Redetermination of the crystal structures of the `Arppe compound' Bi~24~O~31~Cl~10~ and the isomorphous Bi~24~O~31~Br~10~","Acta Crystallographica Section B","2000","56","3","431","437","10.1107/S0108768100000550","","","0.71073","MoKα","","0.1089","0.063","","","","0.1463","","","","","","0.9","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102777","7.6396","0.0012","4.9447","0.0007","9.3596","0.0014","90","","111.427","0.011","90","","329.13","0.09","293","1","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Ba O9 V4 -","- Ba O9 V4 -","- Ba2 O18 V8 -","2","0.5","BM5044","Reeswinkel, T.; Prinz, S.; Sparta, K. M.; Roth, G.","Synthesis and structural characterization of BaV~4~O~9~","Acta Crystallographica Section B","2007","63","2","270","276","10.1107/S0108768107003734","","","0.71073","MoKα","","","0.023","","","","0.0402","","","","","","1.448","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102778","7.6303","0.0012","4.9405","0.0007","9.3547","0.0014","90","","111.395","0.011","90","","328.35","0.09","250","1","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Ba O9 V4 -","- Ba O9 V4 -","- Ba2 O18 V8 -","2","0.5","BM5044","Reeswinkel, T.; Prinz, S.; Sparta, K. M.; Roth, G.","Synthesis and structural characterization of BaV~4~O~9~","Acta Crystallographica Section B","2007","63","2","270","276","10.1107/S0108768107003734","","","0.71073","MoKα","","","0.0222","","","","0.038","","","","","","1.408","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102779","7.6231","0.0012","4.937","0.0007","9.3528","0.0014","90","","111.386","0.011","90","","327.76","0.09","200","1","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Ba O9 V4 -","- Ba O9 V4 -","- Ba2 O18 V8 -","2","0.5","BM5044","Reeswinkel, T.; Prinz, S.; Sparta, K. M.; Roth, G.","Synthesis and structural characterization of BaV~4~O~9~","Acta Crystallographica Section B","2007","63","2","270","276","10.1107/S0108768107003734","","","0.71073","MoKα","","","0.0216","","","","0.0383","","","","","","1.46","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102780","7.614","0.0012","4.9319","0.0007","9.347","0.0014","90","","111.371","0.011","90","","326.86","0.09","150","1","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Ba O9 V4 -","- Ba O9 V4 -","- Ba2 O18 V8 -","2","0.5","BM5044","Reeswinkel, T.; Prinz, S.; Sparta, K. M.; Roth, G.","Synthesis and structural characterization of BaV~4~O~9~","Acta Crystallographica Section B","2007","63","2","270","276","10.1107/S0108768107003734","","","0.71073","MoKα","","","0.0201","","","","0.0355","","","","","","1.384","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102781","7.6084","0.0013","4.9291","0.0007","9.3464","0.0015","90","","111.371","0.012","90","","326.41","0.09","100","1","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Ba O9 V4 -","- Ba O9 V4 -","- Ba2 O18 V8 -","2","0.5","BM5044","Reeswinkel, T.; Prinz, S.; Sparta, K. M.; Roth, G.","Synthesis and structural characterization of BaV~4~O~9~","Acta Crystallographica Section B","2007","63","2","270","276","10.1107/S0108768107003734","","","0.71073","MoKα","","","0.0206","","","","0.0353","","","","","","1.457","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102819","8.1711","0.001","10.9972","0.0012","9.4601","0.0011","90","","91.575","0.005","90","","849.76","0.17","150","1","150","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Cyclamic acid","N-Cyclohexylsulfamic acid","","- C6 H13 N O3 S -","- C6 H13 N O3 S -","- C24 H52 N4 O12 S4 -","4","1","BM5046","Leban, Ivan; Rudan-Tasic, Darja; Lah, Nina; Klofutar, Cveto","Structures of artificial sweeteners ‒ cyclamic acid and sodium cyclamate with other cyclamates","Acta Crystallographica Section B","2007","63","3","418","425","10.1107/S0108768107013961","","","0.71073","MoKα","","0.0439","0.0338","","","0.0812","0.0904","","","","","","1.123","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2103195","8.293","","16.58","","13.465","","90","","90.29","","90","","1851.39","","","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C6 H5 N Na O6.5 S -","- C6 H5 N Na O6.5 S -","- C48 H40 N8 Na8 O52 S8 -","8","2","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","283803","2023-05-16","08:05:53",""
"2103217","9.134","","12.078","","27.74","","90","","92.39","","90","","3057.63","","","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H51 O S3 Ta -","- C26 H51 O S3 Ta -","- C104 H204 O4 S12 Ta4 -","4","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",""
"2103461","17.8141","0.0018","13.89","0.003","17.806","0.0017","90","","89.91","0.03","90","","4405.9","1.1","173","2","173","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","t-butycalix[4]arene:toluene","","","- C51 H64 O4 -","- C51.5 H64 O4 -","- C206 H256 O16 -","4","1","AN0621","Enright, Gary D.; Brouwer, Eric B.; Udachin, Konstantin A.; Ratcliffe, Christopher I.; Ripmeester, John A.","A reexamination of the low-temperature crystal structure of the <i>p-tert</i>-butylcalix[4]arene‒toluene inclusion compound. Differences in spatial averaging with Cu and Mo<i>K</i>α radiation","Acta Crystallographica Section B","2002","58","6","1032","1035","10.1107/S0108768102018803","","","0.71073","MoKα","","0.0696","0.0513","","","0.1218","0.1366","","","","","","1.089","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2104258","5.906","0.002","16.719","0.006","10.724","0.005","90","","105.99","0.05","90","","1017.9","0.7","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","Tetrabarium Hexatitanium Tetrasilicate Monohydrate","Tetrabarium Hexatitanium Tetrasilicate Monohydrate","","- Ba3.2 H2 O25 Si4 Sr0.8 Ti6 -","- Ba3.26 O25 Si4 Sr0.74 Ti6 -","- Ba6.52 O50 Si8 Sr1.48 Ti12 -","2","0.5","CK5034","Cadoni, Marcella; Bloise, Andrea; Ferraris, Giovanni; Merlino, Stefano","Order‒disorder character and twinning in the structure of a new synthetic titanosilicate: (Ba,Sr)~4~Ti~6~Si~4~O~24~·H~2~O","Acta Crystallographica Section B","2008","64","6","669","675","10.1107/S0108768108032631","","","0.71073","MoKα","","0.1883","0.0827","","","0.1787","0.2269","","","","","","0.962","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2104696","22.4102","0.0003","7.0292","0.0001","13.314","0.0002","90","","92.538","0.001","90","","2095.24","0.05","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Sodium Strontium Silicate hydrate","TetraSodium BisStrontium OctaSilicate TetraHydrate","","- H8 Na4 O23 Si8 Sr -","- Na4 O23 Si8 Sr -","- Na16 O92 Si32 Sr4 -","4","1","WH5008","Cadoni, Marcella; Ferraris, Giovanni","Two new silicate structures based on a rhodesite-type heteropolyhedral microporous framework","Acta Crystallographica Section B","2010","66","2","151","157","10.1107/S0108768109050009","","","0.71073","MoKα","","0.0573","0.0328","","","0.0637","0.065","","","","","","1.617","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2104908","14.5882","0.0005","9.2584","0.0002","19.1532","0.0006","90","","93.26","0.003","90","","2582.71","0.13","200","2","200","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","chlorpropamide, β^II^-form","4-chloro-N-((propylaminocarbonyl)benzenesulfonamide","","- C10 H13 Cl N2 O3 S -","- C10 H13 Cl N2 O3 S -","- C80 H104 Cl8 N16 O24 S8 -","8","2","GP5041","Drebushchak, Tatiana N.; Drebushchak, Valeri A.; Boldyreva, Elena V.","Solid-state transformations in the β-form of chlorpropamide on cooling to 100K","Acta Crystallographica Section B","2011","67","2","163","176","10.1107/S0108768111004290","","","0.71073","MoKα","","0.1224","0.0553","","","0.1373","0.1467","","","","","","0.75","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2105477","9.4415","0.0006","9.4235","0.0007","31.883","0.003","90","","92.352","0.008","90","","2834.3","0.4","100","1","100","1","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- I3 Nb10 Se40 -","- I3 Nb10 Se40 -","- I6 Nb20 Se80 -","2","0.5","WF5106","Zubko, Maciej; Kusz, Joachim; Prodan, Albert; Šturm, Sašo; van Midden, Herman J. P.; Bennett, J. Craig; Dubin, Grzegorz; Zupanič, Erik; Böhm, Horst","Structural phase transition and related electronic properties in quasi-one-dimensional (NbSe~4~)~10/3~I","Acta Crystallographica Section B","2013","69","3","229","237","10.1107/S2052519213010336","","","1.54184","CuKα","","0.0905","0.0581","","","0.1351","0.153","","","","","","1.19","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2106271","8.564","","13.354","","9.368","","90","","124.32","","90","","884.837","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","Se3.02 S4.98","","- S4.98 Se3.02 -","- S4.98 Se3.02 -","- S19.92 Se12.08 -","4","1","","Calvo, C.; Ng, H.N.; Gillespie, R.J.; Vekris, J.E.","Structure of monoclinic sulphur-selenium Se3 S5","Acta Crystallographica B (24,1968-38,1982)","1978","34","","911","912","","","","","","","","","","","","","","","","","","","","","","has coordinates","148631","2020-10-21","18:00:00",""
"2106479","9.859","","5.0416","","6.991","","90","","109.478","","90","","327.602","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","V3 O5","","- O5 V3 -","- O5 V3 -","- O20 V12 -","4","1","","Asbrink, S.","The crystal structure of and valency distribution in the low-temperature modification of V3 O5. The decisive importance of a few very weak reflexions in a crystal-structure","Acta Crystallographica B (24,1968-38,1982)","1980","36","","1332","1339","","","","","","","","","","","","","","","","","","","","","","has coordinates","150356","2020-10-21","18:00:00",""
"2106889","11.93","","3.82","","59.72","","90","","98.3","","90","","2693.09","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","W25 O73","","- O73 W25 -","- O73 W25 -","- O146 W50 -","2","0.5","","Sundberg, M.R.","The crystal and defect structures of W25 O73, a member of the homologous series Wn O3N/-2","Acta Crystallographica B (24,1968-38,1982)","1976","32","","2144","2149","","","","","","","","","","","","","","","","","","","","","","has coordinates","162570","2020-10-21","18:00:00",""
"2107056","8.06","","4.65","","12.63","","90","","90","","90","","473.36","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Tl Be2 F5","","- Be2 F5 Tl -","- Be2 F5 Tl -","- Be8 F20 Tl4 -","4","1","","le Fur, Y.","Structure du pentafluorodiberyllate Tl Be2 F5","Acta Crystallographica B (24,1968-38,1982)","1972","28","","1159","1163","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2107377","9.21","","9.15","","22.6","","90","","106.1","","90","","1829.84","","","","","","","","","","","","","1","P 1 2/c 1","-P 2yc","13","","","","- P -","- P -","- P84 -","84","21","","Thurn, H.; Krebs, H.","Ueber Struktur und Eigenschaften der Halbmetalle. XXII. Die Kristallstruktur des Hittorfschen Phosphors","Acta Crystallographica B (24,1968-38,1982)","1969","25","","125","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2108102","16.205","0.0005","8.7361","0.0003","16.4295","0.0005","90","","92.216","0.003","90","","2324.16","0.13","295","2","295","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Tris(piperazine-1,4-diium) bis(hexaiodidoantimonate(III)) pentahydrate","","- C12 H46 I12 N6 O5 Sb2 -","- C12 H46 I12 N6 O5 Sb2 -","- C24 H92 I24 N12 O10 Sb4 -","2","0.5","EB5060","Bujak, Maciej","Formation and distortion of iodidoantimonates(III): the first isolated [SbI~6~]^3{-^} octahedron","Acta Crystallographica Section B","2017","73","3","432","442","10.1107/S2052520617003420","","","0.71073","MoKα","","0.0555","0.0283","","","0.0527","0.0557","","","","","","0.848","","","","has coordinates,has Fobs","199056","2020-10-21","18:00:00",""
"2108103","16.0632","0.0009","8.6414","0.0005","16.3102","0.001","90","","91.994","0.005","90","","2262.6","0.2","85","0.5","85","0.5","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Tris(piperazine-1,4-diium) bis(hexaiodidoantimonate(III)) pentahydrate","","- C12 H46 I12 N6 O5 Sb2 -","- C12 H46 I12 N6 O5 Sb2 -","- C24 H92 I24 N12 O10 Sb4 -","2","0.5","EB5060","Bujak, Maciej","Formation and distortion of iodidoantimonates(III): the first isolated [SbI~6~]^3{-^} octahedron","Acta Crystallographica Section B","2017","73","3","432","442","10.1107/S2052520617003420","","","0.71073","MoKα","","0.0952","0.0412","","","0.1045","0.1094","","","","","","1.007","","","","has coordinates,has Fobs","199056","2020-10-21","18:00:00",""
"2108679","11.8817","0.0003","8.19277","0.00017","10.3237","0.0002","90","","101.597","0.0013","90","","984.43","0.04","293","","293","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Cu Ge9 O24 Sr5 -","- Cu Ge9 O24 Sr5 -","- Cu2 Ge18 O48 Sr10 -","2","0.5","","Klein, Holger; Kodjikian, Stéphanie; Philippe, Rémy; Ding, Lei; Colin, Claire V.; Darie, Céline; Bordet, Pierre","Three different Ge environments in a new Sr~5~CuGe~9~O~24~ phase synthesized at high pressure and high temperature","Acta Crystallographica Section B","2020","76","5","727","732","10.1107/S2052520620008914","powder diffraction","x-ray","1.54056","CuKα~1~","","0.0276","0.0272","","0.0299","0.0299","","","","1.55","","","","","","","has coordinates","258185","2020-10-21","18:00:00",""
"2200067","8.9931","0.0001","12.2068","0.0001","22.6703","0.0003","90","","92.507","0.001","90","","2486.29","0.05","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Diphenylbis[N-(2-hydroxyethyl)-N-methyldithiocarbamato]tin","","- C20 H26 N2 O2 S4 Sn -","- C20 H26 N2 O2 S4 Sn -","- C80 H104 N8 O8 S16 Sn4 -","4","1","NA6027","Farina, Yang; Baba, Ibrahim; Othman, A. Hamid; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Ng, Seik Weng","Bis[<i>N</i>-(2-hydroxyethyl)-<i>N</i>-methyldithiocarbamato-<i>S</i>,<i>S</i>']diphenyltin","Acta Crystallographica Section E","2001","57","1","m41","m42","10.1107/S1600536800020316","","","0.71073","MoKα","","0.089","0.054","","","","0.146","","","","","","0.98","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2200264","15.061","0.005","6.2184","0.0019","13.908","0.004","90","","114.398","0.005","90","","1186.2","0.6","298","2","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","2,3,7,8-Tetrakis(2-pyridyl)pyrazino-[2,3-g]quinoxaline","","- C30 H18 N8 -","- C30 H18 N8 -","- C60 H36 N16 -","2","0.5","BT6028","Fang, Ya-Yin; Guo, Ya-Mei; Du, Miao; Liu, He; Leng, Xue-Bing; Zhang, Ruo-Hua","2,3,7,8-Tetrakis(2-pyridyl)pyrazino[2,3-<i>g</i>]quinoxaline","Acta Crystallographica Section E","2001","57","5","o380","o382","10.1107/S1600536801005153","","","0.71073","MoKα","","","0.0406","","","","0.1036","","","","","","0.935","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2201953","10.4058","0.0011","6.1448","0.0007","12.9773","0.0014","90","","110.835","0.002","90","","775.53","0.15","130","0.2","130","0.2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C21 H18 Fe2 O -","- C21 H18 Fe2 O -","- C42 H36 Fe4 O2 -","2","0.5","DN6048","Natalie Bratych; Kathryn Hassall; Jonathan White","Redetermination of the structure of diferrocenyl ketone at low temperature","Acta Crystallographica Section E","2003","59","1","m33","m35","10.1107/S1600536802022262","","","0.71073","MoKα","","0.0365","0.0341","","","0.0924","0.0941","","","","","","1.023","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203270","9.8121","0.0009","6.6775","0.0006","15.647","0.001","90","","97.957","0.002","90","","1015.33","0.15","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","4,4'-Bipyridinium 1,5-naphthalenedisulfonate dihydrate","","- C20 H20 N2 O8 S2 -","- C20 H20 N2 O8 S2 -","- C40 H40 N4 O16 S4 -","2","0.5","BT6412","Zhang, Xiu-Lian; Chen, Xiao-Ming; Ng^a^, Seik Weng","4,4'-Bipyridinium 1,5-naphthalenedisulfonate dihydrate","Acta Crystallographica Section E","2004","60","3","o455","o456","10.1107/S1600536804004064","","","0.71073","MoKα","","0.062","0.049","","","0.125","0.134","","","","","","1.07","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203281","14.4063","0.0005","12.6196","0.0006","13.34","0.0005","90","","111.48","0.003","90","","2256.79","0.16","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","chlorobis(1,10-phenanthroline)copper(II) dichlorocuprate(I)","","- C24 H16 Cl3 Cu2 N4 -","- C24 H16 Cl3 Cu2 N4 -","- C96 H64 Cl12 Cu8 N16 -","4","1","CV6258","Yang, Hong-Fang; Huang, Chang-Cang; Zhang, Han-Hui; Liu, Yongxiu; Lian, Zhao-Xun; Xiao,Guang-Can","A new mixed-valence Cu^II^/Cu^I^ complex: chlorobis(1,10-phenanthroline)copper(II) dichlorocuprate(I)","Acta Crystallographica Section E","2004","60","3","m291","m293","10.1107/S1600536804002375","","","0.71069","MoKα","","0.0492","0.0351","","","0.0995","0.11","","","","","","1.007","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2203786","13.071","0.003","8.36","0.001","17.418","0.004","90","","109.01","0.02","90","","1799.5","0.7","293","","293","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","(E)-1-[1-ethoxycarbonyl-2(N-benzylamino)-1-propenyl]benzotriazole.","","- C19 H20 N4 O2 -","- C19 H20 N4 O2 -","- C76 H80 N16 O8 -","4","1","NA6321","Guo-Bin Zhou; Peng-Fei Zhang; Zhen-Chu Chen; Yuan-Jiang Pan","Ethyl (<i>E</i>)-2-(1<i>H</i>-benzotriazol-1-yl)-3-(<i>N</i>-benzylamino)but-2-enoate","Acta Crystallographica Section E","2004","60","6","o1021","o1022","10.1107/S1600536804011250","","","0.7107","MoKα","","","0.042","","","0.051","","","","","1.18","1.18","","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204018","8.6173","0.0015","5.2953","0.0007","15.588","0.003","90","","93.214","0.014","90","","710.2","0.2","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","S,S'-Bis(methoxycarbonylmethyl)dithioglyoxime monohydrate","dimethyl [1,2-bis(hydroxyimino)ethane-1,2-diyl]dithiodiacetate monohydrate","","- C8 H14 N2 O7 S2 -","- C8 H14 N2 O7 S2 -","- C16 H28 N4 O14 S4 -","2","0.5","DN6146","Serkan Soylu; Mehmet Kandaz; Nezihe Çalıs̨kan","S,S'-Bis(methoxycarbonylmethyl)dithioglyoxime monohydrate","Acta Crystallographica, Section E","2004","60","8","o1347","o1349","10.1107/S1600536804015922","","","0.71069","MoKα","","0.0728","0.0584","","","0.1481","0.1566","","","","","","0.934","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2204203","16.927","0.002","4.5244","0.0005","19.673","0.002","90","","105.828","0.005","90","","1449.5","0.3","120","2","120","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","(E)-{[2-(phenyldiazenyl)phenyl]ethylideneaminooxy}acetic acid","","- C16 H15 N3 O3 -","- C16 H15 N3 O3 -","- C64 H60 N12 O12 -","4","1","LH6263","Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Wardell, James L.","Hydrogen-bonded <i>R</i>~2~^2^(8) dimers in (<i>E</i>)-{[2-(phenyldiazenyl)phenyl]ethylideneaminooxy}acetic acid","Acta Crystallographica Section E","2004","60","9","o1560","o1562","10.1107/S1600536804019877","","","0.71073","MoKα","","0.1866","0.0687","","","0.1444","0.1866","","","","","","0.945","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2204213","13.2381","0.0011","7.8171","0.0004","16.5034","0.0014","90","","94.654","0.007","90","","1702.2","0.2","293","2","293","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","Bis[N-(2,6-dimethylphenyl)aminophenylglyoximato-κ^2^N,N']nickel(II) dimethyl sulfoxide solvate","Bis[N-(2,6-dimethylphenyl)aminophenylglyoximato-κ^2^N,N']nickel(II) dimethyl sulfoxide solvate","","- C34 H38 N6 Ni O5 S -","- C34 H38 N6 Ni O5 S -","- C68 H76 N12 Ni2 O10 S2 -","2","0.5","OB6405","Batı, Hümeyra; Zülfikaroğlu, Ayşin; Taş, Murat; Çalışkan, Nezihe; Soylu, Serkan; Andac, Omer; Büyükgüngör, Orhan","Bis[<i>N</i>-(2,6-dimethylphenyl)aminophenylglyoximato-κ^2^<i>N,N</i>']nickel(II) dimethyl sulfoxide solvate","Acta Crystallographica Section E","2004","60","9","m1334","m1336","10.1107/S1600536804020872","","","0.71073","MoKα","","0.0694","0.0366","","","0.0763","0.0844","","","","","","0.912","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2204494","11.7267","0.0004","8.1512","0.0002","16.8433","0.0005","90","","105.612","0.001","90","","1550.6","0.08","90","1","90","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Dicarbonylbis(triphenylphosphine)nickel(0)","","- C38 H30 Ni O2 P2 -","- C38 H30 Ni O2 P2 -","- C76 H60 Ni2 O4 P4 -","2","0.5","FL6122","Moncol, Jan; Gembicky, Milan; Coppens, Phillip","Dicarbonylbis(triphenylphosphine)nickel(0): a redetermination at 90K","Acta Crystallographica Section E","2004","60","11","m1582","m1583","10.1107/S1600536804024377","","","0.71069","MoKα","","0.0328","0.0242","","","0.0708","0.0745","","","","","","1.036","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2204576","9.511","0.003","11.496","0.003","11.528","0.004","90","","125.287","0.005","90","","1028.9","0.6","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","catena-poly[[[tetraaquacobalt(II)]-μ-4,4-bipyridine-κ^2^N:N'] phthalate dihydrate]","","- C18 H24 Co N2 O10 -","- C18 H24.04 Co N2 O10 -","- C36 H48.08 Co2 N4 O20 -","2","0.5","WK6022","Xie, Cheng-Zhi; Zhang, Bao-Feng; Wang, Xiao-Qing; Shen, Guang-Qiu; Shen, De-Zhong","<i>catena</i>-poly[[[tetraaquacobalt(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] phthalate dihydrate]","Acta Crystallographica Section E","2004","60","11","m1703","m1705","10.1107/S1600536804025930","","","0.71073","MoKα","","0.052","0.036","","","0.078","0.084","","","","","","1.037","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204887","8.566","0.006","8.807","0.007","18.729","0.017","90","","101.37","","90","","1385.2","1.9","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","catena-Poly[[(dihydrogenphosphato)silver(I)]-μ-4,4'-bipyridine] dihydrate]","","- C10 H14 Ag N2 O6 P -","- C10 H14 Ag N2 O6 P -","- C40 H56 Ag4 N8 O24 P4 -","4","1","HB6097","Wang, Li-Shi; Yang, Shi-Ping; Zhang, Jin-Feng","<i>catena</i>-Poly[[[(dihydrogenphosphato)silver(I)]-μ-4,4'-bipyridine] dihydrate]","Acta Crystallographica Section E","2005","61","1","m25","m26","10.1107/S1600536804031435","","","0.71073","MoKα","","0.1483","0.0908","","","0.2475","0.3281","","","","","","1.093","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2204966","6.9541","0.0012","11.465","0.002","12.059","0.002","90","","113.547","0.003","90","","881.4","0.3","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","[Fe(bpy)(H~2~O)~4~](bdc)","catena-poly[[[tetraaquairon(II)]-μ-4,4'-bipyridine] benzene-1,4-dicarboxylate]","","- C18 H20 Fe N2 O8 -","- C18 H20 Fe N2 O8 -","- C36 H40 Fe2 N4 O16 -","2","0.5","SJ6033","Halder, Gregory J.; Kepert, Cameron J.","A three-dimensional hydrogen-bonded coordination framework: <i>catena</i>-poly[[[tetraaquairon(II)]-μ-4,4'-bipyridine] benzene-1,4-dicarboxylate]","Acta Crystallographica Section E","2005","61","1","m113","m114","10.1107/S1600536804032192","","","0.71073","MoKα","","0.024","0.0231","","","0.0638","0.0645","","","","","","1.134","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2205275","14.1367","0.0012","7.9021","0.0008","16.8034","0.0016","90","","104.907","0.003","90","","1813.9","0.3","180","2","180","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","N,N-bis(2-pyridiniomethyl)glycine diperchlorate","","- C14 H17 Cl2 N3 O10 -","- C14 H17 Cl2 N3 O10 -","- C56 H68 Cl8 N12 O40 -","4","1","HG6129","Nielsen, Anne; Bond, Andrew D.; McKenzie, Christine J.","<i>N,N</i>-Bis(2-pyridiniomethyl)glycine diperchlorate","Acta Crystallographica Section E","2005","61","3","o516","o517","10.1107/S1600536805002503","","","0.71073","MoKα","","0.0854","0.0531","","","0.1267","0.143","","","","","","1.067","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2206620","14.253","0.0015","4.9385","0.0005","25.868","0.002","90","","119.826","0.002","90","","1579.6","0.3","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Bis(4,4'-bipyridin-1-ium) bis(5-fluorouracil-1-acetate) monohydrate","bis(4,4'-bipyridin-1-ium) bis(5-fluoro-1,2,3,6-tetrahydro-2,6-dioxopyrimidine-3-acetate) monohydrate","","- C32 H28 F2 N8 O9 -","- C32 H28 F2 N8 O9 -","- C64 H56 F4 N16 O18 -","2","0.5","AT6028","Mao-Lin Hu","Bis(4,4'-bipyridin-1-ium) bis(5-fluorouracil-1-acetate) monohydrate","Acta Crystallographica Section E","2005","61","9","o3063","o3065","10.1107/S1600536805026851","","","0.71073","MoKα","","0.099","0.076","","","0.176","0.189","","","","","","1.17","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2206779","11.7937","0.0013","8.1652","0.0009","17.076","0.0019","90","","106.202","0.002","90","","1579.1","0.3","153","2","153","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Dichlorobis(triphenylphosphine)iron(II)","","- C36 H30 Cl2 Fe P2 -","- C36 H30 Cl2 Fe P2 -","- C72 H60 Cl4 Fe2 P4 -","2","0.5","OM6256","Seewald, Oliver; Flörke, Ulrich; Henkel, Gerald","Dichlorobis(triphenylphosphine)iron(II)","Acta Crystallographica Section E","2005","61","9","m1829","m1830","10.1107/S1600536805026206","","","0.71073","MoKα","","0.0467","0.0403","","","0.1037","0.1068","","","","","","1.054","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207100","15.411","0.0018","6.6402","0.0008","14.6523","0.0017","90","","108.898","0.002","90","","1418.6","0.3","292","2","292","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","2,5-Bis(2-methoxyphenyl)furan","","- C18 H16 O3 -","- C18 H16 O3 -","- C72 H64 O12 -","4","1","WW6423","Meng, Xiang-Gao; Wu, An-Xin","2,5-Bis(2-methoxyphenyl)furan","Acta Crystallographica Section E","2005","61","10","o3192","o3193","10.1107/S1600536805027911","","","0.71073","MoKα","","0.0916","0.0528","","","0.1205","0.139","","","","","","1.031","","","","has coordinates,has Fobs","201973","2020-10-21","18:00:00",""
"2207945","9.8647","0.0011","11.3846","0.0009","12.9516","0.0014","90","","107.446","0.005","90","","1387.6","0.2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","catena-Poly[[[bis(2-aminoethanesulfonato-κ^2^N,O)copper(II)]-μ-4,4'- bipyridine-κ^2^N:N'] 4,4'-bipyridine monohydrate]]","","- C24 H30 Cu N6 O7 S2 -","- C24 H30 Cu N6 O7 S2 -","- C48 H60 Cu2 N12 O14 S4 -","2","0.5","XU6086","Jin-Hua Cai; Yi-Min Jiang; Xiu-Ju Yin; Xu-Hui Liu; Xiu-Jian Wang","<i>catena</i>-Poly[[[bis(2-aminoethanesulfonato-κ^2^<i>N</i>,<i>O</i>)copper(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] 4,4'-bipyridine monohydrate]","Acta Crystallographica Section E","2006","62","1","m72","m73","10.1107/S1600536805040900","","","0.71073","MoKα","","0.06","0.047","","","0.093","0.099","","","","","","1.083","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2208186","9.3133","0.0007","15.2753","0.0011","12.8037","0.0009","90","","94.263","0.001","90","","1816.5","0.2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Tris(1,10-phenanthroline)manganese(II) bis(hexafluorophosphate)","","- C36 H24 F12 Mn N6 P2 -","- C36 H24 F12 Mn N6 P2 -","- C72 H48 F24 Mn2 N12 P4 -","2","0.5","TK6305","Hwang, In-Chul; Ha, Kwang","Tris(1,10-phenanthroline)manganese(II) bis(hexafluorophosphate)","Acta Crystallographica Section E","2006","62","2","m376","m378","10.1107/S1600536806002753","","","0.71073","MoKα","","0.131","0.077","","","0.159","0.185","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2208550","17.701","0.004","7.0661","0.0018","14.695","0.004","90","","104.607","0.004","90","","1778.6","0.8","294","2","294","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","3-[(2,4-Dinitrophenyl)hydrazonomethyl]phenol dimethylformamide solvate","","- C16 H17 N5 O6 -","- C16 H17 N5 O6 -","- C64 H68 N20 O24 -","4","1","CI2015","Jing, Zuo-Liang; Sun, Jia-Cui; Chen, Xin; Yu Ming","3-[(2,4-Dinitrophenyl)hydrazonomethyl]phenol dimethylformamide solvate","Acta Crystallographica Section E","2006","62","4","o1202","o1204","10.1107/S1600536806006908","","","0.71073","MoKα","","0.0793","0.0399","","","0.0938","0.1138","","","","","","1.003","","","","has coordinates","201973","2020-10-21","18:00:00",""
"2208986","7.6963","0.0006","11.1028","0.0008","12.9739","0.0008","90","","123.707","0.003","90","","922.25","0.12","273","2","273","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Poly[[diaqua-μ-1,2-benzene-1,2-dicarboxylato-μ-4,4'-bipyridinecopper(II)] dihydrate]","","- C18 H20 Cu N2 O8 -","- C18 H20 Cu N2 O8 -","- C36 H40 Cu2 N4 O16 -","2","0.5","SA2002","Xu, Han; Sun, Ran; Li, Yi-Zhi; Bai, Jun-Feng","Poly[[diaqua-μ-1,2-benzene-1,2-dicarboxylato-μ-4,4'-bipyridine-copper(II)] dihydrate]: a two-dimensional copper(II) polymer","Acta Crystallographica Section E","2006","62","5","m1156","m1158","10.1107/S1600536806014711","","","0.71073","MoKα","","0.0674","0.0541","","","0.1221","0.1256","","","","","","1.095","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2209086","6.2993","0.0013","6.7205","0.0013","11.962","0.002","90","","98.71","0.03","90","","500.56","0.17","293","2","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Niobium selenide trichloride","","- Cl3 Nb Se -","- Cl3 Nb Se -","- Cl12 Nb4 Se4 -","4","1","BR2006","Meerschaut, Alain","Niobium selenide trichloride, NbSeCl~3~","Acta Crystallographica Section E","2006","62","6","i131","i132","10.1107/S1600536806016242","","","0.71073","MoKα","","0.064","0.0391","","","0.0686","0.0733","","","","","","0.986","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2209196","3.7354","0.0007","12.099","0.002","13.129","0.003","90","","91.33","0.03","90","","593.2","0.2","292","2","292","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","catena-Poly[[(pyrazino[2,3-f][1,10]phenanthroline)copper(I)]-μ~2~-chloro]","","- C14 H8 Cl Cu N4 -","- C14 H8 Cl Cu N4 -","- C28 H16 Cl2 Cu2 N8 -","2","0.5","HB2061","Guang-Bo Che; Zhan-Lin Xu; Chun-Bo Liu","<i>catena</i>-Poly[[(pyrazino[2,3-<i>f</i>][1,10]phenanthroline)copper(I)]-μ~2~-chloro]","Acta Crystallographica Section E","2006","62","6","m1370","m1372","10.1107/S1600536806018733","","","0.71073","MoKα","","0.0561","0.0392","","","0.0961","0.1031","","","","","","1.082","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2209281","18.376","0.0004","9.5325","0.0002","18.7776","0.0004","90","","100.388","0.001","90","","3235.34","0.12","120","2","120","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Si(Ar''')4","Tetrakis[3,5-bis(trifluoromethyl)phenyl]silane","","- C32 H12 F24 Si -","- C32 H12 F24 Si -","- C128 H48 F96 Si4 -","4","1","RN2003","Agnew, Caroline; Dillon, Keith B.; Goeta, Andrés E.; Thompson, Amber L.","Tetrakis[3,5-bis(trifluoromethyl)phenyl]silane","Acta Crystallographica Section E","2006","62","6","o2344","o2346","10.1107/S1600536806017417","","","0.71073","MoKα","","0.0823","0.0514","","","0.1344","0.1577","","","","","","1.02","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2209809","11.502","0.008","6.032","0.004","16.359","0.008","90","","131.47","0.03","90","","850.4","1","295","2","295","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","catena-Poly[[silver-μ-piperazine-κ^2^N:N'] perchlorate]","","- C4 H10 Ag Cl N2 O4 -","- C4 H10 Ag Cl N2 O4 -","- C16 H40 Ag4 Cl4 N8 O16 -","4","1","CI2122","Liu, Ju-Tao; Ng, Seik Weng","<i>catena</i>-Poly[[silver-μ-piperazine-κ^2^<i>N</i>:<i>N</i>'] perchlorate]","Acta Crystallographica Section E","2006","62","8","m1992","m1993","10.1107/S1600536806028753","","","0.71073","MoKα","","0.066","0.057","","","0.185","0.188","","","","","","1.21","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2210226","7.7141","0.0008","7.7252","0.0008","13.0299","0.0013","90","","93.403","0.002","90","","775.12","0.14","130","2","130","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","guanidinium pyrazine-2,3-dicarboxylate trihydrate","Bis(guanidinium) pyrazine-2,3-dicarboxylate trihydrate","","- C8 H20 N8 O7 -","- C8 H20 N8 O7 -","- C16 H40 N16 O14 -","2","0.5","FL2044","Graham Smith; Urs D. Wermuth; David J. Young; Jonathan M. White","Bis(guanidinium) pyrazine-2,3-dicarboxylate trihydrate","Acta Crystallographica Section E","2006","62","9","o3912","o3914","10.1107/S1600536806031047","","","0.71073","MoKα","","0.035","0.0311","","","0.0832","0.0851","","","","","","1.103","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2210732","18.621","0.005","10.254","0.005","23.481","0.005","90","","105.456","0.005","90","","4321","3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Di-μ~2~-acetato-bis[(tri-p-tolylphosphine)silver(I)]","","- C46 H48 Ag2 O4 P2 -","- C46 H48 Ag2 O4 P2 -","- C184 H192 Ag8 O16 P8 -","4","1","NG2103","Meijboom, Reinout","Di-μ-acetato-bis[(tri-<i>p</i>-tolylphosphine)silver(I)]","Acta Crystallographica Section E","2006","62","10","m2698","m2700","10.1107/S1600536806037846","","","0.71069","MoKα","","","0.0453","","","","0.1264","","","","","","1.003","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211151","13.799","0.003","4.8292","0.001","13.206","0.003","90","","103.88","0.03","90","","854.3","0.3","193","2","193","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","3,5-Dichloroanthranilic hydroxamic acid","2-Amino-3,5-dichlorobenzohydroxamic acid","","- C7 H6 Cl2 N2 O2 -","- C7 H6 Cl2 N2 O2 -","- C28 H24 Cl8 N8 O8 -","4","1","OB2081","Nagarajan Vembu; Jean Lee; John G. Kelly; Kevin B. Nolan; Marc Devocelle","2-Amino-3,5-dichlorobenzohydroxamic acid: supramolecular aggregation through two-dimensional networks of O—H···N/O and N—H···O/Cl interactions","Acta Crystallographica Section E","2006","62","11","o5086","o5088","10.1107/S1600536806042395","","","0.71073","MoKα","","0.0628","0.0389","","","0.0909","0.0978","","","","","","1.093","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211174","8.5","0.003","5.95","0.002","15.665","0.004","90","","116.204","0.015","90","","710.8","0.4","298","2","298","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","(3-Ammonio-2-hydroxypropyl)carbamate monohydrate","","- C4 H12 N2 O4 -","- C4 H12 N2 O4 -","- C16 H48 N8 O16 -","4","1","RZ2080","Shi, Peng-Fei; Xu, Tong-Tao; Xu, Xing-You; Niu, Shao-Rui","(3-Ammonio-2-hydroxypropyl)carbamate monohydrate","Acta Crystallographica Section E","2006","62","11","o5191","o5193","10.1107/S1600536806043200","","","0.71073","MoKα","","0.0863","0.0512","","","0.1256","0.1486","","","","","","1.007","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211377","7.939","0.0016","5.7474","0.0011","18.736","0.004","90","","94.69","0.03","90","","852","0.3","295","2","295","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Diaquabis(4-formylbenzoato-κO)zinc(II) monohydrate","","- C16 H16 O9 Zn -","- C16 H16 O9 Zn -","- C32 H32 O18 Zn2 -","2","0.5","EZ2050","Deng, Zhao-Peng; Gao, Shan; Huo, Li-Hua; Zhao, Hui","Diaquabis(4-formylbenzoato-κ<i>O</i>)zinc(II) monohydrate","Acta Crystallographica Section E","2006","62","12","m3524","m3526","10.1107/S1600536806049828","","","0.71073","MoKα","","0.028","0.026","","","0.073","0.074","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211489","17.8144","0.0008","7.4999","0.0008","7.9125","0.0008","90","","102.203","0.002","90","","1033.27","0.16","223","2","223","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","1,2,4,5-tetraiodobenzene","1,2,4,5-tetraiodobenzene","","- C6 H2 I4 -","- C6 H2 I4 -","- C24 H8 I16 -","4","1","KP2054","Novak, Igor; Li, DongBo","1,2,4,5-Tetraiodobenzene","Acta Crystallographica Section E","2006","62","12","o5736","o5737","10.1107/S1600536806048823","","","0.71073","MoKα","","0.0562","0.0454","","","0.1046","0.1097","","","","","","1.044","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211667","8.2138","0.0012","11.2601","0.0016","16.79","0.002","90","","93.277","0.002","90","","1550.3","0.4","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C30 H26 N12 Ni O6 -","- C30 H26 N12 Ni O6 -","- C60 H52 N24 Ni2 O12 -","2","0.5","WW2052","Yan, Guo-Bing","Bis[2,6-bis(2-pyridylamino)pyridine]nickel(II) dinitrate","Acta Crystallographica Section E","2006","62","12","m3551","m3553","10.1107/S1600536806049919","","","0.71073","MoKα","","0.0599","0.0508","","","0.1407","0.1479","","","","","","1.003","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211746","7.0527","0.0004","5.5465","0.0002","14.0317","0.0006","90","","121.544","0.004","90","","467.78","0.04","298","1","298","1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Diethylammonium hydrogen oxalate","","- C6 H13 N O4 -","- C6 H13 N O4 -","- C12 H26 N2 O8 -","2","0.5","BT2217","Ejsmont, Krzysztof","Diethylammonium hydrogen oxalate","Acta Crystallographica Section E","2007","63","1","o107","o109","10.1107/S1600536806051932","","","0.71073","MoKα","","0.0448","0.0387","","","0.1103","0.1165","","","","","","1.09","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211865","20.0313","0.0006","12.0577","0.0004","20.0379","0.0007","90","","107.382","0.002","90","","4618.8","0.3","100","0.1","100","0.1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","2-(benzimidazol-2-yl)-6-methoxyphenol","","- C14 H12 N2 O2 -","- C14 H12 N2 O2 -","- C224 H192 N32 O32 -","16","4","IS2122","Naser Eltaher Eltayeb; Siang Guan Teoh; Jeannie Bee-Jan Teh; Hoong-Kun Fun; Kamarulazizi Ibrahim","Second monoclinic polymorph of 2-(benzimidazol-2-yl)-6-methoxyphenol","Acta Crystallographica Section E","2007","63","1","o300","o302","10.1107/S1600536806052792","","","0.71073","MoKα","","0.1311","0.091","","","0.2056","0.223","","","","","","1.163","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211971","14.1699","0.0013","4.2915","0.0004","16.1565","0.0013","90","","96.801","0.007","90","","975.57","0.15","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","5,7-Diiodoquinolin-8-ol","","- C9 H5 I2 N O -","- C9 H5 I2 N O -","- C36 H20 I8 N4 O4 -","4","1","WW2049","Butt, M. Saeed; Akhter, Zareen; Bolte, Michael; Siddiqi, Humaira M.","5,7-Diiodoquinolin-8-ol","Acta Crystallographica Section E","2007","63","1","o15","o16","10.1107/S1600536806050690","","","0.71073","MoKα","","0.0324","0.0308","","","0.0761","0.0771","","","","","","1.174","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212148","21.5559","0.0011","3.6473","0.0001","19.4851","0.0008","90","","115.752","0.004","90","","1379.79","0.11","120","2","120","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","2-Aminopyridinium nitrate","","- C5 H7 N3 O3 -","- C5 H7 N3 O3 -","- C40 H56 N24 O24 -","8","2","ER2017","Rademeyer, Melanie","2-Aminopyridinium nitrate","Acta Crystallographica Section E","2007","63","2","o545","o546","10.1107/S1600536806055693","","","0.71073","MoKα","","0.0647","0.04","","","0.1099","0.1217","","","","","","1.046","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2212175","10.358","0.001","6.183","0.001","20.726","0.001","90","","92.48","0.01","90","","1326.1","0.3","119","2","119","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","N,N,N',N'-Tetrakis(carboxymethyl)-2,2'-(ethylenedioxy)dianilinium dichloride dihydrate","","- C22 H30 Cl2 N2 O12 -","- C22 H30 Cl2 N2 O12 -","- C44 H60 Cl4 N4 O24 -","2","0.5","GK2053","John W. Raynor; Maksymilian Chruszcz; Wladek Minor","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetrakis(carboxymethyl)-2,2'-(ethylenedioxy)dianilinium dichloride dihydrate","Acta Crystallographica Section E","2007","63","2","o754","o756","10.1107/S1600536807001559","","","0.71074","MoKα","","0.0437","0.0342","","","0.0929","0.0975","","","","","","1.074","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212447","16.213","0.004","7.1194","0.0014","17.748","0.004","90","","118.418","0.017","90","","1801.7","0.8","294","2","294","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Tetrakis[(1-phenyltetrazol-5-yl)sulfanylmethyl]methane","","- C33 H28 N16 S4 -","- C33 H28 N16 S4 -","- C66 H56 N32 S8 -","2","0.5","BG2022","Lyakhov, Alexander S.; Zatsepina, Marina V.; Artamonova, Tatiana V.; Gaponik, Pavel N.; Koldobskii, Grigorii I.","Tetrakis[(1-phenyltetrazol-5-yl)sulfanylmethyl]methane","Acta Crystallographica Section E","2007","63","3","o1145","o1147","10.1107/S1600536807004400","","","0.71073","MoKα","","0.0613","0.039","","","0.1051","0.1226","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213370","19.287","0.001","6.7697","0.0004","14.2238","0.0004","90","","91.444","0.001","90","","1856.57","0.16","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Bis(acetato-κO)triaquacadmium dihydrate 2-amino-4,6-dimethylpyrimidine tetrasolvate dihydrate","","- C28 H52 Cd N12 O9 -","- C28 H52 Cd N12 O9 -","- C56 H104 Cd2 N24 O18 -","2","0.5","HB2393","Fang, Hua; Ng, Seik Weng","Bis(acetato-κ<i>O</i>)triaquacadmium 2-amino-4,6-dimethylpyrimidine tetrasolvate dihydrate","Acta Crystallographica Section E","2007","63","5","m1523","m1524","10.1107/S1600536807020545","","","0.71073","MoKα","","0.061","0.052","","","0.133","0.145","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213799","14.829","0.003","7.2111","0.0014","23.976","0.005","90","","95","0.03","90","","2554.1","0.9","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","catena-Poly[[[aqua(pyrazino[2,3-f][1,10]phenanthroline)copper(II)]-μ- benzene-1,3-dicarboxylato] N,N-dimethylacetamide monohydrate]","","- C26 H25 Cu N5 O7 -","- C26 H25 Cu N5 O7 -","- C104 H100 Cu4 N20 O28 -","4","1","HB2408","Wen-Zhi Zhang","<i>catena</i>-Poly[[[aqua(pyrazino[2,3-<i>f</i>][1,10]phenanthroline)copper(II)]-μ-benzene-1,3-dicarboxylato] <i>N</i>,<i>N</i>-dimethylacetamide monohydrate]","Acta Crystallographica Section E","2007","63","6","m1692","m1693","10.1107/S1600536807023082","","","0.71073","MoKα","","0.0945","0.0675","","","0.1708","0.1838","","","","","","1.066","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213879","9.887","0.004","8.177","0.004","17.791","0.007","90","","108.612","0.019","90","","1363.1","1","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","(Acetato-κ^2^O,O')bis(1,10-phenanthroline-κ^2^N,N')cadmium(II) perchlorate dihydrate","","- C26 H23 Cd Cl N4 O8 -","- C26 H23 Cd Cl N4 O8 -","- C52 H46 Cd2 Cl2 N8 O16 -","2","0.5","LH2380","Hu, Bo; Wang, Min; Lan, Shen-Min; Wang, Xiao-Yan; Deng, Xiao-Tao","(Acetato-κ^2^<i>O</i>,<i>O</i>')bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II) perchlorate dihydrate","Acta Crystallographica Section E","2007","63","6","m1676","m1676","10.1107/S1600536807022908","","","0.71073","MoKα","","0.0697","0.0587","","","0.1479","0.1554","","","","","","1.047","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2214109","11.339","0.002","9.2995","0.0019","19.395","0.004","90","","97.79","0.03","90","","2026.3","0.7","293","","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","μ-Oxalato-κ^4^O^1^,O^2^:O^1'^,O^2'^-bis{[N,N'-bis(pyridin-2- ylmethylene)propane-1,2-diamine-κ^4^- N,N',N'',N''']copper(II)} bis(perchlorate)","","- C32 H32 Cl2 Cu2 N8 O12 -","- C32 H32 Cl2 Cu2 N8 O12 -","- C64 H64 Cl4 Cu4 N16 O24 -","2","0.5","CF2095","Tian-Fu Liu","μ-Oxalato-κ^4^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^1'^,<i>O</i>^2'^-bis{[<i>N</i>,<i>N</i>'-bis(pyridin-2-ylmethylene)propane-1,2-diamine-κ^4^-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']copper(II)} bis(perchlorate)","Acta Crystallographica Section E","2007","63","7","m1856","m1858","10.1107/S1600536807022659","","","0.71073","MoKα","","0.1081","0.0557","","","0.1331","0.1467","","","","","","0.859","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214369","21.1172","0.0018","16.8787","0.0014","12.0819","0.001","90","","105.531","0.001","90","","4149.1","0.6","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Bis[N-ethyl-N'-(pyridin-2-ylmethylene)ethane-1,2-diamine]nickel(II) bis(perchlorate)","","- C20 H30 Cl2 N6 Ni O8 -","- C20 H30 Cl2 N6 Ni O8 -","- C120 H180 Cl12 N36 Ni6 O48 -","6","1.5","OM2138","Zhe Hong","Bis[<i>N</i>-ethyl-<i>N</i>'-(pyridin-2-ylmethylene)ethane-1,2-diamine]nickel(II) bis(perchlorate)","Acta Crystallographica Section E","2007","63","7","m2026","m2026","10.1107/S160053680703108X","","","0.71073","MoKα","","0.097","0.0586","","","0.1609","0.1894","","","","","","0.989","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214831","11.6817","0.0004","5.5845","0.0002","16.4627","0.0006","90","","122.372","0.003","90","","907.06","0.06","170","2","170","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","<i>N</i>,<i>N</i>,<i>N'</i>,<i>N'</i>-tetrakis(carboxymethyl)ethylenediammonium dichloride trihydrate","","- C10 H24 Cl2 N2 O11 -","- C10 H24 Cl2 N2 O11 -","- C20 H48 Cl4 N4 O22 -","2","0.5","PV2016","Kaluđerović, Goran N.; Gómez-Ruiz, Santiago; Schmidt, Harry; Steinborn, Dirk","A monoclinic form of <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetrakis(carboxymethyl)ethylenediammonium dichloride trihydrate","Acta Crystallographica Section E","2007","63","8","o3491","o3491","10.1107/S1600536807033569","","","0.71073","MoKα","","0.064","0.0335","","","0.0679","0.0749","","","","","","0.916","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215761","11.109","0.002","6.0063","0.0012","22.871","0.005","90","","90.54","0.03","90","","1526","0.5","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","<i>catena</i>-Poly[[[aquabis[3-(4-carboxyphenoxy)propionato- κ^2^<i>O</i>,O']zinc(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] dihydrate]","","- C30 H32 N2 O13 Zn -","- C30 H32 N2 O13 Zn -","- C60 H64 N4 O26 Zn2 -","2","0.5","BG2117","Li-Li Kong; Shan Gao; Li-Hua Huo","<i>catena</i>-Poly[[[aquabis[3-(4-carboxyphenoxy)propionato-κ^2^<i>O</i>,<i>O</i>']zinc(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] dihydrate]","Acta Crystallographica Section E","2007","63","11","m2791","m2792","10.1107/S1600536807050611","","","0.71073","MoKα","","0.0801","0.0391","","","0.0906","0.1176","","","","","","1.116","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215890","10.7704","0.0009","13.1196","0.0011","19.6427","0.0014","90","","115.63","0.004","90","","2502.5","0.4","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Bis[<i>N</i>^3^-(2-hydroxybenzoyl)pyridine-2-carboxamidrazonato- κ^3^N^1^,N^2^,O]zinc(II)","","- C26 H22 N8 O4 Zn -","- C26 H22 N8 O4 Zn -","- C104 H88 N32 O16 Zn4 -","4","1","DN2252","Li, Yong","Bis[<i>N</i>^3^-(2-hydroxybenzoyl)pyridine-2-carboxamidrazonato-κ^3^<i>N</i>^1^,<i>N</i>^2^,<i>O</i>]zinc(II)","Acta Crystallographica Section E","2007","63","11","m2837","m2837","10.1107/S1600536807052750","","","0.71073","MoKα","","0.0376","0.0347","","","0.0958","0.0978","","","","","","1.058","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216731","7.7633","0.0019","10.597","0.004","15.14","0.004","90","","108.136","0.019","90","","1183.7","0.6","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Tetraaquatetraureaneodymium(III) triiodide","","- C4 H24 I3 N8 Nd O8 -","- C4 H24 I3 N8 Nd O8 -","- C8 H48 I6 N16 Nd2 O16 -","2","0.5","RK2058","Ludmila Yu. Alikberova; Dmitry V. Albov; Denis V. Golubev; Valery V. Kravchenko; Nataliya S. Rukk","Tetraaquatetraureaneodymium(III) triiodide","Acta Crystallographica Section E","2007","63","12","m3078","m3078","10.1107/S1600536807058643","","","0.71073","MoKα","","0.0545","0.0345","","","0.0644","0.0696","","","","","","0.997","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216895","12.4402","0.0008","5.8608","0.0004","19.724","0.0013","90","","90.223","0.001","90","","1438.06","0.16","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","1-(1,3-Benzothiazol-2-yl)-3-benzoylthiourea","","- C15 H11 N3 O S2 -","- C15 H11 N3 O S2 -","- C60 H44 N12 O4 S8 -","4","1","BH2150","Yunus, Uzma; Tahir, Muhammad Kalim; Bhatti, Moazzam Hussain; Ali, Saqib; Wong, Wai-Yeung","1-(1,3-Benzothiazol-2-yl)-3-benzoylthiourea","Acta Crystallographica Section E","2008","64","1","o20","o20","10.1107/S160053680706134X","","","0.71073","MoKα","","0.0505","0.0354","","","0.0932","0.1024","","","","","","1.038","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2217018","10.7661","0.0016","13.049","0.002","19.998","0.003","90","","116.192","0.007","90","","2521","0.7","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Bis[<i>N</i>^3^-(2-hydroxybenzoyl)pyridine-2-carboxamidrazonato- κ^3^<i>N</i>^1^,<i>N</i>^2^,<i>O</i>]manganese(II)","","- C26 H22 Mn N8 O4 -","- C26 H22 Mn N8 O4 -","- C104 H88 Mn4 N32 O16 -","4","1","DN2292","Li, Yong","Bis[<i>N</i>^3^-(2-hydroxybenzoyl)pyridine-2-carboxamidrazonato-κ^3^<i>N</i>^1^,<i>N</i>^2^,<i>O</i>]manganese(II)","Acta Crystallographica Section E","2008","64","1","m50","m50","10.1107/S1600536807063301","","","0.71073","MoKα","","0.045","0.0394","","","0.1071","0.1095","","","","","","1.067","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2217038","6.9516","0.0016","11.309","0.003","12.047","0.003","90","","113.439","0.011","90","","868.9","0.4","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Poly[[[tetraaquacobalt(II)]-μ-bipyridine] terephthalate]","","- C18 H20 Co N2 O8 -","- C18 H20 Co N2 O8 -","- C36 H40 Co2 N4 O16 -","2","0.5","FJ2081","Haiyun Xu","Poly[[[tetraaquacobalt(II)]-μ-bipyridine] terephthalate]","Acta Crystallographica Section E","2008","64","1","m103","m103","10.1107/S1600536807064045","","","0.71073","MoKα","","0.0417","0.0354","","","0.0832","0.0855","","","","","","1.004","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2217328","16.039","0.007","6.087","0.003","18.096","0.008","90","","94.78","0.008","90","","1760.6","1.4","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","<i>N</i>-(Biphenyl-4-carbonyl)-<i>N</i>'-(4-chlorophenyl)thiourea","","- C20 H15 Cl N2 O S -","- C20 H15 Cl N2 O S -","- C80 H60 Cl4 N8 O4 S4 -","4","1","SU2027","Yamin, Bohari M.; Arif, M. Asyikin M.","<i>N</i>-(Biphenyl-4-carbonyl)-<i>N</i>'-(4-chlorophenyl)thiourea","Acta Crystallographica Section E","2008","64","1","o104","o104","10.1107/S1600536807062265","","","0.71073","MoKα","","0.085","0.049","","","0.108","0.122","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2217408","7.616","0.0015","11.372","0.002","12.954","0.004","90","","123.63","0.02","90","","934.2","0.4","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Poly[[diaqua-μ~2~-4,4'-bipyridyl-μ~2~-o-phthalato-nickel(II)] dihydrate]","","- C18 H20 N2 Ni O8 -","- C18 H20 N2 Ni O8 -","- C36 H40 N4 Ni2 O16 -","2","0.5","BG2157","Zhang, Xiao; Yi, ZhiHui; Xia, Wujiong; Yang, Chao; Li, Bing","Poly[[diaqua-μ~2~-4,4'-bipyridyl-μ~2~-<i>o</i>-phthalato-nickel(II)] dihydrate]","Acta Crystallographica Section E","2008","64","2","m345","m346","10.1107/S1600536807064562","","","0.71073","MoKα","","0.0318","0.0297","","","0.0897","0.0906","","","","","","1.123","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2217500","14.742","0.008","6.899","0.004","15.292","0.008","90","","110.98","0.009","90","","1452.2","1.4","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","trans-Tetraaquabis(nicotinamide-κN)cadmium(II) biphenyl-4,4'-disulfonate","","- C24 H28 Cd N4 O12 S2 -","- C24 H28 Cd N4 O12 S2 -","- C48 H56 Cd2 N8 O24 S4 -","2","0.5","FJ2097","Chunyuan Li; Min Chen; Changlun Shao","<i>trans</i>-Tetraaquabis(nicotinamide-κ<i>N</i>)cadmium(II) biphenyl-4,4'-disulfonate","Acta Crystallographica Section E","2008","64","2","m424","m424","10.1107/S1600536808002390","","","0.71073","MoKα","","0.0337","0.0304","","","0.0876","0.0917","","","","","","1.07","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2217515","11.029","0.003","7.3925","0.0018","10.165","0.003","90","","112.149","0.003","90","","767.6","0.4","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Poly[[diaqua-μ~4~-tartrato-μ~2~-tartrato-dimanganese(II)] dihydrate]","","- C4 H8 Mn O8 -","- C4 H8 Mn O8 -","- C16 H32 Mn4 O32 -","4","1","HB2676","Ge, Chunhua; Zhao, Zhen; Han, Guangxi; Zhang, Xiangdong","Poly[[diaqua-μ~4~-tartrato-μ~2~-tartrato-dimanganese(II)] dihydrate]","Acta Crystallographica Section E","2008","64","2","m360","m360","10.1107/S1600536807067839","","","0.71073","MoKα","","0.0275","0.0271","","","0.0735","0.0738","","","","","","1.105","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2217616","10.662","0.003","6.9165","0.0018","21.335","0.005","90","","101.146","0.004","90","","1543.6","0.7","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Poly[[tetraaquabis(1H-imidazole-κN^3^)bis[2- (oxaloamino)benzoato(3-)]dicopper(II)barium(II)] dihydrate]","","- C24 H28 Ba Cu2 N6 O16 -","- C24 H24 Ba Cu2 N6 O16 -","- C48 H48 Ba2 Cu4 N12 O32 -","2","0.5","PK2076","Chongzhen Mei; Kaihui Li; Peng Zhang","Poly[[tetraaquabis(1<i>H</i>-imidazole-κ<i>N</i>^3^)bis[2-(oxaloamino)benzoato(3‒)]dicopper(II)barium(II)] dihydrate]","Acta Crystallographica Section E","2008","64","2","m356","m356","10.1107/S1600536808000597","","","0.71073","MoKα","","0.0412","0.0352","","","0.0863","0.0892","","","","","","1.007","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2217671","10.0966","0.0007","12.3483","0.0006","28.8133","0.0017","90","","97.73","0.006","90","","3559.7","0.4","120","2","120","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Aqua(4-methylquinoline-κN)[<i>N</i>-(2-oxidobenzylidene)glycinato- κ^3^O,N,O']copper(II) hemihydrate","","- C19 H19 Cu N2 O4.5 -","- C19 H19 Cu N2 O4.5 -","- C152 H152 Cu8 N16 O36 -","8","2","TK2236","Trávníček, Zdeněk; Marek, Jaromír; Vančo, Ján; Švajlenová, Oľga","Aqua(4-methylquinoline-κ<i>N</i>)[<i>N</i>-(2-oxidobenzylidene)glycinato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']copper(II) hemihydrate","Acta Crystallographica Section E","2008","64","2","m282","m283","10.1107/S1600536807067852","","","0.71073","MoKα","","0.082","0.047","","","0.101","0.113","","","","","","1.09","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2217990","12.8198","0.0017","5.5273","0.0008","19.945","0.003","90","","106.48","0.002","90","","1355.2","0.3","173","2","173","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","1,3-Diphenylisobenzofuran","1,3-diphenyl-2-benzofuran","","- C20 H14 O -","- C20 H14 O -","- C80 H56 O4 -","4","1","PV2071","Boeré, René T.; Dibble, Peter W.; Fischer, Kristapher E.","1,3-Diphenylisobenzofuran","Acta Crystallographica Section E","2008","64","4","o686","","10.1107/S1600536808006016","","","0.71073","MoKα","","0.1068","0.0467","","","0.0861","0.1046","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2218477","8.1672","0.0007","6.7538","0.0004","12.5451","0.001","90","","127.077","0.005","90","","552.08","0.08","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Europium(III) bromide hexahydrate","Hexaaquadibromidoeuropium(III) bromide","","- Br3 Eu H12 O6 -","- Br3 Eu H12 O6 -","- Br6 Eu2 H24 O12 -","2","0.5","MG2051","Hoch, Constantin; Simon, Arndt","Hexaaquadibromidoeuropium(III) bromide, [EuBr~2~(H~2~O)~6~]Br","Acta Crystallographica Section E","2008","64","6","i35","","10.1107/S1600536808014359","","","0.71073","MoKα","","0.0378","0.0281","","","0.0471","0.0488","","","","","","1.111","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2218558","33.161","0.017","6.06","0.003","9.926","0.005","90","","95.594","0.009","90","","1985.2","1.7","297","2","297","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Di-<i>tert</i>-butyl N,N'-(octahydropentalene-2,5-diyl)dicarbamate","","- C18 H32 N2 O4 -","- C18 H32 N2 O4 -","- C72 H128 N8 O16 -","4","1","WK2086","Kendhale, Amol M.; Gonnade, Rajesh G.; Sanjayan, Gangadhar J.","Di-<i>tert</i>-butyl <i>N</i>,<i>N</i>'-(octahydropentalene-2,5-diyl)dicarbamate","Acta Crystallographica Section E","2008","64","6","o1149","","10.1107/S1600536808014876","","","0.71073","MoKα","","0.0679","0.0559","","","0.1264","0.1331","","","","","","1.08","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2219305","16.127","0.006","5.1535","0.0017","13.405","0.008","90","","92.76","0.02","90","","1112.8","0.9","291","2","291","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","<i>catena</i>-Poly[[[diaquacopper(II)]-{μ-4,4'-[1,4- phenylenebis(methyleneimino)]dibenzoato}] monohydrate]","","- C22 H24 Cu N2 O7 -","- C22 H24 Cu N2 O7 -","- C44 H48 Cu2 N4 O14 -","2","0.5","CV2427","Wang, Qiu-sheng; Ouyang, Jie","<i>catena</i>-Poly[[[diaquacopper(II)]-{μ-4,4'-[1,4-phenylenebis(methyleneimino)]dibenzoato}] monohydrate]","Acta Crystallographica Section E","2008","64","9","m1118","","10.1107/S1600536808024379","","","0.71073","MoKα","","0.0578","0.0425","","","0.1284","0.1397","","","","","","1.034","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2220085","7.4677","0.0005","13.2402","0.0009","19.3937","0.0012","90","","109.165","0.002","90","","1811.3","0.2","292","2","292","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","Diaquasodium(I) perchlorate bis[μ-2-(carboxylatomethyliminomethyl)phenolato]bis[(3- methylpyridine)copper(II)]","","- C30 H32 Cl Cu2 N4 Na O12 -","- C30 H32 Cl Cu2 N4 Na O12 -","- C60 H64 Cl2 Cu4 N8 Na2 O24 -","2","0.5","BI2318","Wen, Xiangru; Liu, Yongmin; Li, Zhengyi","Diaquasodium(I) perchlorate bis[μ-2-(carboxylatomethyliminomethyl)phenolato]bis[(3-methylpyridine)copper(II)]","Acta Crystallographica Section E","2008","64","12","m1634","","10.1107/S1600536808039561","","","0.71073","MoKα","","0.0573","0.0446","","","0.0967","0.0999","","","","","","1.125","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2220133","9.2837","0.0011","10.3786","0.0013","18.824","0.002","90","","101.372","0.002","90","","1778.1","0.4","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","catena-Poly[[(1,10-phenanthroline)manganese(II)]-μ~3~-5-methylisophthalato]","","- C21 H14 Mn N2 O4 -","- C21 H14 Mn N2 O4 -","- C84 H56 Mn4 N8 O16 -","4","1","CV2471","Yu, Zhao-Lian; Hu, Jiang-Liang","<i>catena</i>-Poly[[(1,10-phenanthroline)manganese(II)]-μ~3~-5-methylisophthalato]","Acta Crystallographica Section E","2008","64","12","m1522","","10.1107/S1600536808036362","","","0.71073","MoKα","","0.0768","0.0415","","","0.0814","0.0966","","","","","","1.018","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2220236","13.192","0.003","8.817","0.0018","30.012","0.006","90","","102.42","0.03","90","","3409.1","1.3","294","2","294","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","5-(4-Chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-1<i>H</i>-pyrazole-3- carboxylic acid","","- C17 H11 Cl3 N2 O2 -","- C17 H11 Cl3 N2 O2 -","- C136 H88 Cl24 N16 O16 -","8","2","HK2574","Wang, Wei; Fang, Zheng","5-(4-Chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-1<i>H</i>-pyrazole-3-carboxylic acid","Acta Crystallographica Section E","2008","64","12","o2413","","10.1107/S1600536808038105","","","0.71073","MoKα","","0.1595","0.0721","","","0.1452","0.1813","","","","","","0.985","","","","has coordinates,has Fobs","201978","2020-10-21","18:00:00",""
"2220625","11.3772","0.0014","8.5734","0.001","16.2189","0.0016","90","","124.119","0.006","90","","1309.7","0.3","291","2","291","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","<i>trans</i>-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'- Tetrakis(carboxymethyl)cyclohexane-1,2-diammonium tetrachloridocadmium(II) tetrahydrate","","- C14 H32 Cd Cl4 N2 O12 -","- C14 H32 Cd Cl4 N2 O12 -","- C28 H64 Cd2 Cl8 N4 O24 -","2","0.5","SI2140","Lian, Ping; Hu, Qiao-Sheng; Xie, Yong-Rong; Guo, Hong-Xu","<i>trans</i>-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetrakis(carboxymethyl)cyclohexane-1,2-diammonium tetrachloridocadmium(II) tetrahydrate","Acta Crystallographica Section E","2009","65","1","m32","m33","10.1107/S160053680804110X","","","0.7107","MoKα","","0.0267","0.0254","","","0.0683","0.0691","","","","","","1.014","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2221079","10.763","0.002","7.254","0.0015","17.53","0.004","90","","97.93","0.03","90","","1355.6","0.5","293","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","2-Isobutyl-2-phosphabicyclo[3.3.1]nonane 2-selenide","","- C12 H23 P Se -","- C12 H23 P Se -","- C48 H92 P4 Se4 -","4","1","HB2909","Bungu, Peter N.; Otto, Stefanus","2-Isobutyl-2-phosphabicyclo[3.3.1]nonane 2-selenide","Acta Crystallographica Section E","2009","65","3","o560","o561","10.1107/S1600536809005492","","","0.71073","MoKα","","0.1395","0.0586","","","0.1483","0.1813","","","","","","1.022","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2221237","13.496","0.001","4.931","0.001","12.357","0.001","90","","113.352","0.001","90","","754.98","0.17","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","<i>catena</i>-Poly[[diaquazinc(II)]-μ-4,4'-(methylenedioxy)dibenzoato]","","- C15 H14 O8 Zn -","- C15 H14 O8 Zn -","- C30 H28 O16 Zn2 -","2","0.5","AT2728","Xu, Lei; Guo, Yingna; Yuan, Xing","<i>catena</i>-Poly[[diaquazinc(II)]-μ-4,4'-(methylenedioxy)dibenzoato]","Acta Crystallographica Section E","2009","65","4","m360","","10.1107/S1600536809006965","","","0.71069","MoKα","","0.0396","0.0319","","","0.0706","0.0752","","","","","","1.056","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2221765","15.5726","0.0003","3.8062","0.0001","16.1269","0.0003","90","","118.029","0.001","90","","843.77","0.03","123","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","5,7-Dichloroquinolin-8-ol","","- C9 H5 Cl2 N O -","- C9 H5 Cl2 N O -","- C36 H20 Cl8 N4 O4 -","4","1","LH2808","Ng, Seik Weng","5,7-Dichloroquinolin-8-ol","Acta Crystallographica Section E","2009","65","5","o1131","","10.1107/S1600536809014846","","","0.71073","MoKα","","0.0466","0.0398","","","0.1058","0.1118","","","","","","1.052","","","","has coordinates,has Fobs","201978","2020-10-21","18:00:00",""
"2222538","12.006","0.004","6.5806","0.0019","6.914","0.002","90","","105.253","0.006","90","","527","0.3","296","2","296","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","1,2-Bis(1<i>H</i>-pyrrol-2-ylmethylene)diazane monohydrate","","- C10 H12 N4 O -","- C10 H12 N4 O -","- C20 H24 N8 O2 -","2","0.5","AT2834","Yan, Lin; Zhao, Hong; Chen, Chun-Ling","1,2-Bis(1<i>H</i>-pyrrol-2-ylmethylene)diazane monohydrate","Acta Crystallographica Section E","2009","65","8","o1787","","10.1107/S1600536809025422","","","0.71073","MoKα","","0.0914","0.0652","","","0.1813","0.1913","","","","","","1.048","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2222787","11.4114","0.0003","9.9303","0.0002","25.1442","0.0006","90","","111.164","0.001","90","","2657.12","0.11","153","2","153","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Bis[1,3-bis(benzimidazol-2-yl)-2-oxapropane]cobalt(II) dipicrate acetonitrile trisolvate","","- C50 H41 Co N17 O16 -","- C50 H41 Co N17 O16 -","- C100 H82 Co2 N34 O32 -","2","0.5","LH2846","Wu, Huilu; Yun, Ruirui; Huang, Xingcai; Sun, Qingyu; Qi, Baoliang","Bis[1,3-bis(benzimidazol-2-yl)-2-oxapropane]cobalt(II) dipicrate acetonitrile trisolvate","Acta Crystallographica Section E","2009","65","8","m851","","10.1107/S1600536809024234","","","0.71073","MoKα","","0.0357","0.0308","","","0.0831","0.0867","","","","","","1.035","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2223086","15.9045","0.0016","4.9295","0.0006","11.5335","0.0016","90","","91.585","0.006","90","","903.89","0.19","296","2","296","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Diaquabis(cyclohexanecarboxylato)zinc(II) monohydrate","","- C14 H28 O7 Zn -","- C14 H28 O7 Zn -","- C28 H56 O14 Zn2 -","2","0.5","HB5057","Zhang, Yue-Wu; Wang, Li-Jun; Hou, Jian; Zeng, Qing-Fu","Diaquabis(cyclohexanecarboxylato)zinc(II) monohydrate","Acta Crystallographica Section E","2009","65","9","m1147","","10.1107/S1600536809033479","","","0.71073","MoKα","","0.0648","0.0543","","","0.1521","0.1584","","","","","","1.069","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2224019","14.383","0.003","9.656","0.002","12.864","0.002","90","","112.63","0.002","90","","1649","0.5","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","sulfone","(<i>E</i>)-3-[2-(4-Chlorophenylsulfonyl)vinyl]-6-methyl-4<i>H</i>-chromen-4-one","","- C18 H13 Cl O4 S -","- C18 H13 Cl O4 S -","- C72 H52 Cl4 O16 S4 -","4","1","SU2142","Ravi Kumar, R.; Krishnaiah, M.; Oo, Thanzaw; Kaung, Pho; Jagadeesh Kumar, N.","(<i>E</i>)-3-[2-(4-Chlorophenylsulfonyl)vinyl]-6-methyl-4<i>H</i>-chromen-4-one","Acta Crystallographica Section E","2009","65","11","o2760","","10.1107/S1600536809041300","","","0.71073","MoKα","","0.0872","0.0734","","","0.2174","0.2448","","","","","","1.127","","","","has coordinates,has Fobs","201978","2020-10-21","18:00:00",""
"2224928","19.2483","0.0004","3.62535","0.00004","17.3504","0.0002","90","","116.883","0.002","90","","1079.9","0.03","298","","298","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","<i>catena</i>-Poly[[dipyridinenickel(II)]-<i>trans</i>-di-μ-chlorido]","","- C10 H10 Cl2 N2 Ni -","- C10 H10 Cl2 N2 Ni -","- C40 H40 Cl8 N8 Ni4 -","4","1","CV2682","Alig, Edith; Bernert, Thomas; Fink, Lothar; Külcü, Nevzat; Yeşilkaynak, Tuncay","<i>catena</i>-Poly[[dipyridinenickel(II)]-<i>trans</i>-di-μ-chlorido] from powder data","Acta Crystallographica Section E","2010","66","2","m239","","10.1107/S1600536810001820","powder diffraction","","1.54056","CuKα~1~","","","","","","","","","","1.165","","","","","","","has coordinates","176789","2020-10-21","18:00:00",""
"2225665","9.4596","0.0019","11.437","0.002","7.2988","0.0015","90","","107.91","0.03","90","","751.4","0.3","291","2","291","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","5-(4-Chlorophenyl)-1<i>H</i>-tetrazole","","- C7 H5 Cl N4 -","- C7 H5 Cl N4 -","- C28 H20 Cl4 N16 -","4","1","NG2726","Xu, Liang; Gu, Li-Yan; Zhao, Dan-Yu; Wang, Bing; Kang, Ting-Guo","5-(4-Chlorophenyl)-1<i>H</i>-tetrazole","Acta Crystallographica Section E","2010","66","4","o742","","10.1107/S1600536810003788","","","0.71073","MoKα","","0.07","0.0498","","","0.127","0.1352","","","","","","1.046","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2226426","14.365","0.002","5.7397","0.0009","11.7464","0.0019","90","","93.275","0.003","90","","966.9","0.3","295","2","295","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","3,9-Bis(2,4-dichlorophenyl)-2,4,8,10-tetraoxaspiro[5.5]undecane","","- C19 H16 Cl4 O4 -","- C19 H16 Cl4 O4 -","- C38 H32 Cl8 O8 -","2","0.5","EZ2218","Li, Zhengyi; Tang, Qiuzheng; Wu, Kang; Yu, Shuling; Sun, Xiaoqiang","3,9-Bis(2,4-dichlorophenyl)-2,4,8,10-tetraoxaspiro[5.5]undecane","Acta Crystallographica Section E","2010","66","7","o1864","","10.1107/S1600536810024712","","","0.71073","MoKα","","0.0436","0.0349","","","0.1409","0.1597","","","","","","1.018","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2226517","11.702","0.002","11.6391","0.0018","13.424","0.002","90","","106.75","0.02","90","","1750.8","0.5","230","2","230","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Poly[[bis(μ-4,4'-bipyridyl-κ^2^<i>N</i>:<i>N</i>')bis(thiocyanato- κ<i>N</i>)manganese(II)] diethyl ether disolvate]","","- C30 H36 Mn N6 O2 S2 -","- C30 H36 Mn N6 O2 S2 -","- C60 H72 Mn2 N12 O4 S4 -","2","0.5","HY2314","Wriedt, Mario; Jess, Inke; Näther, Christian","Poly[[bis(μ-4,4'-bipyridyl-κ^2^<i>N</i>:<i>N</i>')bis(thiocyanato-κ<i>N</i>)manganese(II)] diethyl ether disolvate]","Acta Crystallographica Section E","2010","66","7","m781","","10.1107/S1600536810021665","","","0.71073","MoKα","","0.083","0.0726","","","0.1967","0.2056","","","","","","1.071","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2226642","11.7803","0.0005","7.6462","0.0003","42.3249","0.0017","90","","102.184","0.001","90","","3726.5","0.3","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","<i>catena</i>-Poly[[[aqua(7-hydroxy-2<i>H</i>-1-benzopyran-2-one)sodium]- di-μ-aqua] 2-oxo-2<i>H</i>-1-benzopyran-7-olate monohydrate]","","- C18 H19 Na O10 -","- C18 H19 Na O10 -","- C144 H152 Na8 O80 -","8","2","RK2209","Zheng, Fuchun; Chen, Yicun; Ni, Jia; Wang, Jinzhi; Shi, Ganggang","<i>catena</i>-Poly[[[aqua(7-hydroxy-2<i>H</i>-1-benzopyran-2-one)sodium]-di-μ-aqua] 2-oxo-2<i>H</i>-1-benzopyran-7-olate monohydrate]","Acta Crystallographica Section E","2010","66","7","m834","m835","10.1107/S160053681002341X","","","0.71073","MoKα","","0.0697","0.0564","","","0.1438","0.1533","","","","","","1.132","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2226842","14.4347","0.0014","9.4399","0.0009","11.1959","0.0011","90","","102.896","0.002","90","","1487.1","0.2","170","2","170","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Dibenzoatobis[3-(pyrrol-1-ylmethyl)pyridine]zinc(II)","","- C34 H30 N4 O4 Zn -","- C34 H30 N4 O4 Zn -","- C68 H60 N8 O8 Zn2 -","2","0.5","DN2587","Lee, Hong Gyu; Kim, Jin Hoon; Kim, Pan-Gi; Kim, Cheal; Kim, Youngmee","Dibenzoatobis[3-(pyrrol-1-ylmethyl)pyridine]zinc(II)","Acta Crystallographica Section E","2010","66","8","m980","","10.1107/S1600536810028503","","","0.71073","MoKα","","0.0446","0.0335","","","0.0688","0.0705","","","","","","0.912","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2226916","13.801","0.003","8.2454","0.0016","13.716","0.003","90","","117.47","0.03","90","","1384.8","0.6","120","2","120","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Dibromido(4,4'-dimethyl-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')zinc(II)","","- C12 H12 Br2 N2 Zn -","- C12 H12 Br2 N2 Zn -","- C48 H48 Br8 N8 Zn4 -","4","1","HB5556","Alizadeh, Robabeh; Mohammadi Eshlaghi, Parisa; Amani, Vahid","Dibromido(4,4'-dimethyl-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')zinc(II)","Acta Crystallographica Section E","2010","66","8","m996","","10.1107/S1600536810028692","","","0.71073","MoKα","","0.0522","0.0392","","","0.0928","0.0987","","","","","","1.066","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2227294","13.498","0.0012","6.247","0.0005","12.716","0.0013","90","","108.871","0.01","90","","1014.6","0.17","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Chloridodimethyl(thiosemicarbazide)tin(IV) chloride","","- C3 H10 Cl2 N3 S Sn -","- C3 H10 Cl2 N3 S Sn -","- C12 H40 Cl8 N12 S4 Sn4 -","4","1","BX2306","Cortes C., Laura; Burgos C., Ana E.; Okio, Coco K. Y. A.","Chloridodimethyl(thiosemicarbazide)tin(IV) chloride","Acta Crystallographica Section E","2010","66","11","m1353","","10.1107/S1600536810038705","","","0.71073","MoKα","","0.0467","0.0365","","","0.0982","0.1032","","","","","","1.139","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2227297","13.293","0.003","5.2742","0.0012","12.156","0.003","90","","116.145","0.002","90","","765.1","0.3","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","<i>catena</i>-Poly[[diaquacadmium(II)]-μ-4,4'-sulfonyldibenzoato- κ^2^<i>O</i>^1^:<i>O</i>^1'^]","","- C14 H12 Cd O8 S -","- C14 H12 Cd O8 S -","- C28 H24 Cd2 O16 S2 -","2","0.5","BX2311","Jiao, Chang-mei","<i>catena</i>-Poly[[diaquacadmium(II)]-μ-4,4'-sulfonyldibenzoato-κ^2^<i>O</i>^1^:<i>O</i>^1'^]","Acta Crystallographica Section E","2010","66","11","m1405","","10.1107/S1600536810039711","","","0.71073","MoKα","","0.0351","0.0324","","","0.0857","0.1019","","","","","","1.235","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2227819","10.674","0.0019","8.7637","0.0005","10.37","0.003","90","","109.83","0.02","90","","912.5","0.3","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","6,6'-Dimethyl-2,2'-[oxalylbis(azanediyl)]dipyridinium dichloride acetonitrile solvate","","- C16 H19 Cl2 N5 O2 -","- C16 H19 Cl2 N5 O2 -","- C32 H38 Cl4 N10 O4 -","2","0.5","NC2195","Hu, Hui-Ling; Cheng, Pei-Chi; Wu, Chia-Jun; Chen, Jhy-Der","6,6'-Dimethyl-2,2'-[oxalylbis(azanediyl)]dipyridinium dichloride acetonitrile solvate","Acta Crystallographica Section E","2010","66","9","o2386","","10.1107/S1600536810033519","","","0.71073","MoKα","","0.0481","0.0353","","","0.0869","0.0941","","","","","","1.067","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2228207","10.909","0.002","4.8271","0.001","15.98","0.003","90","","100.02","0.03","90","","828.7","0.3","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","<i>catena</i>-Poly[lead(II)-bis(μ-2-amino-1,3-benzothiazole-6-carboxylato)]","","- C16 H10 N4 O4 Pb S2 -","- C16 H10 N4 O4 Pb S2 -","- C32 H20 N8 O8 Pb2 S4 -","2","0.5","BG2378","Zhang, Ke-Ke; Fang, Xin; Yu, Hai-Yang; Ke, Hua; Wang, Jun-Dong","<i>catena</i>-Poly[lead(II)-bis(μ-2-amino-1,3-benzothiazole-6-carboxylato)]","Acta Crystallographica Section E","2010","66","12","m1700","m1701","10.1107/S1600536810049330","","","0.71073","MoKα","","0.0373","0.0369","","","0.0956","0.0959","","","","","","1.106","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2228430","8.0634","0.0013","11.705","0.002","22.807","0.004","90","","94.307","0.002","90","","2146.5","0.6","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Poly[(μ~3~-biphenyl-3,4'-dicarboxylato- κ^4^<i>O</i>^3^:<i>O</i>^3'^:<i>O</i>^4'^,<i>O</i>^4''^)(1<i>H</i>- imidazo[4,5-<i>f</i>][1,10]phenanthroline- κ^2^<i>N</i>^7^,<i>N</i>^8^)manganese(II)]","","- C27 H16 Mn N4 O4 -","- C27 H16 Mn N4 O4 -","- C108 H64 Mn4 N16 O16 -","4","1","JH2224","Wang, Fu-Ming","Poly[(μ~3~-biphenyl-3,4'-dicarboxylato-κ^4^<i>O</i>^3^:<i>O</i>^3'^:<i>O</i>^4'^,<i>O</i>^4''^)(1<i>H</i>-imidazo[4,5-<i>f</i>][1,10]phenanthroline-κ^2^<i>N</i>^7^,<i>N</i>^8^)manganese(II)]","Acta Crystallographica Section E","2010","66","12","m1677","","10.1107/S1600536810045587","","","0.71073","MoKα","","0.1147","0.0516","","","0.0866","0.1065","","","","","","1.003","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2228598","11.1046","0.0008","11.1633","0.0006","17.9779","0.0009","90","","107.856","0.006","90","","2121.3","0.2","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","3-Ethyl 2-methyl 8-bromo-2-phenyl- 1,2,3,3a,4,9b-hexahydrochromeno[4,3-<i>b</i>]pyrrole-2,3-dicarboxylate","","- C22 H22 Br N O5 -","- C22 H22 Br N O5 -","- C88 H88 Br4 N4 O20 -","4","1","XU5063","He, Long","3-Ethyl 2-methyl 8-bromo-2-phenyl-1,2,3,3a,4,9b-hexahydrochromeno[4,3-<i>b</i>]pyrrole-2,3-dicarboxylate","Acta Crystallographica Section E","2010","66","12","o3075","","10.1107/S1600536810044491","","","0.71073","MoKα","","0.0855","0.0468","","","0.1313","0.1371","","","","","","1.064","","","","has coordinates,has disorder,has Fobs","176789","2020-10-21","18:00:00",""
"2229199","12.263","0.003","12.785","0.002","15.286","0.002","90","","105.94","0.01","90","","2304.4","0.7","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","μ-Carbonato-bis(bis{2-[(diethylamino)methyl]phenyl}bismuth(III))","","- C45 H64 Bi2 N4 O3 -","- C45 H64 Bi2 N4 O3 -","- C90 H128 Bi4 N8 O6 -","2","0.5","RK2252","Soran, Albert P.; Nema, Mihai G.; Breunig, Hans J.; Silvestru, Cristian","μ-Carbonato-bis(bis{2-[(diethylamino)methyl]phenyl}bismuth(III))","Acta Crystallographica Section E","2011","67","2","m153","m154","10.1107/S160053681005453X","","","0.71073","MoKα","","0.0524","0.0409","","","0.0992","0.1041","","","","","","1.008","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2229244","13.769","0.002","13.089","0.002","19.999","0.003","90","","131.426","0.003","90","","2702.5","0.7","298","2","298","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","2-Hydroxy-<i>N</i>'-(4-hydroxy-3-nitrobenzylidene)benzohydrazide","","- C14 H11 N3 O5 -","- C14 H11 N3 O5 -","- C112 H88 N24 O40 -","8","2","SU2244","Zhang, Zhen","2-Hydroxy-<i>N</i>'-(4-hydroxy-3-nitrobenzylidene)benzohydrazide","Acta Crystallographica Section E","2011","67","2","o301","","10.1107/S1600536811000201","","","0.71073","MoKα","","0.1339","0.0741","","","0.1417","0.1653","","","","","","1.072","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2229271","16.4635","0.0015","7.5836","0.0008","15.1123","0.0014","90","","115.68","0.001","90","","1700.4","0.3","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Bis(μ-3,5-difluorobenzoato)bis[(3,5-difluorobenzoato)dimethyltin(IV)]","","- C32 H24 F8 O8 Sn2 -","- C32 H24 F8 O8 Sn2 -","- C64 H48 F16 O16 Sn4 -","2","0.5","XU5108","Liu, Hong; Yin, Han-Dong; Li, Jing; Wang, Da-Qi","Bis(μ-3,5-difluorobenzoato)bis[(3,5-difluorobenzoato)dimethyltin(IV)]","Acta Crystallographica Section E","2011","67","2","m148","","10.1107/S1600536810054061","","","0.71073","MoKα","","0.0693","0.0433","","","0.1007","0.1265","","","","","","1.05","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2229702","13.397","0.002","8.4152","0.0014","13.752","0.002","90","","112.57","0.003","90","","1431.6","0.4","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Bis(2,4-dichlorophenoxyacetato-κ^2^<i>O</i>^1^,<i>O</i>^1'^)(5,5'- dimethyl-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')cobalt(II)","","- C28 H22 Cl4 Co N2 O6 -","- C28 H22 Cl4 Co N2 O6 -","- C56 H44 Cl8 Co2 N4 O12 -","2","0.5","HY2417","Ji, Li-Li; Liu, Jian-She; Song, Wen-Dong","Bis(2,4-dichlorophenoxyacetato-κ^2^<i>O</i>^1^,<i>O</i>^1'^)(5,5'-dimethyl-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')cobalt(II)","Acta Crystallographica Section E","2011","67","4","m493","","10.1107/S1600536811010579","","","0.71073","MoKα","","0.0425","0.034","","","0.0836","0.1056","","","","","","1.137","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2229957","14.1907","0.0003","9.0224","0.0002","10.9412","0.0002","90","","111.789","0.001","90","","1300.77","0.05","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Ethylenediammonium bis(hydrogen squarate) monohydrate","","- C10 H14 N2 O9 -","- C10 H14 N2 O9 -","- C40 H56 N8 O36 -","4","1","DN2662","Zenkhri, Louiza; Bataille, Thierry; Audebrand, Nathalie","A second monoclinic polymorph of ethylenediammonium bis(hydrogen squarate) monohydrate","Acta Crystallographica Section E","2011","67","5","o1118","","10.1107/S1600536811009019","","","0.71073","MoKα","","0.0702","0.044","","","0.1025","0.1162","","","","","","1.057","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2230087","15.617","0.006","8.083","0.003","11.585","0.004","90","","104.47","0.004","90","","1416","0.9","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Dimethyl 2,5-bis(5-hexylthiophen-2-yl)benzene-1,4-dioate","","- C30 H38 O4 S2 -","- C30 H38 O4 S2 -","- C60 H76 O8 S4 -","2","0.5","NG5141","Song, Cheng-Li; Liu, Ke; Zhang, Ai-Jiang; Xu, Zhu-Guo; Zhang, Hao-Li","Dimethyl 2,5-bis(5-hexylthiophen-2-yl)benzene-1,4-dioate","Acta Crystallographica Section E","2011","67","5","o1059","","10.1107/S1600536811011718","","","0.71073","MoKα","","0.0593","0.0412","","","0.0943","0.1042","","","","","","1.04","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2230227","11.3308","0.0004","3.9396","0.0001","14.6945","0.0005","90","","98.644","0.001","90","","648.49","0.04","200","2","200","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Ammonium-2-thiobarbiturate","Ammonium 4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ide","","- C4 H7 N3 O2 S -","- C4 H7 N3 O2 S -","- C16 H28 N12 O8 S4 -","4","1","BQ2297","Betz, Richard; Gerber, Thomas","Ammonium 4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ide","Acta Crystallographica Section E","2011","67","6","o1326","","10.1107/S1600536811016722","","","0.71073","MoKα","","0.0262","0.0233","","","0.064","0.0668","","","","","","1.097","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2230246","14.3102","0.0003","13.9933","0.0002","36.0614","0.0006","90","","91.211","0.002","90","","7219.6","0.2","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Poly[[tetrakis(μ-1,2-di-4-pyridylethylene- κ^2^<i>N</i>:<i>N</i>')tetrakis(selenocyanato-κ<i>N</i>)dimanganese(II)] 1,2-di-4-pyridylethylene disolvate]","","- C76 H60 Mn2 N16 Se4 -","- C76 H60 Mn2 N16 Se4 -","- C304 H240 Mn8 N64 Se16 -","4","1","BT5535","Wöhlert, Susanne; Jess, Inke; Näther, Christian","Poly[[tetrakis(μ-1,2-di-4-pyridylethylene-κ^2^<i>N</i>:<i>N</i>')tetrakis(selenocyanato-κ<i>N</i>)dimanganese(II)] 1,2-di-4-pyridylethylene disolvate]","Acta Crystallographica Section E","2011","67","6","m693","m694","10.1107/S1600536811016199","","","0.71073","MoKα","","0.0724","0.0556","","","0.1165","0.1241","","","","","","1.1","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2230439","12.5052","0.0006","10.9917","0.0005","13.1837","0.0006","90","","91.68","0.001","90","","1811.37","0.15","125","2","125","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","Poly[μ~3~-chlorido-μ~2~-chloridodichlorido(μ-dimethyl sulfoxide-κ^2^<i>O</i>:<i>S</i>)(dimethyl sulfoxide-κ<i>O</i>)(μ-pyrimidine- κ^2^<i>N</i>:<i>N</i>')ruthenium(III)sodium]","","- C8 H16 Cl4 N2 Na O2 Ru S2 -","- C8 H16 Cl4 N2 Na O2 Ru S2 -","- C32 H64 Cl16 N8 Na4 O8 Ru4 S8 -","4","1","OM2427","Ferrara, Skylar; Kreider-Mueller, Ava; Tanski, Joseph M.; Anderson, Craig M.","Poly[μ~3~-chlorido-μ~2~-chloridodichlorido(μ-dimethyl sulfoxide-κ^2^<i>O</i>:<i>S</i>)(dimethyl sulfoxide-κ<i>O</i>)(μ-pyrimidine-κ^2^<i>N</i>:<i>N</i>')ruthenium(III)sodium]","Acta Crystallographica Section E","2011","67","6","m756","m757","10.1107/S1600536811017211","","","0.71073","MoKα","","0.0193","0.0177","","","0.0444","0.0453","","","","","","1.072","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2231072","13.2923","0.0007","10.7155","0.0003","13.8745","0.0007","90","","118.592","0.006","90","","1735.2","0.17","100.15","","100.15","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Diammine(2,2'-bipyridine)bis(thiocyanato-κ<i>N</i>)cobalt(III) diamminetetrakis(thiocyanato-κ<i>N</i>)chromate(III) acetonitrile disolvate","","- C20 H26 Co Cr N14 S6 -","- C20 H26 Co Cr N14 S6 -","- C40 H52 Co2 Cr2 N28 S12 -","2","0.5","FF2017","Semenaka, Valentyna V.; Nesterova, Oksana V.; Kokozay, Volodymyr N.; Zybatyuk, Roman I.; Shishkin, Oleg V.","Diammine(2,2'-bipyridine)bis(thiocyanato-κ<i>N</i>)cobalt(III) diamminetetrakis(thiocyanato-κ<i>N</i>)chromate(III) acetonitrile disolvate","Acta Crystallographica Section E","2011","67","8","m1021","m1022","10.1107/S1600536811024998","","","0.7107","MoKα","","0.0542","0.0375","","","0.0776","0.0843","","","","","","1.015","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2231410","11.119","0.002","8.312","0.001","16.043","0.002","90","","97.27","0.01","90","","1470.8","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","<i>N</i>-(2,6-Dimethylphenyl)-2,4-dimethylbenzenesulfonamide","","- C16 H19 N O2 S -","- C16 H19 N O2 S -","- C64 H76 N4 O8 S4 -","4","1","BT5591","Nirmala, P. G.; Foro, Sabine; Gowda, B. Thimme","<i>N</i>-(2,6-Dimethylphenyl)-2,4-dimethylbenzenesulfonamide","Acta Crystallographica Section E","2011","67","9","o2258","","10.1107/S1600536811031102","","","0.71073","MoKα","","0.0577","0.0432","","","0.1154","0.125","","","","","","1.039","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2231573","11.3661","0.0011","10.0239","0.0009","8.947","0.0007","90","","109.988","0.001","90","","957.95","0.15","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","<i>N</i>,<i>N</i>'-Bis(2,5-dichlorophenyl)isophthalamide","<i>N</i>,<i>N</i>'-bis(2,5-dichlorophenyl)benzene-1,3-dicarboxamide","","- C20 H12 Cl4 N2 O2 -","- C20 H12 Cl4 N2 O2 -","- C40 H24 Cl8 N4 O4 -","2","0.5","JJ2095","Zhu, Ruitao; Dong, Jinlong; Zuo, Yu; Ren, Yuehong","<i>N</i>,<i>N</i>'-Bis(2,5-dichlorophenyl)isophthalamide","Acta Crystallographica Section E","2011","67","9","o2311","","10.1107/S1600536811031758","","","0.71073","MoKα","","0.0688","0.0415","","","0.0907","0.1104","","","","","","1.006","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2231850","15.2981","0.0011","5.7338","0.0003","24.4051","0.0012","90","","112.031","0.007","90","","1984.4","0.2","150","1","150","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","acetylferrocene‒2-chloro-1-ferrocenylethanone (1/1)","","- C24 H23 Cl Fe2 O2 -","- C24 H23 Cl Fe2 O2 -","- C96 H92 Cl4 Fe8 O8 -","4","1","CV5144","Erben, Milan; Vinklárek, Jaromír; Růžička, Aleš","Acetylferrocene‒2-chloro-1-ferrocenylethanone (1/1)","Acta Crystallographica Section E","2011","67","10","m1447","m1448","10.1107/S1600536811038244","","","0.71073","MoKα","","0.0962","0.0589","","","0.1297","0.1514","","","","","","0.973","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2231988","14.3207","0.0013","5.2003","0.0005","19.5919","0.0018","90","","108.369","0.002","90","","1384.7","0.2","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","4-[2-(2-Methoxyphenyl)hydrazinylidene]-3-methyl-5-oxo-4,5-dihydro-1<i>H</i>- pyrazole-1-carbothioamide","","- C12 H13 N5 O2 S -","- C12 H13 N5 O2 S -","- C48 H52 N20 O8 S4 -","4","1","LH5336","Fun, Hoong-Kun; Arshad, Suhana; Shetty, Shobhitha; Kalluraya, Balakrishna","4-[2-(2-Methoxyphenyl)hydrazinylidene]-3-methyl-5-oxo-4,5-dihydro-1<i>H</i>-pyrazole-1-carbothioamide","Acta Crystallographica Section E","2011","67","10","o2711","","10.1107/S1600536811037883","","","0.71073","MoKα","","0.0817","0.0596","","","0.1644","0.1865","","","","","","1.052","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2232386","15.286","0.0008","4.8436","0.0002","11.9803","0.0006","90","","111.812","0.006","90","","823.51","0.08","200","2","200","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","ethylenediaminium 4,4'-sulfonyldibenzoate","Ethane-1,2-diaminium 4,4'-sulfonyldibenzoate","","- C16 H18 N2 O6 S -","- C16 H18 N2 O6 S -","- C32 H36 N4 O12 S2 -","2","0.5","LH5347","Smith, Graham; Wermuth, Urs D.","Ethane-1,2-diaminium 4,4'-sulfonyldibenzoate","Acta Crystallographica Section E","2011","67","11","o2966","","10.1107/S1600536811041274","","","0.71073","MoKα","","0.0456","0.034","","","0.0898","0.0984","","","","","","1.05","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2232515","9.8527","0.0005","7.283","0.0004","14.6432","0.0009","90","","100.879","0.001","90","","1031.87","0.1","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Poly[(μ~2~-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>')(μ~2~-2,2- dimethylcyclopentane-1,3-dicarboxylato- κ^4^<i>O</i>^1^,<i>O</i>^1'^:<i>O</i>^3^,<i>O</i>^3'^)cadmium]","","- C19 H20 Cd N2 O4 -","- C19 H20 Cd N2 O4 -","- C38 H40 Cd2 N4 O8 -","2","0.5","XU5349","Zhang, Xian-Fa; Gao, Shan; Ng, Seik Weng","Poly[(μ~2~-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>')(μ~2~-2,2-dimethylcyclopentane-1,3-dicarboxylato-κ^4^<i>O</i>^1^,<i>O</i>^1'^:<i>O</i>^3^,<i>O</i>^3'^)cadmium]","Acta Crystallographica Section E","2011","67","11","m1593","","10.1107/S1600536811042656","","","0.71073","MoKα","","0.0737","0.0537","","","0.143","0.1708","","","","","","1.119","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2232715","19.3315","0.0006","9.6523","0.0003","29.9731","0.0008","90","","127.817","0.002","90","","4418.1","0.3","100","","100","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","7'-Phenyl-5',6',7',7a'-tetrahydrodipiro[indan-2,5'- pyrrolo[1,2-<i>c</i>][1,3]thiazole-6',2''-indan]-1,3,1''-trione","","- C28 H21 N O3 S -","- C28 H21 N O3 S -","- C224 H168 N8 O24 S8 -","8","2","HB6489","Wei, Ang Chee; Ali, Mohamed Ashraf; Choon, Tan Soo; Quah, Ching Kheng; Fun, Hoong-Kun","7'-Phenyl-5',6',7',7a'-tetrahydrodipiro[indan-2,5'-pyrrolo[1,2-<i>c</i>][1,3]thiazole-6',2''-indan]-1,3,1''-trione","Acta Crystallographica Section E","2011","67","12","o3218","o3219","10.1107/S1600536811046174","","","0.71073","MoKα","","0.1302","0.0664","","","0.1312","0.155","","","","","","1.018","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2233279","11.5161","0.0002","11.6531","0.0002","16.3216","0.0003","90","","102.403","0.001","90","","2139.21","0.07","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Poly[[diaquabis(μ~2~-4,4'-bipyridyl)iron(II)] bis{2-[(3-carboxypyridin-2-yl)disulfanyl]nicotinate}]","","- C44 H34 Fe N8 O10 S4 -","- C44 H34 Fe N8 O10 S4 -","- C88 H68 Fe2 N16 O20 S8 -","2","0.5","RK2316","Shan, Jie-Jie; Chai, Sheng-Yuan; Feng, Yun-Long","Poly[[diaquabis(μ~2~-4,4'-bipyridyl)iron(II)] bis{2-[(3-carboxypyridin-2-yl)disulfanyl]nicotinate}]","Acta Crystallographica Section E","2012","68","1","m28","","10.1107/S1600536811052287","","","0.71073","MoKα","","","0.0466","","","0.1106","0.1258","","","","","","1.054","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2233613","14.6018","0.0005","10.8574","0.0003","17.463","0.0006","90","","126.438","0.002","90","","2227.29","0.14","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","6-Chloro-<i>N</i>-(2-methoxyphenyl)pyridazin-3-amine","","- C11 H10 Cl N3 O -","- C11 H10 Cl N3 O -","- C88 H80 Cl8 N24 O8 -","8","2","RK2330","Ather, Abdul Qayyum; Tahir, M. Nawaz; Khan, Muhammad Naeem; Khan, Misbahul Ain; Athar, Muhammad Makshoof","6-Chloro-<i>N</i>-(2-methoxyphenyl)pyridazin-3-amine","Acta Crystallographica Section E","2012","68","2","o438","o439","10.1107/S1600536812001535","","","0.71073","MoKα","","0.0698","0.0385","","","0.0931","0.11","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","201979","2020-10-21","18:00:00",""
"2233769","24.871","0.002","10.235","0.001","23.855","0.002","90","","103.646","0.002","90","","5901","0.9","298","2","298","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","<i>N</i>'-(2-Hydroxy-4-methoxybenzylidene)-4-methylbenzohydrazide","","- C16 H16 N2 O3 -","- C16 H16 N2 O3 -","- C256 H256 N32 O48 -","16","4","CV5243","Zhang, Yan; Liu, Min; Ma, Jing-Jun","<i>N</i>'-(2-Hydroxy-4-methoxybenzylidene)-4-methylbenzohydrazide","Acta Crystallographica Section E","2012","68","3","o679","o680","10.1107/S1600536812005156","","","0.71073","MoKα","","0.1939","0.0831","","","0.1708","0.2238","","","","","","1.018","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2233882","11.453","0.002","8.4896","0.0017","12.337","0.003","90","","107.12","0.03","90","","1146.4","0.5","290","2","290","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(4-chlorobenzoato- κ<i>O</i>)zinc(II)","","- C24 H16 Cl2 N2 O4 Zn -","- C24 H16 Cl2 N2 O4 Zn -","- C48 H32 Cl4 N4 O8 Zn2 -","2","0.5","HY2516","Zhang, Bi-Song; Zhu, Hong-Line; Li, Jun; Dai, Dong-Dong; Peng, Yi-Bao","(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(4-chlorobenzoato-κ<i>O</i>)zinc","Acta Crystallographica Section E","2012","68","3","m321","m322","10.1107/S160053681200699X","","","0.71073","MoKα","","0.0609","0.0411","","","0.0914","0.1214","","","","","","1.168","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2234255","7.2514","0.0004","4.7113","0.0003","21.8591","0.0011","90","","103.394","0.002","90","","726.47","0.07","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","<i>catena</i>-Poly[[dichloridomercury(II)]-<i>N</i>'- nicotinoylnicotinohydrazide]","","- C12 H10 Cl2 Hg N4 O2 -","- C12 H10 Cl2 Hg N4 O2 -","- C24 H20 Cl4 Hg2 N8 O4 -","2","0.5","HP2029","Ma, Teng; Wang, Yuanlu; Wang, Fengliang; Li, Fei","<i>catena</i>-Poly[[dichloridomercury(II)]-<i>N</i>'-nicotinoylnicotinohydrazide]","Acta Crystallographica Section E","2012","68","4","m367","","10.1107/S1600536812008884","","","0.71073","MoKα","","0.0167","0.0156","","","0.0374","0.0378","","","","","","1.09","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2234433","9.1066","0.0018","7.6277","0.0015","14.375","0.003","90","","95.31","0.03","90","","994.2","0.3","120","2","120","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","(<i>E</i>)-2-(2-Hydroxy-5-iodobenzylidene)hydrazinecarboxamide","","- C8 H8 I N3 O2 -","- C8 H8 I N3 O2 -","- C32 H32 I4 N12 O8 -","4","1","VM2154","Bikas, Rahman; Nikbakht Sardari, Samra; Hosseini, Seyed Sajjad; Shahverdizadeh, Gholam Hossein; Notash, Behrouz","(<i>E</i>)-2-(2-Hydroxy-5-iodobenzylidene)hydrazinecarboxamide","Acta Crystallographica Section E","2012","68","4","o1090","","10.1107/S1600536812010197","","","0.71073","MoKα","","0.0367","0.0285","","","0.0543","0.0563","","","","","","1.125","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2234678","16.07","0.004","9.471","0.002","23.54","0.006","90","","107.685","0.004","90","","3413.4","1.4","113","2","113","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Poly[[dodecaaquabis(μ~3~-pyridine-2,6-dicarboxylato)tetrakis(μ~2~-pyridine- 2,6-dicarboxylato)tricalciumdieuropium(III)] 10.5-hydrate]","","- C42 H63 Ca3 Eu2 N6 O46.5 -","- C42 H54 Ca3 Eu2 N6 O46.5 -","- C84 H108 Ca6 Eu4 N12 O93 -","2","0.5","HY2534","Shi, Fengjuan; Deng, Jiguang; Dai, Hongxing","Poly[[dodecaaquabis(μ~3~-pyridine-2,6-dicarboxylato)tetrakis(μ~2~-pyridine-2,6-dicarboxylato)tricalciumdieuropium(III)] 10.5-hydrate]","Acta Crystallographica Section E","2012","68","5","m685","m686","10.1107/S1600536812018028","","","0.71073","MoKα","","0.0515","0.0424","","","0.0903","0.0937","","","","","","1.14","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2234704","7.7255","0.0006","13.2184","0.0011","15.8335","0.0012","90","","118.148","0.005","90","","1425.7","0.2","296","","296","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","2-Amino-4-nitrophenol‒1-(2,4,6-trihydroxyphenyl)ethanone (1/1)","","- C14 H14 N2 O7 -","- C14 H14 N2 O7 -","- C56 H56 N8 O28 -","4","1","KJ2199","Kocabıyık, Can; Paşaoğlu, Hümeyra; Basılı, Taşkın; Ağar, Erbil","2-Amino-4-nitrophenol‒1-(2,4,6-trihydroxyphenyl)ethanone (1/1)","Acta Crystallographica Section E","2012","68","5","o1527","o1528","10.1107/S1600536812017497","","","0.71073","MoKα","","0.09","0.0462","","","0.0868","0.0982","","","","","","0.968","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2235132","17.3573","0.0012","5.08","0.0004","21.6293","0.0017","90","","107.239","0.002","90","","1821.5","0.2","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","2-Amino-3-carboxypyridinium perchlorate","","- C6 H7 Cl N2 O6 -","- C6 H7 Cl N2 O6 -","- C48 H56 Cl8 N16 O48 -","8","2","LD2056","Berrah, Fadila; Bouacida, Sofiane; Anana, Hayet; Roisnel, Thierry","2-Amino-3-carboxypyridinium perchlorate","Acta Crystallographica Section E","2012","68","6","o1601","o1602","10.1107/S1600536812018922","","","0.71073","MoKα","","0.0653","0.0485","","","0.1032","0.1099","","","","","","1.107","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2235203","15.1221","0.0007","5.6518","0.0001","13.6926","0.0006","90","","113.22","0.04","90","","1075.5","0.3","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","3-Cyanoanilinium hydrogen oxalate hemihydrate","","- C9 H9 N2 O4.5 -","- C9 H9 N2 O4.5 -","- C36 H36 N8 O18 -","4","1","PV2542","Chen, Xin-Yuan","3-Cyanoanilinium hydrogen oxalate hemihydrate","Acta Crystallographica Section E","2012","68","6","o1678","","10.1107/S1600536812019824","","","0.71073","MoKα","","0.0709","0.0543","","","0.1419","0.156","","","","","","1.072","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2235285","8.3562","0.0017","10.236","0.002","17.972","0.004","90","","98.8","0.03","90","","1519.1","0.6","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Diaquabis{1-[(1<i>H</i>-benzimidazol-2-yl)methyl]-1<i>H</i>-imidazole- κ<i>N</i>^3^}dichloridocadmium hexahydrate","","- C22 H36 Cd Cl2 N8 O8 -","- C22 H36 Cd Cl2 N8 O8 -","- C44 H72 Cd2 Cl4 N16 O16 -","2","0.5","WM2627","Xie, Xin-Nian; Lu, Meng; Yuan, Juan; Yang, Huai-Xia","Diaquabis{1-[(1<i>H</i>-benzimidazol-2-yl)methyl]-1<i>H</i>-imidazole-κ<i>N</i>^3^}dichloridocadmium hexahydrate","Acta Crystallographica Section E","2012","68","6","m754","","10.1107/S160053681202034X","","","0.71073","MoKα","","0.0531","0.0474","","","0.1186","0.1234","","","","","","1.003","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2235938","7.828","0.002","14.198","0.004","19.846","0.005","90","","97.212","0.004","90","","2188.3","1","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Di-μ-aqua-bis[diaquabis(thiocyanato-κ<i>N</i>)iron(II)]‒ 1,4-bis(4<i>H</i>-1,2,4-triazol-4-yl)benzene (1/3)","","- C34 H36 Fe2 N22 O6 S4 -","- C34 H36 Fe2 N22 O6 S4 -","- C68 H72 Fe4 N44 O12 S8 -","2","0.5","PK2413","Liu, Yuan-Yuan; Yang, Pan; Ding, Bin","The monoclinic form of di-μ-aqua-bis[diaquabis(thiocyanato-κ<i>N</i>)iron(II)]‒1,4-bis(4<i>H</i>-1,2,4-triazol-4-yl)benzene (1/3)","Acta Crystallographica Section E","2012","68","8","m1036","m1037","10.1107/S160053681202613X","","","0.71073","MoKα","","0.0711","0.0498","","","0.1182","0.1322","","","","","","1.039","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2235970","28.312","0.003","7.2952","0.0007","13.0626","0.0013","90","","103.151","0.002","90","","2627.2","0.5","100","","100","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","1-(6-Fluoro-1,3-benzothiazol-2-yl)-2-(1-phenylethylidene)hydrazine","","- C15 H12 F N3 S -","- C15 H12 F N3 S -","- C120 H96 F8 N24 S8 -","8","2","RZ2786","Fun, Hoong-Kun; Quah, Ching Kheng; Munirajasekhar, D.; Himaja, M.; Sarojini, B. K.","1-(6-Fluoro-1,3-benzothiazol-2-yl)-2-(1-phenylethylidene)hydrazine","Acta Crystallographica Section E","2012","68","8","o2438","o2439","10.1107/S1600536812030851","","","0.71073","MoKα","","0.0356","0.0331","","","0.0784","0.0802","","","","","","1.055","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2236034","16.495","0.003","6.632","0.0013","16.273","0.003","90","","119.56","0.03","90","","1548.5","0.7","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Bis(2-amino-3-methylpyridine-κ<i>N</i>^1^)dichloridomercury(II)","","- C12 H16 Cl2 Hg N4 -","- C12 H16 Cl2 Hg N4 -","- C48 H64 Cl8 Hg4 N16 -","4","1","XU5594","Tadjarodi, Azadeh; Bijanzad, Keyvan; Notash, Behrouz","Bis(2-amino-3-methylpyridine-κ<i>N</i>^1^)dichloridomercury(II)","Acta Crystallographica Section E","2012","68","8","m1099","","10.1107/S1600536812032126","","","0.71073","MoKα","","0.0553","0.0466","","","0.1126","0.1163","","","","","","1.032","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2236307","11.9235","0.0016","10.7836","0.0016","19.805","0.003","90","","97.252","0.003","90","","2526.1","0.6","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Bis[(Cyanido-κ<i>C</i>)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>') copper(II)] pentakis(cyanido-κ<i>C</i>)nitrosoferrate(II) dimethylformamide monosolvate","","- C58 H39 Cu2 Fe N17 O2 -","- C58 H39 Cu2 Fe N17 O2 -","- C116 H78 Cu4 Fe2 N34 O4 -","2","0.5","HG5236","Kozachuk, Olesia V.; Kokozay, Vladimir N.; Vassilyeva, Olga Yu.; Skelton, Brian W.","Bis[(cyanido-κ<i>C</i>)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)] pentakis(cyanido-κ<i>C</i>)nitrosoferrate(II) dimethylformamide monosolvate","Acta Crystallographica Section E","2012","68","9","m1218","m1219","10.1107/S1600536812036264","","","0.71073","MoKα","","0.1022","0.0516","","","0.1091","0.1349","","","","","","1.037","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2236374","12.1801","0.0006","9.2529","0.0004","17.6769","0.0008","90","","101.979","0.001","90","","1948.83","0.16","100","1","100","1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","<i>N</i>-[(4-Chlorophenyl)sulfonyl]acetamide","","- C8 H8 Cl N O3 S -","- C8 H8 Cl N O3 S -","- C64 H64 Cl8 N8 O24 S8 -","8","2","IS5173","Fun, Hoong-Kun; Chia, Tze Shyang; Jyothi, K.; Hegde, Poornima; D'Souza, Pramila Rita","<i>N</i>-[(4-Chlorophenyl)sulfonyl]acetamide","Acta Crystallographica Section E","2012","68","9","o2626","","10.1107/S1600536812033764","","","0.71073","MoKα","","0.0415","0.028","","","0.0797","0.09","","","","","","1.038","","","","has coordinates,has Fobs","201979","2020-10-21","18:00:00",""
"2236391","15.9952","0.0009","7.3104","0.0005","12.0351","0.0007","90","","96.912","0.001","90","","1397.05","0.15","100","1","100","1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Adipic acid‒2,4-diamino-6-(4-methoxyphenyl)-1,3,5-triazine (1/2)","","- C26 H32 N10 O6 -","- C26 H32 N10 O6 -","- C52 H64 N20 O12 -","2","0.5","IS5192","Thanigaimani, Kaliyaperumal; Razak, Ibrahim Abdul; Arshad, Suhana; Jagatheesan, Rathinavel; Santhanaraj, Kulandaisamy Joseph","Adipic acid‒2,4-diamino-6-(4-methoxyphenyl)-1,3,5-triazine (1/2)","Acta Crystallographica Section E","2012","68","10","o2938","o2939","10.1107/S1600536812038743","","","0.71073","MoKα","","0.0475","0.0393","","","0.1175","0.1255","","","","","","1.075","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2236686","6.2006","0.0012","9.77","0.002","11.259","0.003","90","","115.33","0.02","90","","616.5","0.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Poly[[diaqua(μ~8~-benzene-1,2,4,5-tetracarboxylato)calciumzinc] monohydrate]","","- C10 H8 Ca O11 Zn -","- C10 H8 Ca O11 Zn -","- C20 H16 Ca2 O22 Zn2 -","2","0.5","WM2661","Jia, Yong-Yan; Chen, Bo; Yuan, Yu-Xia","Poly[[diaqua(μ~8~-benzene-1,2,4,5-tetracarboxylato)calciumzinc] monohydrate]","Acta Crystallographica Section E","2012","68","9","m1150","","10.1107/S1600536812034113","","","0.71073","MoKα","","0.0304","0.0274","","","0.0938","0.0986","","","","","","0.838","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2236796","11.905","0.008","13.729","0.009","12.782","0.008","90","","108.366","0.014","90","","1983","2","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Methyl (<i>E</i>)-2-[(3-chloro-4-cyanophenyl)imino]-4-(4-chlorophenyl)- 6-methyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate","","- C20 H16 Cl2 N4 O2 -","- C20 H16 Cl2 N4 O2 -","- C80 H64 Cl8 N16 O8 -","4","1","ZS2233","Venugopala, K. N.; Nayak, Susanta K.; Odhav, Bharti","Methyl (<i>E</i>)-2-[(3-chloro-4-cyanophenyl)imino]-4-(4-chlorophenyl)-6-methyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate","Acta Crystallographica Section E","2012","68","10","o2977","o2978","10.1107/S1600536812039451","","","0.71073","MoKα","","0.0776","0.0461","","","0.1135","0.1299","","","","","","1.011","","","","has coordinates,has disorder,has Fobs","176798","2020-10-21","18:00:00",""
"2237045","14.747","0.002","9.1038","0.0013","21.376","0.003","90","","117.576","0.008","90","","2543.8","0.6","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","<i>trans</i>-Di-μ-chlorido-bis{chlorido[tris(3,5-dimethylphenyl)phosphane- κ<i>P</i>]palladium(II)} dichloromethane monosolvate","","- C49 H56 Cl6 P2 Pd2 -","- C49 H56 Cl6 P2 Pd2 -","- C98 H112 Cl12 P4 Pd4 -","2","0.5","SU2534","Davis, Wade L.; Muller, Alfred","<i>trans</i>-Di-μ-chlorido-bis{chlorido[tris(3,5-dimethylphenyl)phosphane-κ<i>P</i>]palladium(II)} dichloromethane monosolvate","Acta Crystallographica Section E","2012","68","12","m1563","m1564","10.1107/S1600536812048556","","","0.71073","MoKα","","0.0632","0.0402","","","0.0877","0.0981","","","","","","1.025","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237057","8.01","0.002","8.788","0.002","14.294","0.004","90","","103.019","0.012","90","","980.3","0.4","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Bis(butane-1,4-diammonium) di-μ-oxido-bis[trifluoridooxidomolybdate(V)] monohydrate","","- C8 H30 F6 Mo2 N4 O5 -","- C8 H30 F6 Mo2 N4 O5 -","- C16 H60 F12 Mo4 N8 O10 -","2","0.5","VN2059","Lhoste, J.; Hemon-Ribaud, A.; Maisonneuve, V.; Jobic, S.; Bujoli-Doeuff, M.","Bis(butane-1,4-diammonium) di-μ-oxido-bis[trifluoridooxidomolybdate(V)] monohydrate","Acta Crystallographica Section E","2012","68","12","m1520","","10.1107/S1600536812046892","","","0.71073","MoKα","","0.0395","0.03","","","0.073","0.0782","","","","","","1.045","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237494","15.325","0.002","7.1744","0.0009","17.965","0.002","90","","93.577","0.009","90","","1971.4","0.4","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","(±)-(4a<i>R</i>,5<i>R</i>,8<i>S</i>,8a<i>R</i>)-8-(<i>tert</i>-Butyldimethylsilyloxy)-2,5,8a-trimethyl-4a,5,8,8a-tetrahydronaphthalene-1,4-dione","","- C19 H30 O3 Si -","- C19 H30 O3 Si -","- C76 H120 O12 Si4 -","4","1","HG5287","Delling, Felix N.; Zukerman-Schpector, Julio; Brocksom, Timothy J.; Brocksom, Ursula; Finelli, Fernanda G.; Tiekink, Edward R. T.","(±)-(4a<i>R</i>,5<i>R</i>,8<i>S</i>,8a<i>R</i>)-8-(<i>tert</i>-Butyldimethylsilyloxy)-2,5,8a-trimethyl-4a,5,8,8a-tetrahydronaphthalene-1,4-dione","Acta Crystallographica Section E","2013","69","3","o325","","10.1107/S1600536813002973","","","0.71073","MoKα","","0.2472","0.0621","","","0.1182","0.1653","","","","","","0.925","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2237973","10.036","0.002","10.064","0.002","14.264","0.003","90","","107.3","0.01","90","","1375.5","0.5","297","2","297","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Li3[AsS4].8H2O","Trilithium thioarsenate octahydrate","","- As H16 Li3 O8 S4 -","- As H16 Li3 O8 S4 -","- As4 H64 Li12 O32 S16 -","4","1","PJ2002","Mereiter, Kurt","Trilithium thioarsenate octahydrate","Acta Crystallographica Section E","2013","69","5","i30","i31","10.1107/S1600536813010921","","","0.71073","MoKα","","0.0485","0.0278","","","0.0515","0.0573","","","","","","1.051","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238606","18.768","0.003","6.489","0.0009","18.681","0.003","90","","103.896","0.01","90","","2208.5","0.6","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Bis((<i>E</i>)-2-{3-[4-(1<i>H</i>-imidazol-1-yl-κ<i>N</i>^3^)styryl]-5,5-dimethylcyclohex-2-enylidene}malononitrile)diiodidomercury(II)","","- C44 H40 Hg I2 N8 -","- C44 H40 Hg I2 N8 -","- C88 H80 Hg2 I4 N16 -","2","0.5","CQ2006","Xi, Wen-Gang; Wu, Zhi-Chao; Zhou, Hong-Ping","Bis((<i>E</i>)-2-{3-[4-(1<i>H</i>-imidazol-1-yl-κ<i>N</i>^3^)styryl]-5,5-dimethylcyclohex-2-enylidene}malononitrile)diiodidomercury(II)","Acta Crystallographica Section E","2013","69","10","m548","","10.1107/S1600536813025191","","","0.71069","MoKα","","0.0384","0.036","","","0.0895","0.092","","","","","","1.035","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238783","7.613","0.0007","14.2716","0.0014","16.2594","0.0013","90","","114.556","0.004","90","","1606.8","0.3","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Bis(μ-hydroxido-κ^2^<i>O</i>:<i>O</i>)bis[bis(5-carboxypyridine-2-carboxylato-κ^2^<i>N</i>,<i>O</i>^2^)iron(III)] dihydrate","","- C28 H22 Fe2 N4 O20 -","- C28 H22 Fe2 N4 O20 -","- C56 H44 Fe4 N8 O40 -","2","0.5","RZ5089","Cao, Wenhai","Bis(μ-hydroxido-κ^2^<i>O</i>:<i>O</i>)bis[bis(5-carboxypyridine-2-carboxylato-κ^2^<i>N</i>,<i>O</i>^2^)iron(III)] dihydrate","Acta Crystallographica Section E","2013","69","11","m625","","10.1107/S1600536813029449","","","0.71073","MoKα","","0.045","0.0345","","","0.0902","0.0962","","","","","","1.006","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238825","7.859","0.002","5.9448","0.0015","19.83","0.005","90","","100.962","0.003","90","","909.6","0.4","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","<i>catena</i>-Poly[2-methylpyridinium [tungstate-di-μ-selenido-silver-di-μ-selenido] 2-methylpyridine monosolvate]","","- C12 H15 Ag N2 Se4 W -","- C12 H15 Ag N2 Se4 W -","- C24 H30 Ag2 N4 Se8 W2 -","2","0.5","XU5746","Zhou, Lu-Jun; Shi, Hua-Tian; Xu, Chao; Chen, Qun; Zhang, Qian-Feng","<i>catena</i>-Poly[2-methylpyridinium [tungstate-di-μ-selenido-silver-di-μ-selenido] 2-methylpyridine monosolvate]","Acta Crystallographica Section E","2013","69","11","m608","","10.1107/S1600536813028213","","","0.71073","MoKα","","0.05","0.0337","","","0.0713","0.0778","","","","","","0.968","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2239075","7.8608","0.0006","5.6985","0.0007","38.817","0.003","90","","98.733","0.006","90","","1718.6","0.3","200","1","200","1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","caesium cinnamate cinnamic acid","Poly[μ~5~-{hydrogen bis[(<i>E</i>)-cinnamato]}-caesium]","","- C18 H15 Cs O4 -","- C18 H15 Cs O4 -","- C72 H60 Cs4 O16 -","4","1","WM2798","Smith, Graham","Poly[μ~5~-{hydrogen bis[(<i>E</i>)-cinnamato]}-caesium]","Acta Crystallographica Section E","2014","70","2","m43","m44","10.1107/S1600536814000804","","","0.71073","MoKα","","0.0912","0.0708","","","0.1352","0.1435","","","","","","1.186","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2239214","21.0215","0.0015","5.6564","0.0005","28.785","0.002","90","","110.543","0.003","90","","3205.1","0.4","147","2","147","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","3-Methoxy-2-[5-(naphthalen-2-yl)-4,5-dihydro-1<i>H</i>-pyrazol-3-yl]phenol","","- C20 H18 N2 O2 -","- C20 H18 N2 O2 -","- C160 H144 N16 O16 -","8","2","IS5346","Koh, Dongsoo; Lim, Yoongho; Lough, Alan J.","3-Methoxy-2-[5-(naphthalen-2-yl)-4,5-dihydro-1<i>H</i>-pyrazol-3-yl]phenol","Acta Crystallographica Section E","2014","70","4","o464","","10.1107/S1600536814005972","","","1.54178","CuKα","","0.0424","0.0365","","","0.0941","0.0971","","","","","","1.053","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2239288","7.0284","0.0002","7.6736","0.0002","19.2668","0.0004","90","","99.355","0.002","90","","1025.3","0.05","110","2","110","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Potassium oxonate 2/3-hydrate","Poly[diaquatris(μ~6~-4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazine-2-carboxylato)tripotassium]","","- C6 H5 K1.5 N4.5 O7 -","- C6 H5 K1.5 N4.5 O7 -","- C24 H20 K6 N18 O28 -","4","1","WM5013","Soudani, Sarra; Aubert, Emmanuel; Wenger, Emmanuel; Jelsch, Christian; Gautier-Luneau, Isabelle; Ben Nasr, Cherif","Poly[diaquatris(μ~6~-4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazine-2-carboxylato)tripotassium]","Acta Crystallographica Section E","2014","70","5","m174","m175","10.1107/S1600536814007569","","","0.71073","MoKα","","0.034","0.0274","","","0.0635","0.067","","","","","","0.925","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2239492","13.6308","0.0014","5.4023","0.0005","17.5751","0.0019","90","","93.065","0.004","90","","1292.3","0.2","296","2","296","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","(2<i>E</i>)-2-Benzylidene-<i>N</i>-phenylhydrazinecarboxamide","","- C14 H13 N3 O -","- C14 H13 N3 O -","- C56 H52 N12 O4 -","4","1","YK2104","Layana, S. R.; Sithambaresan, M.; Siji, V. L.; Sudarsanakumar, M. R.; Suma, S.","(2<i>E</i>)-2-Benzylidene-<i>N</i>-phenylhydrazinecarboxamide","Acta Crystallographica Section E","2014","70","5","o591","","10.1107/S1600536814008344","","","0.71073","MoKα","","0.0659","0.0443","","","0.1201","0.1457","","","","","","1.039","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2239523","12.285","0.003","4.8482","0.001","15.271","0.003","90","","98","0.03","90","","900.7","0.3","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","<i>catena</i>-Poly[[dichloridomercury(II)]-μ-1,4-bis[2-(pyridin-4-yl)ethynyl]benzene-κ^2^<i>N</i>:<i>N'</i>]","","- C20 H12 Cl2 Hg N2 -","- C20 H12 Cl2 Hg N2 -","- C40 H24 Cl4 Hg2 N4 -","2","0.5","","Wang, Bin; Li, Ming; Xie, Ya-bo","<i>catena</i>-Poly[[dichloridomercury(II)]-μ-1,4-bis[2-(pyridin-4-yl)ethynyl]benzene-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2014","70","6","m208","","10.1107/S1600536814010228","","","0.71073","MoKα","","0.0291","0.028","","","0.0688","0.0699","","","","","","0.915","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2239578","18.2973","0.0006","7.02041","0.00014","20.1554","0.0006","90","","104.601","0.003","90","","2505.44","0.13","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","1-[Bis(4-fluorophenyl)methyl]-4-[(2<i>Z</i>)-3-phenylprop-2-en-1-yl]piperazine-1,4-diium dichloride monohydrate","1-[Bis(4-fluorophenyl)methyl]-4-[(2<i>Z</i>)-3-phenylprop-2-en-1-yl]piperazine-1,4-diium dichloride hemihydrate","","- C26 H29 Cl2 F2 N2 O0.5 -","- C26 H29 Cl2 F2 N2 O0.5 -","- C104 H116 Cl8 F8 N8 O2 -","4","1","SJ5400","Shivaprakash, S.; Chandrasekara Reddy, G.; Jasinski, Jerry P.","1-[Bis(4-fluorophenyl)methyl]-4-[(2<i>Z</i>)-3-phenylprop-2-en-1-yl]piperazine-1,4-diium dichloride hemihydrate","Acta Crystallographica Section E","2014","70","6","o694","o695","10.1107/S1600536814011064","","","0.71073","MoKα","","0.0774","0.0568","","","0.1406","0.1533","","","","","","1.086","","","","has coordinates,has Fobs","196234","2020-10-21","18:00:00",""
"2239819","13.3527","0.0009","12.4492","0.001","14.8935","0.0014","90","","95.604","0.004","90","","2463.9","0.3","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Bis(4-nitroaniline-κ<i>N</i>^1^)(5,10,15,20-tetraphenylporphyrinato-κ^4^<i>N</i>)cobalt(III) chloride dichloromethane monosolvate","","- C57 H42 Cl3 Co N8 O4 -","- C57 H42 Cl3 Co N8 O4 -","- C114 H84 Cl6 Co2 N16 O8 -","2","0.5","","Belghith, Yassine; Mansour, Anissa; Nasri, Habib","Crystal structure of bis(4-nitroaniline-κ<i>N</i>^1^)(5,10,15,20-tetraphenylporphyrinato-κ^4^<i>N</i>)cobalt(III) chloride dichloromethane monosolvate","Acta Crystallographica Section E","2014","70","9","m312","m313","10.1107/S1600536814016274","","","0.71073","MoKα","","0.0483","0.0388","","","0.0912","0.0967","","","","","","1.037","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2239823","6.2771","0.0008","4.429","0.0006","8.3596","0.001","90","","91.695","0.004","90","","232.31","0.05","295","2","295","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","Mercurous sulfate","Mercury(I) sulfate","","- Hg2 O4 S -","- Hg2 O4 S -","- Hg4 O8 S2 -","2","0.5","HB0012","Weil, Matthias","Crystal structure of Hg2SO4‒ a redetermination","Acta Crystallographica Section E Structure Reports Online","2014","70","9","i44","","10.1107/S1600536814011155","","","0.71073","MoKα","","0.038","0.0354","","","0.0856","0.0871","","","","","","1.058","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2240596","7.999","0.0016","16.532","0.003","15.43","0.003","90","","101.36","0.03","90","","2000.5","0.7","260","2","260","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","Bis[<i>trans</i>-(1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>)bis(thiocyanato-κ<i>N</i>)chromium(III)] tetrachloridozincate","","- C24 H48 Cl4 Cr2 N12 S4 Zn -","- C24 H48 Cl4 Cr2 N12 S4 Zn -","- C48 H96 Cl8 Cr4 N24 S8 Zn2 -","2","0.5","SJ5452","Moon, Dohyun; Ryoo, Keon Sang; Choi, Jong-Ha","Crystal structure of bis[<i>trans</i>-(1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>)bis(thiocyanato-κ<i>N</i>)chromium(III)] tetrachloridozincate from synchrotron data","Acta Crystallographica Section E","2015","71","5","540","543","10.1107/S205698901500746X","","","0.61","synchrotron","","0.0266","0.0251","","","0.0709","0.0716","","","","","","1.056","","","","has coordinates,has Fobs","136388","2020-10-21","18:00:00",""
"2240618","7.8158","0.0011","6.4651","0.0003","12.725","0.0018","90","","131.45","0.02","90","","481.95","0.18","110","2","110","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Ytterbium (III) Chloride Hexahydrate","Hexaaquadichloridoytterbium(III) chloride","","- Cl3 H12 O6 Yb -","- Cl3 H12 O6 Yb -","- Cl6 H24 O12 Yb2 -","2","0.5","BR2249","Knopf, Kevin M.; Crundwell, Guy; Westcott, Barry L.","Crystal structure of hexaaquadichloridoytterbium(III) chloride","Acta Crystallographica Section E","2015","71","6","i5","","10.1107/S2056989015008488","","","0.71073","MoKα","","0.0186","0.0178","","","0.0406","0.041","","","","","","1.117","","","","has coordinates,has Fobs","136410","2020-10-21","18:00:00",""
"2240823","9.2432","0.0006","4.3392","0.0002","20.1953","0.0013","90","","98.468","0.003","90","","801.16","0.08","120","","120","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Diiodo-pyridine","Pyridine‒diiodine (1/1)","","- C5 H5 I2 N -","- C5 H5 I2 N -","- C20 H20 I8 N4 -","4","1","RZ5157","Tuikka, Matti; Haukka, Matti","Crystal structure of the pyridine‒diiodine (1/1) adduct","Acta Crystallographica Section E","2015","71","7","o463","","10.1107/S2056989015010518","","","0.71073","MoKα","","0.0725","0.0486","","","0.0827","0.0912","","","","","","1.073","","","","has coordinates,has Fobs","139191","2020-10-21","18:00:00",""
"2240887","4.698","0.0003","5.738","0.0004","4.896","0.0004","90","","90.311","0.007","90","","131.98","0.016","293","2","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","β-Zinc molybdate","","- Mo O4 Zn -","- Mo O4 Zn -","- Mo2 O8 Zn2 -","2","0.5","","Mtioui-Sghaier, Olfa; Mendoza-Meroño, Rafael; Ktari, Lilia; Dammak, Mohamed; García-Granda, Santiago","Redetermination of the crystal structure of β-zinc molybdate from single-crystal X-ray diffraction data","Acta Crystallographica Section E","2015","71","7","i6","i7","10.1107/S205698901501186X","","","0.71073","MoKα","","0.0361","0.0284","","","0.0623","0.0679","","","","","","1.098","","","","has coordinates,has Fobs","139746","2020-10-21","18:00:00",""
"2241004","20.908","0.0013","4.7429","0.0002","10.681","0.0006","90","","96.419","0.003","90","","1052.54","0.1","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","1-[({5-[[(2-Oxidonaphthalen-1-yl)methylidene]azaniumyl]pentyl}iminiumyl)methyl]naphthalen-2-olate","1,1'-{(Pentane-1,5-diyl)bis[(azaniumylylidene)methanylylidene]}bis(naphthalen-2-olate)","","- C27 H26 N2 O2 -","- C27 H26 N2 O2 -","- C54 H52 N4 O4 -","2","0.5","","Ouari, Kamel; Merzougui, Moufida; Karmazin, Lydia","Crystal structure of 1,1'-{(pentane-1,5-diyl)bis[(azaniumylylidene)methanylylidene]}bis(naphthalen-2-olate)","Acta Crystallographica Section E","2015","71","9","1010","1012","10.1107/S2056989015014437","","","0.71073","MoKα","","0.0762","0.0491","","","0.1082","0.1196","","","","","","1.082","","","","has coordinates,has Fobs","153391","2020-10-21","18:00:00",""
"2241477","16.564","0.002","6.3581","0.0007","15.962","0.002","90","","105.239","0.005","90","","1621.9","0.3","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","(1<i>E</i>,4<i>E</i>)-1,5-Bis(5-bromothiophen-2-yl)-2,4-dimethylpenta-1,4-dien-3-one","","- C15 H12 Br2 O S2 -","- C15 H12 Br2 O S2 -","- C60 H48 Br8 O4 S8 -","4","1","BG2578","Nithya, C.; Sithambaresan, M.; Kurup, M. R. Prathapachandra","Crystal structures of (1<i>E</i>,4<i>E</i>)-1,5-bis(5-bromothiophen-2-yl)-2,4-dimethylpenta-1,4-dien-3-one and (<i>E</i>)-4-(5-bromothiophen-2-yl)-1,3-diphenylbut-3-en-2-one","Acta Crystallographica Section E","2016","72","2","199","202","10.1107/S205698901600058X","","","0.71073","MoKα","","0.1394","0.0591","","","0.1439","0.181","","","","","","0.984","","","","has coordinates,has Fobs","174633","2020-10-21","18:00:00",""
"2241546","18.9744","0.0004","16.0269","0.0003","21.1146","0.0004","90","","100.808","0.001","90","","6307.1","0.2","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","<i>S</i>-Hexyl (<i>E</i>)-3-(2-hydroxybenzylidene)dithiocarbazate","","- C14 H20 N2 O S2 -","- C14 H20 N2 O S2 -","- C224 H320 N32 O16 S32 -","16","4","","Begum, M. S.; Howlader, M. B. H.; Sheikh, M. C.; Miyatake, R.; Zangrando, E.","Crystal structure of <i>S</i>-hexyl (<i>E</i>)-3-(2-hydroxybenzylidene)dithiocarbazate","Acta Crystallographica Section E","2016","72","3","290","292","10.1107/S2056989016001857","","","1.54187","CuKα","","0.0876","0.0646","","","0.1605","0.1756","","","","","","0.933","","","","has coordinates,has Fobs","176360","2020-10-21","18:00:00",""
"2243679","10.7245","0.0003","6.205","0.0003","15.1579","0.0005","90","","103.14","0.003","90","","982.28","0.06","200","2","200","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Bis(tetramethylthiourea-κ<i>S</i>)bis(thiocyanato-κ<i>N</i>)nickel(II)","","- C12 H24 N6 Ni S4 -","- C12 H24 N6 Ni S4 -","- C24 H48 N12 Ni2 S8 -","2","0.5","TX2033","Jochim, Aleksej; Radulovic, Rastko; Jess, Inke; Näther, Christian","Crystal structure of bis(tetramethylthiourea-κ<i>S</i>)bis(thiocyanato-κ<i>N</i>)nickel(II)","Acta Crystallographica Section E","2020","76","12","1841","1845","10.1107/S2056989020015121","","","0.71073","MoKα","","0.0497","0.0384","","","0.0929","0.0981","","","","","","1.046","","","","has coordinates,has Fobs","259161","2020-11-18","05:09:43",""
"2243769","15.037","0.001","8.4266","0.0006","19.471","0.001","90","","96.246","0.006","90","","2452.5","0.3","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","5'-(2,4-Dichlorophenoxy)-3'-methyl-1'-phenyl-5-(thiophen-2-yl)-3,4-dihydro-1'<i>H</i>,2<i>H</i>-3,4'-bipyrazole-2-carbothioamide hemihydrate","","- C48 H40 Cl4 N10 O3 S4 -","- C48 H40 Cl4 N10 O3 S4 -","- C96 H80 Cl8 N20 O6 S8 -","2","0.5","DX2035","Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Manju, Nagaraja; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher","Reduced 3,4'-bipyrazoles carrying thiophene and thiazole substituents: structures of two intermediates and two products","Acta Crystallographica Section E","2021","77","4","335","340","10.1107/S2056989021002310","","","0.71073","MoKα","","0.1008","0.0464","","","0.0832","0.0965","","","","","","0.979","","","","has coordinates,has disorder,has Fobs","262792","2021-03-06","06:20:26",""
"2244094","11.4741","0.001","7.677","0.0005","17.2226","0.0014","90","","108.166","0.006","90","","1441.5","0.2","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","2-<i>tert</i>-Butyl-4-methylphenol–\ 1,3,6,8-tetraazatricyclo[4.4.1.1^3,8^]dodecane (2/1)","","- C30 H48 N4 O2 -","- C30 H48 N4 O2 -","- C60 H96 N8 O4 -","2","0.5","YZ2019","Rivera, Augusto; Ríos-Motta, Jaime; Bolte, Michael","First hydrogen-bonded adduct of sterically hindered 2-<i>tert</i>-butyl-4-methylphenol (TBMP) with 1,3,6,8-tetraazatricyclo[4.4.1.1^3,8^]dodecane (TATD) <i>via</i> coupling of classical hydrogen bonds and C—H···π non-covalent interactions","Acta Crystallographica Section E","2022","78","6","","","10.1107/S2056989022004972","","","0.71073","MoKα","","0.0575","0.0495","","","0.1268","0.1318","","","","","","1.05","","","","has coordinates,has Fobs","275502","2022-05-18","01:43:32",""
"2244231","11.9096","0.0001","5.5836","0.0001","16.8121","0.0002","90","","105.356","0.001","90","","1078.07","0.03","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","3-(3-Hydroxyphenyl)-1-(1<i>H</i>-pyrrol-2-yl)prop-2-en-1-one hemihydrate","","- C26 H24 N2 O5 -","- C26 H24 N2 O5 -","- C52 H48 N4 O10 -","2","0.5","YZ2023","Ismail, Ahmad Zaidi; Gunasekharan, Mohanapriya; Karunakaran, Thiruventhan; Mohd Faudzi, Siti Munirah","Crystal structure and Hirshfeld surface analysis of 3-(3-hy-droxy-phen-yl)-1-(1<i>H</i>-pyrrol-2-yl)prop-2-en-1-one hemihydrate.","Acta crystallographica. Section E, Crystallographic communications","2023","79","Pt 4","287","291","10.1107/S2056989023001925","","","1.54184","CuKα","","0.0364","0.0344","","","0.0926","0.0947","","","","","","1.04","","","","has coordinates,has Fobs","283592","2023-05-06","10:48:00",""
"2300508","12.8209","0.0009","7.0395","0.0004","14.7623","0.0007","90","","96.82","0.003","90","","1322.91","0.14","193","2","193","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C32 H28 N4 O4 -","- C32 H28 N4 O4 -","- C64 H56 N8 O8 -","2","0.5","","Kong, Jianfei; Du, Jialei; Wang, Jiren; Chen, Zuofeng","Supramolecular organic frameworks of a Schiff base showing selective guest adsorption","Journal of Applied Crystallography","2015","48","3","","","10.1107/S1600576715005889","","","0.71073","MoKα","","0.1084","0.0727","","","0.1769","0.1953","","","","","","1.049","","","","has coordinates,has Fobs","136478","2020-10-21","18:00:00",""
"2310568","6.404","","6.559","","6.586","","90","","119.51","","90","","240.749","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Na2 (S2 O4)","","- Na2 O4 S2 -","- Na2 O4 S2 -","- Na4 O8 S4 -","2","0.5","","Dunitz, J.D.","The structure of sodium dithionite and the nature of the dithionite ion","Acta Crystallographica (1,1948-23,1967)","1956","9","","579","586","","","","","","","","","","","","","","","","","","","","","","has coordinates","150701","2020-10-21","18:00:00",""
"2310619","4.6","","5.66","","4.91","","90","","90.01","","90","","127.837","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Ni (W O4)","","- Ni O4 W -","- Ni O4 W -","- Ni2 O8 W2 -","2","0.5","","Keeling, R.O.jr.","The structure of Ni W O4","Acta Crystallographica (1,1948-23,1967)","1957","10","","209","213","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310989","8.96","","4.49","","14.62","","90","","145.43","","90","","333.734","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Au Ag Te4","","- Ag Au Te4 -","- Ag Au Te4 -","- Ag2 Au2 Te8 -","2","0.5","","Tunell, G.; Pauling, L.","The atomic arrangements and bonds of the gold-silver ditellurides","Acta Crystallographica (1,1948-23,1967)","1952","5","","375","381","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2311390","7.087","0.002","10.446","0.003","6.692","0.0016","90","","116.61","0.02","90","","442.9","0.2","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Dichlorido(1,2-phenylenediamine-κ^2^<i>N</i>,<i>N</i>')platinum(II)","","- C6 H8 Cl2 N2 Pt -","- C6 H8 Cl2 N2 Pt -","- C12 H16 Cl4 N4 Pt2 -","2","0.5","WM5396","Konno, Yosuke; Matsushita, Nobuyuki","Crystal structure of di-chlorido-(1,2-phenyl-enedi-amine-κ<sup>2</sup><i>N</i>,<i>N</i>')platinum(II).","Acta crystallographica. Section E, Crystallographic communications","2017","73","Pt 7","1009","1012","10.1107/S2056989017008477","","","0.71075","MoKα","","0.0359","0.0341","","","0.0978","0.0991","","","","","","1.179","","","","has coordinates","245846","2020-10-21","18:00:00",""
"2311442","11.9402","0.0007","3.7005","0.0002","21.7919","0.0013","90","","121.278","0.002","90","","822.92","0.08","120","1","120","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","bis(2-pyridone) chloranilic acid","Bis[pyridin-2(1<i>H</i>)-one] 2,5-dichloro-3,6-dihydroxy-1,4-bebzoquinone","","- C16 H12 Cl2 N2 O6 -","- C16 H12 Cl2 N2 O6 -","- C32 H24 Cl4 N4 O12 -","2","0.5","LH5855","Gotoh, Kazuma; Ishida, Hiroyuki","Crystal structures of three hydrogen-bonded 1:2 compounds of chloranilic acid with 2-pyridone, 3-hy-droxy-pyridine and 4-hyroxypyridine.","Acta crystallographica. Section E, Crystallographic communications","2017","73","Pt 10","1546","1550","10.1107/S2056989017013536","","","0.71075","MoKα","","0.0278","0.0271","","","0.0757","0.0763","","","","","","1.056","","","","has coordinates","245890","2020-10-21","18:00:00",""
"2311984","15.527","0.0005","7.46802","0.00001","17.0254","0.0005","90","","116.528","0.004","90","","1766.35","0.1","105","2","105","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","3,4-Dimethylpyridine‒3,4-dimethylpyridinium diiodidoaurate(I)","","- C14 H19 Au I2 N2 -","- C14 H19 Au I2 N2 -","- C56 H76 Au4 I8 N8 -","4","1","KY3135","Döring, Cindy; Sui, Zhihong; Jones, Peter G.","3,4-Lutidinium salts with the diiodidoaurate(I) anion: structure of [(3,4-lut)<sub>2</sub>H]<sup>+</sup>·[AuI<sub>2</sub>]<sup>-</sup> and of two polymorphs of [(3,4-lut)<sub>2</sub>H<sup>+</sup>]<sub>2</sub>·[AuI<sub>2</sub>]<sup>-</sup>·I<sup/>.","Acta crystallographica. Section C, Structural chemistry","2018","74","Pt 3","289","294","10.1107/S2053229618002218","","","0.71073","MoKα","","0.027","0.0207","","","0.0396","0.0411","","","","","","1.098","","","","has coordinates","246229","2020-10-21","18:00:00",""
"3500069","15.1054","0.0008","5.0745","0.0003","10.7172","0.0006","90","","91.721","0.002","90","","821.13","0.08","100","","100","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C12 H32 Cl2 N2 O -","- C12 H32 Cl2 N2 O -","- C24 H64 Cl4 N4 O2 -","2","0.5","","Thierry Maris","","Personal communication to COD","2017","","","","","","","x-ray","1.34139","GaKα","","0.0321","0.0297","","","0.0771","0.0792","","","","","","1.058","","","","has coordinates,has Fobs","197525","2020-10-21","18:00:00",""
"4000107","9.6096","0.0001","12.561","0.0001","13.9736","0.0002","90","","109.239","0.001","90","","1592.5","0.03","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C27 H21 Co3 K O23 -","- C27 H11 Co3 K O23 -","- C54 H22 Co6 K2 O46 -","2","0.5","","","","Chemistry of Materials","2001","","","","","","","","0.71073","MoKα","","0.0367","0.0306","","","0.0861","0.0889","","","","","","1.065","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4000395","14.8651","0.0014","7.5694","0.0007","22.796","0.002","90","","106.833","0.001","90","","2455.1","0.4","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C28 H62 Co3 N6 O31 P4 -","- C28 H32 Co3 N6 O31 P4 -","- C56 H64 Co6 N12 O62 P8 -","2","0.5","","","","Chemistry of Materials","2004","","","","","10.1021/cm0498990","","","0.71073","MoKα","","0.121","0.0625","","","0.1342","0.1636","","","","","","1.04","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000396","14.3635","0.0008","12.0029","0.0006","16.9974","0.0009","90","","113.381","0.001","90","","2689.8","0.2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C28 H46 N6 O25 P4 Zn5 -","- C28 H24 N6 O25 P4 Zn5 -","- C56 H48 N12 O50 P8 Zn10 -","2","0.5","","","","Chemistry of Materials","2004","","","","","10.1021/cm0498990","","","0.71073","MoKα","","0.0811","0.0565","","","0.1402","0.1592","","","","","","1.08","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4000807","4.542","0.006","5.461","0.016","4.98","0.009","90.5","0.2","86.8","0.13","89.84","0.19","123.3","0.5","293","2","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Cu O4 W -","- Cu O4 W -","- Cu2 O8 W2 -","2","0.5","","Ruiz-Fuertes, J.; Friedrich, A.; Pellicer-Porres, J.; Errandonea, D.; Segura, A.; Morgenroth, W.; Haussühl, E.; Tu, C.-Y.; Polian, A.","Structure Solution of the High-Pressure Phase of CuWO4and Evolution of the Jahn‒Teller Distortion","Chemistry of Materials","2011","23","18","4220","","10.1021/cm201592h","","","0.45","","","0.0308","0.0308","","","0.0663","0.0663","","","","","","1.119","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001068","19.039","0.004","8.933","0.0018","13.876","0.003","90","","111.37","0.03","90","","2197.7","0.9","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C14 H22 Cd N8 O6 S2 -","- C14 H22 Cd N8 O6 S2 -","- C56 H88 Cd4 N32 O24 S8 -","4","1","","Mandal, Trinanjana; Stavila, Vitalie; Rusakova, Irene; Ghosh, Saunab; Whitmire, Kenton H.","Molecular Precursors for CdS Nanoparticles: Synthesis and Characterization of Carboxylate−Thiourea or −Thiosemicarbazide Cadmium Complexes and Their Decomposition","Chemistry of Materials","2009","21","23","5617","","10.1021/cm902230u","","","0.71073","MoKα","","0.0842","0.0296","","","0.0627","0.0683","","","","","","0.595","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001393","17.638","0.004","9.4889","0.0019","26.369","0.005","90","","115.47","0.03","90","","3984.3","1.7","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C30 H82.9 In5 N5 O1.45 S19 Sb6 -","- C24.82 H58.2 In5 N3.97 O1.46 S19 Sb6 -","- C49.64 H116.4 In10 N7.94 O2.92 S38 Sb12 -","2","0.5","","Ding, Nan; Kanatzidis, Mercouri G.","Permeable Layers with Large Windows in [(CH3CH2CH2)2NH2]5In5Sb6S19·1.45 H2O: High Ion-Exchange Capacity, Size Discrimination, and Selectivity for Cs Ions","Chemistry of Materials","2007","19","16","3867","","10.1021/cm071179g","","","0.71073","MoKα","","0.0768","0.0584","","","0.1547","0.1655","","","","","","1.096","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001727","7.575","","5.92","","12.148","","90","","113.56","","90","","499.354","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","K2 (Ag2 Sn Se4)","","- Ag2 K2 Se4 Sn -","- Ag2 K2 Se4 Sn -","- Ag4 K4 Se8 Sn2 -","2","0.5","","Fu, A.-H.; Chen, X.; Huang, X.-Y.; Guo, H.-Y.; Li, J.; Zhang, L.-D.","From 1D chain to 3D network: syntheses, structures, and 1D properties of K2 Mn Sn2 Se6, K2 Mn Sn Se4, and K2 Ag2 Sn Se4","Chemistry of Materials (1,1989-)","2000","12","","2385","2391","","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4003432","23.5987","0.0008","9.4951","0.0002","15.7871","0.0005","90","","91.653","0.003","90","","3535.98","0.18","150.01","0.1","150.01","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","2-bromo-N,N,N-trimethylethan-1-aminium tetrabromomanganate(II)","","- C12 H30 Br6 Mn N2 -","- C12 H30 Br6 Mn N2 -","- C72 H180 Br36 Mn6 N12 -","6","1.5","","Morad, Viktoriia; Cherniukh, Ihor; Pöttschacher, Lena; Shynkarenko, Yevhen; Yakunin, Sergii; Kovalenko, Maksym V.","Manganese(II) in Tetrahedral Halide Environment: Factors Governing Bright Green Luminescence","Chemistry of Materials","2019","","","","","10.1021/acs.chemmater.9b03782","","x-ray","0.71073","MoKα","","0.1023","0.0577","","","0.0719","0.0813","","","","","","1.078","","","","has coordinates","243736","2020-10-21","18:00:00",""
"4004028","20.6808","0.0003","15.8316","0.0002","16.3301","0.0003","90","","94.133","0.001","90","","5332.74","0.14","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","JUK-20-noh","","","- C40 H39 Cd N9 O7 -","- C40 H39 Cd N9 O7 -","- C160 H156 Cd4 N36 O28 -","4","1","","Jędrzejowski, Damian; Pander, Marzena; Nitek, Wojciech; Bury, Wojciech; Matoga, Dariusz","Turning Flexibility into Rigidity: Stepwise Locking of Interpenetrating Networks in a MOF Crystal through Click Reaction","Chemistry of Materials","2021","33","18","7509","7517","10.1021/acs.chemmater.1c02451","","x-ray","1.54184","CuKα","","0.0723","0.0677","","","0.2002","0.2045","","","","","","1.055","","","","has coordinates,has disorder","269506","2021-10-03","21:46:34",""
"4004030","20.3536","0.0001","15.8322","0.0001","16.8859","0.0002","90","","94.971","0.001","90","","5420.88","0.08","120","2","120","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","JUK-20-nor","","","- C29 H20 Cd N8 O5 -","- C29 H20 Cd N8 O5 -","- C116 H80 Cd4 N32 O20 -","4","1","","Jędrzejowski, Damian; Pander, Marzena; Nitek, Wojciech; Bury, Wojciech; Matoga, Dariusz","Turning Flexibility into Rigidity: Stepwise Locking of Interpenetrating Networks in a MOF Crystal through Click Reaction","Chemistry of Materials","2021","33","18","7509","7517","10.1021/acs.chemmater.1c02451","","x-ray","0.71073","MoKα","","0.081","0.0602","","","0.1733","0.1942","","","","","","1.038","","","","has coordinates,has disorder","269508","2021-10-03","21:47:21",""
"4004032","20.3536","0.0001","15.8322","0.0001","16.8859","0.0002","90","","94.971","0.001","90","","5420.88","0.08","120","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","JUK-20-noh","","","- C36 H30 Cd N8 O5 -","- C36 H30 Cd N8 O5 -","- C144 H120 Cd4 N32 O20 -","4","1","","Jędrzejowski, Damian; Pander, Marzena; Nitek, Wojciech; Bury, Wojciech; Matoga, Dariusz","Turning Flexibility into Rigidity: Stepwise Locking of Interpenetrating Networks in a MOF Crystal through Click Reaction","Chemistry of Materials","2021","33","18","7509","7517","10.1021/acs.chemmater.1c02451","","","0.71073","MoKα","","0.0959","0.0746","","","0.2279","0.2502","","","","","","1.069","","","","has coordinates,has disorder","269510","2021-10-03","21:48:13",""
"4004035","20.488","0.0004","15.7873","0.0002","16.812","0.0004","90","","95.489","0.002","90","","5412.91","0.18","121","2","121","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","JUK-20-chx","","","- C35 H28 Cd N8 O5 -","- C35 H28 Cd N8 O5 -","- C140 H112 Cd4 N32 O20 -","4","1","","Jędrzejowski, Damian; Pander, Marzena; Nitek, Wojciech; Bury, Wojciech; Matoga, Dariusz","Turning Flexibility into Rigidity: Stepwise Locking of Interpenetrating Networks in a MOF Crystal through Click Reaction","Chemistry of Materials","2021","33","18","7509","7517","10.1021/acs.chemmater.1c02451","","x-ray","0.71073","MoKα","","0.1463","0.1067","","","0.2639","0.2979","","","","","","1.054","","","","has coordinates,has disorder","269513","2021-10-03","21:49:21",""
"4020529","7.722","0.004","7.949","0.003","7.405","0.003","90","","91.783","0.017","90","","454.3","0.3","105","","105","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C8 H8 Br Cl O2 -","- C8 H8 Br Cl O2 -","- C16 H16 Br2 Cl2 O4 -","2","0.5","","Youjun Yang; Jorge O. Escobedo; Alexander Wong; Corin M. Schowalter; Michael C. Touchy; Lijuan Jiao; William E. Crowe; Frank R. Fronczek; Robert M. Strongin","A Convenient Preparation of Xanthene Dyes","Journal of Organic Chemistry","2005","70","","6907","6912","10.1021/jo051002a","","","","","","","","","","","","","","","","","","","","","has coordinates","178383","2020-10-21","18:00:00",""
"4020672","20.275","0.002","6.5897","0.0007","28.606","0.002","90","","113.243","0.006","90","","3511.7","0.6","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C42 H40 Ag N3 O7 -","- C42 H40 Ag N3 O7 -","- C168 H160 Ag4 N12 O28 -","4","1","","Teh-Chang Chou; Ching-Lun Hwa; Jin-Ju Lin; Kung-Ching Liao; Jui-Chang Tseng","Bicyclo[2.2.2]octene-Based ""Crab-like"" Molecules: Synthesis, Complexation, Luminescence Properties, and Solid-State Structures","Journal of Organic Chemistry","2005","70","","9717","9726","10.1021/jo051006f","","","0.71073","MoKα","","0.1287","0.0653","","","0.1607","0.1944","","","","","","0.964","","","","has coordinates","178384","2020-10-21","18:00:00",""
"4021725","18.3914","0.0016","12.5889","0.0011","32.662","0.003","90","","122.009","0.004","90","","6412.4","1","292","2","273","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C60 H70 N8 O21 -","- C60 H70 N8 O21 -","- C240 H280 N32 O84 -","4","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","","0.1153","0.0638","","","0.0937","0.0995","","","","","","1.031","","","","has coordinates","178395","2020-10-21","18:00:00",""
"4022163","24.4242","0.0003","12.9575","0.0002","15.6062","0.0002","90","","103.343","0.0006","90","","4805.67","0.11","200","2","200","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C22 H26 N4 O8 S -","- C22 H26 N4 O8 S -","- C176 H208 N32 O64 S8 -","8","2","","Michael Zöllinger; Peter Mayer; Thomas Lindel","Total Synthesis of the Cytostatic Marine Natural Product Dibromophakellstatin via Three-Component Imidazolidinone Anellation","Journal of Organic Chemistry","2006","71","","9431","9439","10.1021/jo061813u","","","0.71073","MoKα","","0.0759","0.0435","","","0.1138","0.1288","","","","","","1.046","","","","has coordinates,has disorder","178399","2020-10-21","18:00:00",""
"4022620","10.2805","0.0005","8.8859","0.0004","15.8645","0.0006","90","","91.645","0.003","90","","1448.65","0.11","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C11 H13 N3 O2 S2 -","- C11.98 H9.325 N3.5 O2 S2 -","- C47.92 H37.3 N14 O8 S8 -","4","1","","Ali Asadi; Brian O. Patrick; David M. Perrin","Janus-AT Bases: Synthesis, Self-Assembly, and Solid State Structures","Journal of Organic Chemistry","2007","72","","466","475","10.1021/jo061840k","","","0.71073","MoKα","","0.0566","0.0464","","","0.1219","0.1299","","","","","","1.035","","","","has coordinates,has disorder","178405","2020-10-21","18:00:00",""
"4024040","16.123","0.005","7.045","0.005","21.453","0.005","90","0.005","106.869","0.005","90","0.005","2331.9","1.9","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C25 H17 F5 N3 O2 -","- C25 H17 F5 N3 O2 -","- C100 H68 F20 N12 O8 -","4","1","","Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport","Enols of Substituted Cyanomalonamides","Journal of Organic Chemistry","2007","72","","5297","5312","10.1021/jo070877h","","","0.71069","MoKα","","0.1907","0.1026","","","0.1994","0.2384","","","","","","1.063","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4025415","14.136","0.0003","4.995","0.0001","17.563","0.0003","90","","112.544","0.002","90","","1145.35","0.04","","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C9 H7 Br2 Cl2 N2 O -","- C10 H7 Br2 Cl N2 O -","- C40 H28 Br8 Cl4 N8 O4 -","4","1","","Mohamed Abboud; Victor Mamane; Emmanuel Aubert; Claude Lecomte; Yves Fort","Synthesis of Polyhalogenated 4,4'-Bipyridines via a Simple Dimerization Procedure","Journal of Organic Chemistry","2010","75","","3224","3231","10.1021/jo100152e","","","","","","","","","","","","","","","","","","","","","has coordinates","178433","2020-10-21","18:00:00",""
"4025751","12.7933","0.0005","7.6796","0.0003","17.9035","0.0007","90","","110.324","0.002","90","","1649.47","0.11","173","1","173","1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","1,3-bis[bis[diisopropylamino)phosphino]-1H-imidazol-2-ylidene","","- C27 H58 N6 P2 -","- C27 H58 N6 P2 -","- C54 H116 N12 P4 -","2","0.5","","Anatolii P. Marchenko; Heorgii N. Koidan; Anastasiya N. Huryeva; Evgeniy V. Zarudnitskii; Aleksandr A. Yurchenko; Aleksandr N. Kostyuk","N-Phosphorylated Imidazolium Salts as Precursors to 2- and 5-Phosphorylated Imidazoles and New Imidazol-2-ylidenes Featuring the PNCN Unit","Journal of Organic Chemistry","2010","75","","7141","7145","10.1021/jo101177h","","","0.71073","MoKα","","0.0704","0.045","","","0.0933","0.1042","","","","","","1.033","","","","has coordinates","178436","2020-10-21","18:00:00",""
"4025922","15.4348","0.0004","5.1653","0.0002","12.6502","0.0003","90","","95.858","0.001","90","","1003.28","0.05","100","","100","","","","","","","","Synthesized by the authors. See text","4","P 1 2/c 1","-P 2yc","13","","","","- C18 H22 N12 O2 -","- C18 H22 N12 O2 -","- C36 H44 N24 O4 -","2","0.5","","Adam Duong; Thierry Maris; Olivier Lebel; James D. Wuest","Syntheses and Structures of Isomeric Diaminotriazinyl-Substituted 2,2'-Bipyridines and 1,10-Phenanthrolines","Journal of Organic Chemistry","2011","76","","1333","1341","10.1021/jo102191n","","","1.54178","CuKα","","0.0456","0.0446","","","0.1381","0.1396","","","","","","1.065","","","","has coordinates","178438","2020-10-21","18:00:00",""
"4026018","16.4839","0.0011","6.674","0.0004","22.516","0.002","90","","120.625","0.006","90","","2131.6","0.3","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C21 H25 O7 P -","- C21 H25 O7 P -","- C84 H100 O28 P4 -","4","1","","K. V. Sajna; Ramesh Kotikalapudi; Manab Chakravarty; N. N. Bhuvan Kumar; K. C. Kumara Swamy","Cycloaddition Reactions of Allenylphosphonates and Related Allenes with Dialkyl Acetylenedicarboxylates, 1,3-Diphenylisobenzofuran, and Anthracene","Journal of Organic Chemistry","2011","76","","920","938","10.1021/jo102240u","","","0.71073","MoKα","","0.0823","0.0447","","","0.0991","0.1084","","","","","","0.88","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4026759","15.717","","12.299","","15.454","","90","","95.11","","90","","2975.44","","297","2","297","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C18 H15 N O4 -","- C18 H15 N O4 -","- C144 H120 N8 O32 -","8","2","","Ta-Hsien Chuang; Wei-Yu Chang; Chien-Fu Li; Yu-Chia Wen; Chia-Chen Tsai","Substituent Effects on the Iodine-Catalyzed Thermal Cyclization of 3,4-Diphenylbuta-1,3-dienyl Isocyanates: Mechanistic Studies","Journal of Organic Chemistry","2011","76","","9678","9686","10.1021/jo2017247","","x-ray","0.71073","MoKα","","0.1248","0.0431","","","0.0699","0.0781","","","","","","0.957","","","","has coordinates","178446","2020-10-21","18:00:00",""
"4027244","20.464","0.003","6.1223","0.0009","19.024","0.003","90","","114.916","0.006","90","","2161.6","0.6","143","1","143","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C21 H30 F2 N2 O5 -","- C21 H30 F2 N2 O5 -","- C84 H120 F8 N8 O20 -","4","1","","Grant R. Krow; Matthew D. Shoulders; Ramakrishna Edupuganti; Deepa Gandla; Fang Yu; Philip E. Sonnet; Matthew Sender; Amit Choudhary; Charles DeBrosse; Charles W. Ross; Patrick Carroll; Ronald T. Raines","Synthesis of 5-Fluoro- and 5-Hydroxymethanoprolines via Lithiation of N-BOC-methanopyrrolidines. Constrained Cγ-Exo and Cγ-Endo Flp and Hyp Conformer Mimics","Journal of Organic Chemistry","2012","77","","5331","5344","10.1021/jo300700a","","","0.71073","MoKα","","0.1687","0.1252","","","0.3161","0.3533","","","","","","1.087","","","","has coordinates","178451","2020-10-21","18:00:00",""
"4027997","10.8266","0.0003","8.326","0.0002","19.1289","0.0005","90","","93.793","0.001","90","","1720.55","0.08","296","2","296","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","none","dimethyl (1RS, 4SR, 5SR, 6RS)-exo-5-((2'RS)-1'-indanon-2'-yl) bicyclo[2.2.1]hept-2-ene-endo-5,exo-6-dicarboxylate","","- C20 H20 O5 -","- C20 H20 O5 -","- C80 H80 O20 -","4","1","","Roman A. Valiulin; Teresa M. Arisco; Andrei G. Kutateladze","Photoinduced Intramolecular Cyclopentanation vs Photoprotolytic Oxametathesis in Polycyclic Alkenes Outfitted with Conformationally Constrained Aroylmethyl Chromophores","Journal of Organic Chemistry","2013","78","","2012","2025","10.1021/jo301909j","","","0.71073","MoKα","","0.0519","0.044","","","0.1221","0.1299","","","","","","1.028","","","","has coordinates","178458","2020-10-21","18:00:00",""
"4029021","9.9429","0.0013","9.5568","0.0013","18.306","0.003","90","","97.905","0.004","90","","1722.9","0.4","208","2","208","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","ccs23jul12","","","- C17 H28 Li N O2 -","- C17 H28 Li N O2 -","- C68 H112 Li4 N4 O8 -","4","1","","Su, Chicheung; Guang, Jie; Williard, Paul G.","Structures of Lithium N-Monosubstituted Anilides: Trisolvated Monomer to Tetrasolvated Dimer.","The Journal of organic chemistry","2014","79","3","1032","","10.1021/jo402498z","","","0.71073","","","0.0338","0.0291","","","0.0734","0.0772","","","","","","1.011","","","","has coordinates","178469","2020-10-21","18:00:00",""
"4029132","12.2601","0.0009","9.4289","0.0006","16.688","0.0004","90","","123.062","0.005","90","","1616.76","0.19","150","1","150","1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C34 H42 N4 S2 -","- C34 H42 N4 S2 -","- C68 H84 N8 S4 -","2","0.5","","Novakova, Veronika; Miletin, Miroslav; Filandrová, Tereza; Lenčo, Juraj; Růžička, Aleš; Zimcik, Petr","Role of steric hindrance in the newman-kwart rearrangement and in the synthesis and photophysical properties of arylsulfanyl tetrapyrazinoporphyrazines.","The Journal of organic chemistry","2014","79","5","2082","2093","10.1021/jo402791c","","","0.71073","MoKα","","0.0376","0.0306","","","0.0775","0.0857","","","","","","1.073","","","","has coordinates","178470","2020-10-21","18:00:00",""
"4029414","23.741","0.0017","8.7785","0.0006","28.77","0.002","90","","103.418","0.005","90","","5832.3","0.7","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C34 H32 F6 N2 O -","- C34 H32 F6 N2 O -","- C272 H256 F48 N16 O8 -","8","2","","Hong, Fong-Jiao; Low, Yun-Yee; Chong, Kam-Weng; Thomas, Noel F.; Kam, Toh-Seok","Biomimetic oxidative dimerization of anodically generated stilbene radical cations: effect of aromatic substitution on product distribution and reaction pathways.","The Journal of organic chemistry","2014","79","10","4528","4543","10.1021/jo500559r","","","0.71073","MoKα","","0.2451","0.1234","","","0.2525","0.2941","","","","","","1.239","","","","has coordinates","178473","2020-10-21","18:00:00",""
"4030046","16.5879","0.0018","9.039","0.001","16.4332","0.0017","90","","117.757","0.005","90","","2180.4","0.4","296","2","296","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C30 H20 O2 -","- C30 H20 O2 -","- C120 H80 O8 -","4","1","","Chen, Zhiyuan; Jia, Xuegong; Huang, Jiapian; Yuan, Jianjun","Platinum-Catalyzed Tandem Cycloisomerization Reaction of Benzoendiynyl Esters: Regioselective Long-Range 1,5-Acyl Migration.","The Journal of organic chemistry","2014","79","21","10674","","10.1021/jo5020245","","","0.71073","MoKα","","0.0488","0.0412","","","0.124","0.1369","","","","","","1.001","","","","has coordinates","178479","2020-10-21","18:00:00",""
"4030577","23.8836","0.0007","10.9631","0.0003","29.7545","0.0006","90","","108.263","0.002","90","","7398.4","0.3","223","2","223","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C33 H21 B F15 N Si2 -","- C33 H21 B F15 N Si2 -","- C264 H168 B8 F120 N8 Si16 -","8","2","","Liedtke, René; Tenberge, Fabian; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard","Benzannulation of heterocyclic frameworks by 1,1-carboboration pathways.","The Journal of organic chemistry","2015","80","4","2240","2248","10.1021/jo502753s","","","1.54178","CuKα","","0.0869","0.0684","","","0.1967","0.212","","","","","","1.064","","","","has coordinates","178484","2020-10-21","18:00:00",""
"4030713","6.6239","0.0009","6.901","0.001","12.539","0.002","90","","98.98","0.01","90","","566.15","0.15","","","293","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Br3 Nb Se -","- Br3 Nb Se -","- Br12 Nb4 Se4 -","4","1","","Meerschaut, A.; Grenouilleau, P.; Guemas, L.","Preparation and structure determination of NbSeBr3","European Journal of Solid State and Inorganic Chemistry","1994","31","","1029","1036","","","x-ray","0.71073","MoKα","","","0.066","","","0.081","","","","","","","","","","","has coordinates","178486","2020-10-21","18:00:00",""
"4030808","15.565","0.002","7.133","0.001","13.533","0.002","90","","109.93","0.01","90","","1412.5","0.4","","","293","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H16 Ag5 N5 O15 -","- C24 Ag5 N5 O15 -","- C48 Ag10 N10 O30 -","2","0.5","","Jaber, F.; Charbonnier, F.; Petit-Ramel, M.; Faure, R.","A new silver(I) carboxylate chelate type: a six-membered ring in the N-oxide-picolinate","European Journal of Solid State and Inorganic Chemistry","1996","33","","429","440","","","x-ray","0.71073","MoKα","","","0.033","","","0.043","","","","","","","","","","","has coordinates","178487","2020-10-21","18:00:00",""
"4030813","8.787","0.003","5.016","0.002","15.606","0.006","90","","97.53","0.03","90","","681.9","0.4","","","296","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- As2 Co2 H K O8 -","- As2 Co2 H K O8 -","- As8 Co8 H4 K4 O32 -","4","1","","Jia-Cherng Horng; Fen-Ling Liao; Sue-Lein Wang","Hydrothermal synthesis and crystal structure of a layered cobalt(II) arsenate, KCo2(AsO4)(HAsO4)","European Journal of Solid State and Inorganic Chemistry","1996","33","","471","581","","","x-ray","0.71073","MoKα","","","0.0309","","","0.0334","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4031693","10.01","","6.27","","17.89","","90","","101.8","","90","","1099.1","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","(Cl Mo2 Cl8) (Cl3 Mo2 Cl4 O2)","","- Cl16 Mo4 O2 -","- Cl16 Mo4 O2 -","- Cl32 Mo8 O4 -","2","0.5","","Edwards, A.J.; Slim, D.R.","The crystal structure of Nonachlorodimolybdenum(V) heptachlorodioxodimolybdate(V)","Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-)","1988","1988","","485","487","","","","","","","","","","","","","","","","","","","","","","has coordinates","168627","2020-10-21","18:00:00",""
"4031992","11.24141","0.00073","3.94441","0.00025","14.83809","0.00088","90","","99.452","0.0024","90","","649","0.07","300","","300","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C4 H3 N2 O2 S Tl -","- C4 H3 N2 O2 S Tl -","- C16 H12 N8 O8 S4 Tl4 -","4","1","","N.N. Golovnev; M.S. Molokeev","Crystal structure of thalium(I) 2-thiobarbiturate","Russian Journal of Inorganic Chemistry","2016","61","4","463","467","10.1134/S0036023616040100","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.379","1.452","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"4032796","13.7446","0.0009","10.6979","0.0007","16.3339","0.0011","90","","110.418","0.001","90","","2250.8","0.3","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C10 H9 N3 O4 S -","- C10 H9 N3 O4 S -","- C80 H72 N24 O32 S8 -","8","2","","Huang, Adrian; Wo, Kellie; Lee, So Yeun Christine; Kneitschel, Nika; Chang, Jennifer; Zhu, Kathleen; Mello, Tatsiana; Bancroft, Laura; Norman, Natalie J.; Zheng, Shao-Liang","Regioselective Synthesis, NMR, and Crystallographic Analysis of N1-Substituted Pyrazoles.","The Journal of organic chemistry","2017","82","17","8864","8872","10.1021/acs.joc.7b01006","","","0.71073","MoKα","","0.0741","0.049","","","0.1272","0.1458","","","","","","1.047","","","","has coordinates","200456","2020-10-21","18:00:00",""
"4032943","13.986","0.005","4.9867","0.0017","18.623","0.008","90","","111.799","0.005","90","","1206","0.8","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C11 H8 B Cl F2 N2 O2 -","- C11 H8 B Cl F2 N2 O2 -","- C44 H32 B4 Cl4 F8 N8 O8 -","4","1","","Sasano, Yoshifumi; Sato, Ryuma; Shigeta, Yasuteru; Yasuda, Nobuhiro; Maeda, Hiromitsu","H-Aggregated π-Systems Based on Disulfide-Linked Dimers of Dipyrrolyldiketone Boron Complexes.","The Journal of organic chemistry","2017","82","20","11166","11172","10.1021/acs.joc.7b02185","","","0.7824","Synchrotron","","0.1208","0.0872","","","0.2246","0.2622","","","","","","1.058","","","","has coordinates,has disorder","202716","2020-10-21","18:00:00",""
"4033195","18.844","0.003","5.5118","0.0009","12.7313","0.0016","90","","107.388","0.006","90","","1261.9","0.3","296","2","296","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C30 H30 O6 -","- C30 H30 O6 -","- C60 H60 O12 -","2","0.5","","Jha, Vishwajeet; Goyal, Navneet; Stevens, Cheryl K.; Stevens, Edwin; Sridhar, Jayalakshmi","Synthetic Method to Form 2,2'-Bis(naphthoquinone) Compounds.","The Journal of organic chemistry","2017","82","24","13686","13692","10.1021/acs.joc.7b02501","","","0.71073","MoKα","","0.0858","0.0717","","","0.1719","0.1771","","","","","","1.064","","","","has coordinates","204798","2020-10-21","18:00:00",""
"4033246","24.9437","0.0014","8.7955","0.0005","11.5489","0.0006","90","","94.461","0.002","90","","2526.1","0.2","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C53 H48 Cl2 F2 O10 S2 -","- C53 H48 Cl2 F2 O10 S2 -","- C106 H96 Cl4 F4 O20 S4 -","2","0.5","","Hsueh, Nai-Chen; Chen, Hsing-Yin; Chang, Meng-Yang","Construction of Sulfonyl Oxabenzo[3.3.1]bicyclic Core via Cyclocondensation of β-Ketosulfones and o-Formyl Allylbenzenes.","The Journal of organic chemistry","2017","82","24","13324","13332","10.1021/acs.joc.7b02425","","","0.71073","MoKα","","0.0444","0.0382","","","0.1098","0.1185","","","","","","1.057","","","","has coordinates","204801","2020-10-21","18:00:00",""
"4033596","13.1456","0.0004","5.1912","0.0002","16.5884","0.0005","90","","90.411","0.002","90","","1131.99","0.07","123","1","123","1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C14 H11 N3 O -","- C14 H11 N3 O -","- C56 H44 N12 O4 -","4","1","","Simeth, Nadja A.; Bellisario, Alfredo; Crespi, Stefano; Fagnoni, Maurizio; König, Burkhard","Substituent Effects on 3-Arylazoindole Photoswitches.","The Journal of organic chemistry","2019","84","11","6565","6575","10.1021/acs.joc.8b02973","","","1.54184","CuKα","","0.0454","0.0353","","","0.0917","0.0995","","","","","","1.057","","","","has coordinates","223234","2020-10-21","18:00:00",""
"4034027","15.1672","0.0015","6.1734","0.0006","10.7592","0.0011","90","","98.628","0.009","90","","996.02","0.17","123","2","123","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C21 H28 N6 -","- C21 H28 N6 -","- C42 H56 N12 -","2","0.5","","Manabe, Yumehiro; Uesaka, Mitsuharu; Yoneda, Tomoki; Inokuma, Yasuhide","Two-Step Transformation of Aliphatic Polyketones into π-Conjugated Polyimines.","The Journal of organic chemistry","2019","84","16","9957","9964","10.1021/acs.joc.9b01119","","x-ray","0.71073","MoKα","","0.0595","0.0474","","","0.1338","0.1409","","","","","","1.107","","","","has coordinates","222587","2020-10-21","18:00:00",""
"4035320","13.0228","0.0004","5.7","0.0002","22.0772","0.0008","90","","95.706","0.0019","90","","1630.67","0.1","123","","123","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C20 H18 F4 -","- C20 H18 F4 -","- C80 H72 F16 -","4","1","","Iwasaki, Takanori; Min, Xin; Fukuoka, Asuka; Zhu, Longzhi; Qiu, Renhua; Yang, Tao; Ehara, Masahiro; Sudalai, Arumugam; Kambe, Nobuaki","Ni-Catalyzed Dimerization and Hydroperfluoroarylation of 1,3-Dienes.","The Journal of organic chemistry","2018","83","16","9267","9277","10.1021/acs.joc.8b01266","","","1.54187","CuKα","","0.1354","0.1007","","","0.2756","0.321","","","","","","1.116","","","","has coordinates","226784","2020-10-21","18:00:00",""
"4037048","34.657","0.002","6.6454","0.0004","29.863","0.002","90","","94.62","0.002","90","","6855.4","0.7","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C37 H46 O3 Si2 -","- C37 H46 O3 Si2 -","- C296 H368 O24 Si16 -","8","2","","Mukhopadhyay, Arindam; Maka, Vijay Kumar; Moorthy, Jarugu Narasimha","Fluoride-Triggered Ring-Opening of Photochromic Diarylpyrans into Merocyanine Dyes: Naked-Eye Sensing in Subppm Levels.","The Journal of organic chemistry","2016","81","17","7741","7750","10.1021/acs.joc.6b01361","","","0.71073","MoKα","","0.3461","0.1199","","","0.2142","0.2936","","","","","","1.011","","","","has coordinates","235601","2020-10-21","18:00:00",""
"4038391","8.3017","0.0005","10.384","0.0006","21.381","0.0012","90","","94.188","0.003","90","","1838.22","0.19","99","2","99","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C23 H20 O4 S -","- C23 H20 O4 S -","- C92 H80 O16 S4 -","4","1","","Chang, Meng-Yang; Tsai, Yu-Lin; Chen, Hsing-Yin","CuBr<sub>2</sub>-Mediated One-Pot Synthesis of Sulfonyl 9-Fluorenylidenes.","The Journal of organic chemistry","2020","","","","","10.1021/acs.joc.0c00035","","","0.71073","MoKα","","0.0385","0.0324","","","0.0847","0.0891","","","","","","1.045","","","","has coordinates","252123","2020-10-21","18:00:00",""
"4038392","8.3081","0.0003","10.2495","0.0003","20.9221","0.0007","90","","94.604","0.002","90","","1775.85","0.1","99","2","99","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C22 H17 F O4 S -","- C22 H17 F O4 S -","- C88 H68 F4 O16 S4 -","4","1","","Chang, Meng-Yang; Tsai, Yu-Lin; Chen, Hsing-Yin","CuBr<sub>2</sub>-Mediated One-Pot Synthesis of Sulfonyl 9-Fluorenylidenes.","The Journal of organic chemistry","2020","","","","","10.1021/acs.joc.0c00035","","","0.71073","MoKα","","0.0615","0.0448","","","0.1119","0.121","","","","","","1.023","","","","has coordinates","252123","2020-10-21","18:00:00",""
"4038580","11.9761","0.0003","9.3925","0.0002","25.5523","0.0006","90","","102.852","0.002","90","","2802.26","0.12","100","0.11","100","0.11","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C30 H36 F4 N4 -","- C30 H36 F4 N4 -","- C120 H144 F16 N16 -","4","1","","Zhang, Rui; Zhang, Zhikun; Wang, Kang; Wang, Jianbo","Difluoroketenimine: Generation from Difluorocarbene and Isocyanide, and Its [3+2] Cycloadditions with Alkenes or Alkynes.","The Journal of organic chemistry","2020","","","","","10.1021/acs.joc.0c01120","","x-ray","0.71073","MoKα","","0.0478","0.0453","","","0.115","0.116","","","","","","1.184","","","","has coordinates","254323","2020-10-21","18:00:00",""
"4038949","13.1602","0.0007","12.283","0.0006","14.3308","0.0007","90","","111.651","0.002","90","","2153.09","0.19","100","","100","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","10,10'-spirobi[[1,2,5]thiadiazolo[3',4':6,7] fluoreno[2,3-c][1,2,5]thiadiazole]","","- C25 H8 N8 S4 -","- C25 H8 N8 S4 -","- C100 H32 N32 S16 -","4","1","","Langis-Barsetti, Sophie; Maris, Thierry; Wuest, James D.","Molecular Organization of 2,1,3-Benzothiadiazoles in the Solid State.","The Journal of organic chemistry","2017","82","","5034","5045","10.1021/acs.joc.6b02778","","x-ray","1.34139","GaKα","","0.0565","0.054","","","0.1294","0.1308","","","","","","1.06","","","","has coordinates","260368","2021-01-02","15:12:52",""
"4060179","14.498","0.0005","10.8391","0.0003","14.0975","0.0004","90","","108.514","0.001","90","","2100.7","0.11","180","2","180","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C38 H32 Co4 Fe O14 S2 -","- C38 H32 Co4 Fe O14 S2 -","- C76 H64 Co8 Fe2 O28 S4 -","2","0.5","","","","Organometallics","2005","","","","","","","","0.71069","MoKα","","0.0494","0.0413","","","0.1088","0.115","","","","","","1.064","","","","has coordinates","178490","2020-10-21","18:00:00",""
"4060638","13.7234","0.0014","11.1025","0.0012","19.8166","0.0018","90","","94.377","0.003","90","","3010.5","0.5","223","2","223","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C27.5 H16 Cl O9 Os3 Sb -","- C27.5 H16 Cl O9 Os3 Sb -","- C110 H64 Cl4 O36 Os12 Sb4 -","4","1","","","","Organometallics","2006","","","","","10.1021/om0508132","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4060651","23.406","0.004","12.868","0.002","36.79","0.007","90","","91.095","0.003","90","","11079","4","298","2","298","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C76 H100 Cl4 F12 N4 O12 Rh4 S4 -","- C76 H100 Cl4 F12 N4 O12 Rh4 S4 -","- C304 H400 Cl16 F48 N16 O48 Rh16 S16 -","4","1","","","","Organometallics","2006","","","","","10.1021/om0508435","","","","","","","","","","","","","","","","","","","","","has coordinates","178495","2020-10-21","18:00:00",""
"4060995","8.168","0.002","15.14","0.002","15.606","0.002","90","","95.83","0.01","90","","1919.9","0.6","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C35 H38 F12 N4 O P2 Pd -","- C35 H35.2 F12 N4 O P2 Pd -","- C70 H70.4 F24 N8 O2 P4 Pd2 -","2","0.5","","Scarel, Alessandro; Milani, Barbara; Zangrando, Ennio; Stener, Mauro; Furlan, Sara; Fronzoni, Giovanna; Mestroni, Giovanni; Gladiali, Serafino; Carfagna, Carla; Mosca, Luca","Palladium Complexes with 3-Alkyl-Substituted-1,10-Phenanthrolines: Effect of the Remote Alkyl Substituent on the CO/Olefin Copolymerization Reactions","Organometallics","2004","23","23","5593","5605","10.1021/om0493412","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","209932","2020-10-21","18:00:00",""
"4061074","17.034","0.005","16.684","0.005","20.545","0.006","90","","94.161","0.005","90","","5823","3","206","2","206","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C58 H80 K2 N4 O9 Th -","- C58 H80 K2 N4 O9 Th -","- C232 H320 K8 N16 O36 Th4 -","4","1","","Korobkov, Ilia; Gambarotta, Sandro","Cis Double Addition of CO2 to a Coordinated Arene of a Thorium Complex","Organometallics","2004","23","23","5379","5381","10.1021/om049470i","","","","","","","","","","","","","","","","","","","","","has coordinates","209917","2020-10-21","18:00:00",""
"4061126","23.7839","0.0003","16.7263","0.0002","32.1496","0.0003","90","","98.462","0.001","90","","12650.4","0.2","173","2","173","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","[{(Mes2BO)MgBr2Li(OEt2)2}2]","","","- C52 H84 B2 Br4 Li2 Mg2 O6 -","- C52 H84 B2 Br4 Li2 Mg2 O6 -","- C416 H672 B16 Br32 Li16 Mg16 O48 -","8","2","","","","Organometallics","2004","","","","","10.1021/om049520j","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","178508","2020-10-21","18:00:00",""
"4061177","13.069","0.002","11.007","0.002","34.101","0.006","90","","90.43","0.01","90","","4905","1","296","","296","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C52 H47 F6 O2 P5 Ru -","- C52 H47 F6 O2 P5 Ru -","- C208 H188 F24 O8 P20 Ru4 -","4","1","","Wyman, Ian W.; Burchell, Tara J.; Robertson, Kathy N.; Cameron, T. Stanley; Aquino, Manuel A. S.","Structure and Electrochemistry of Heterobimetallic Ferrocenecarboxylatoruthenium(II) Complexes","Organometallics","2004","23","22","5353","5364","10.1021/om049635n","","","","","","","0.0831","","","0.2069","","","","","","","","","","","has coordinates","209907","2020-10-21","18:00:00",""
"4061245","9.3529","0.001","12.4153","0.0013","22.416","0.002","90","","93.236","0.002","90","","2598.7","0.5","223","2","223","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C38 H61 F12 N3 P2 Pt Ru2 S6 -","- C38 H61 F12 N3 P2 Pt Ru2 S6 -","- C76 H122 F24 N6 P4 Pt2 Ru4 S12 -","2","0.5","","Shin, Richard Y. C.; Tan, Geok Kheng; Koh, Lip Lin; Goh, Lai Yoong; Webster, Richard D.","[(Ln)Ru{?3-(tpdt)}] Complexes as Dithiolate Donors to Group 10 Metal Centers. Synthetic, Single Crystal X-ray and Elecrtrochemical Studies. {Ln = C6Me6 (HMB) and C5Me5 (Cp*); tpdt = S(CH2CH2)2S)2}.","Organometallics","2004","23","26","6108","6115","10.1021/om049407t","","","","","","","","","","","","","","","","","","","","","has coordinates","178509","2020-10-21","18:00:00",""
"4061382","21.705","0.005","12.645","0.003","23.116","0.005","90","","107.449","0.003","90","","6053","2","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C4.62 H2.85 B0.08 F1.85 N0.31 Pt0.08 S0.08 -","- C4.61538 H2.84615 B0.0769231 F1.84615 N0.307692 Pt0.0769231 S0.0769231 -","- C240 H148 B4 F96 N16 Pt4 S4 -","52","13","","","","Organometallics","2005","","","","","10.1021/om050133z","","","","","","","","","","","","","","","","","","","","","has coordinates","178510","2020-10-21","18:00:00",""
"4061714","15.807","0.008","9.002","0.004","15.455","0.007","90","","100.086","0.01","90","","2165.2","1.8","220","2","220","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C12 H27 Ga -","- C12 H27 Ga -","- C72 H162 Ga6 -","6","1.5","","","","Organometallics","2005","","","","","10.1021/om050572y","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","178514","2020-10-21","18:00:00",""
"4062214","10.092","0.004","12.968","0.005","29.395","0.01","90","","106.506","0.012","90","","3688","2","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C36 H32 Fe4 Ge2 O10 -","- C36 H32 Fe4 Ge2 O10 -","- C144 H128 Fe16 Ge8 O40 -","4","1","","Wang, Baiquan; Zhu, Bolin; Zhang, Jianyong; Xu, Shansheng; Zhou, Xiuzhong; Weng, Linhong","Reactions of Doubly Bridged Bis(cyclopentadienes) with Iron Pentacarbonyl","Organometallics","2003","22","26","5543","5555","10.1021/om030364a","","","","","","","","","","","","","","","","","","","","","has coordinates","218189","2020-10-21","18:00:00",""
"4062370","17.148","0.0002","11.0161","0.0002","22.1596","0.0004","90","","90.4755","0.0008","90","","4185.9","0.12","298","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C31 H40 Cr3 N2 O15 Te -","- C31 H40 Cr3 N1.5 O15 Te -","- C124 H160 Cr12 N6 O60 Te4 -","4","1","","Shieh, Minghuey; Ho, Li-Fang; Guo, Yu-Wen; Lin, Shu-Fen; Lin, Yi-Chun; Peng, Shie-Ming; Liu, Yi-Hung","Carbonylchromium Monotelluride Complexes [Et~4~N]~2~[Te{Cr(CO)~5~}~n~] (n = 2, 3): Two Important Intermediates","Organometallics","2003","22","24","5020","5026","10.1021/om034033+","","","","","","","","","","","","","","","","","","","","","has coordinates","192151","2020-10-21","18:00:00",""
"4062381","13.2724","0.0007","13.5524","0.0007","12.9716","0.0007","90","","109.229","0.0012","90","","2203.1","0.2","295","2","295","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H10 F6 N6 O2 Os -","- C20 H10 F6 N6 O2 Os -","- C80 H40 F24 N24 O8 Os4 -","4","1","","Wu, Pei-Chi; Yu, Jen-Kan; Song, Yi-Hwa; Chi, Yun; Chou, Pi-Tai; Peng, Shie-Ming; Lee, Gene-Hsiang","Synthesis and Characterization of Metal Complexes Possessing the 5-(2-Pyridyl) Pyrazolate Ligands: The Observation of Remarkable Osmium-Induced Blue Phosphorescence in Solution at Room Temperature","Organometallics","2003","22","24","4938","4946","10.1021/om034037e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","192142","2020-10-21","18:00:00",""
"4063106","13.382","0.005","8.615","0.004","18.031","0.006","90","","103.36","0.03","90","","2022.5","1.4","198","2","198","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C34 H66 Li2 N6 S2 -","- C34 H66 Li2 N6 S2 -","- C68 H132 Li4 N12 S4 -","2","0.5","","","","Organometallics","2004","","","","","10.1021/om049886w","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","178526","2020-10-21","18:00:00",""
"4063263","9.0312","0.0003","12.3044","0.0004","16.8288","0.0006","90","","99.018","0.002","90","","1846.96","0.11","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C39 H18 B2 Cl2 F20 O2 -","- C39 H18 B2 Cl2 F20 O2 -","- C78 H36 B4 Cl4 F40 O4 -","2","0.5","","Preston A. Chase; Lee D. Henderson; Warren E. Piers; Masood Parvez; William Clegg; Mark R. J. Elsegood","Bifunctional Perfluoroaryl Boranes: Synthesis and Coordination Chemistry with Neutral Lewis Base Donors","Organometallics","2006","25","2","349","357","10.1021/om050764t","","","0.71069","MoKα","","0.0846","0.0523","","","0.1267","0.1494","","","","","","1.029","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063634","19.2829","0.0019","9.9632","0.001","41.32","0.004","90","","105.036","0.004","90","","7666.6","1.3","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C30 H62 F4 Ni2 P4 -","- C30 H62 F4 Ni2 P4 -","- C240 H496 F32 Ni16 P32 -","8","2","","Johnson, Samuel A.; Mroz, Natalia M.; Valdizon, René; Murray, Scott","Characterization of Intermediates in the C−F Activation of Tetrafluorobenzenes using a Reactive Ni(PEt3)2Synthon: Combined Computational and Experimental Investigation","Organometallics","2011","30","3","441","","10.1021/om100699d","","","0.71073","MoKα","","0.0474","0.0386","","","0.0841","0.0881","","","","","","1.084","","","","has coordinates,has disorder","178531","2020-10-21","18:00:00",""
"4063989","15.3645","0.0003","11.4025","0.0002","14.6185","0.0003","90","","105.441","0.0012","90","","2468.63","0.08","150","2","150","2","","","","","","","synthesized by the authors","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H80 S Si4 Ti2 -","- C48 H80 S Si4 Ti2 -","- C96 H160 S2 Si8 Ti4 -","2","0.5","","Pinkas, Jiří; Císařová, Ivana; Horáček, Michal; Kubišta, Jiří; Mach, Karel","Reactions of Hydrogen Sulfide with Singly and Doubly Tucked-in Titanocenes","Organometallics","2011","30","5","1034","","10.1021/om1010726","","","0.71073","MoKα","","0.0399","0.0311","","","0.0842","0.0884","","","","","","1.044","","","","has coordinates","178534","2020-10-21","18:00:00",""
"4064115","15.4074","0.0006","9.9765","0.0002","20.8968","0.0007","90","","106.406","0.003","90","","3081.31","0.18","200","2","200","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C33 H50 Al O Ti -","- C33 H50 Al O Ti -","- C132 H200 Al4 O4 Ti4 -","4","1","","Burlakov, Vladimir V.; Kaleta, Katharina; Beweries, Torsten; Arndt, Perdita; Baumann, Wolfgang; Spannenberg, Anke; Shur, Vladimir B.; Rosenthal, Uwe","Reactions of Five-Membered Metallacyclocumulenes Cp2M(η4-t-Bu-C4-t-Bu) (M = Ti, Zr) with Diisobutylaluminum Hydride","Organometallics","2011","30","5","1157","","10.1021/om1011374","","","0.71073","MoKα","","0.086","0.0446","","","0.0909","0.0997","","","","","","0.852","","","","has coordinates,has disorder","178535","2020-10-21","18:00:00",""
"4064281","6.9383","0.0017","13.765","0.003","8.974","0.002","90","","97.527","0.003","90","","849.7","0.3","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","ansa-Cbc-Naph-PF6","l,l'-( 1,8-Naphthalenediyl)cobaltocenium hexafluorophosphate","","- C20 H14 Co F6 P -","- C20 H14 Co F6 P -","- C40 H28 Co2 F12 P2 -","2","0.5","","Pagels, Nils; Prosenc, Marc H.; Heck, Jürgen","Anansa-Cobaltocene with a Naphthalene Handle: Synthesis and Spectroscopic and Structural Characterization","Organometallics","2011","30","7","1968","","10.1021/om200013t","","","0.71073","MoKα","","0.031","0.0259","","","0.0685","0.0719","","","","","","1.085","","","","has coordinates","178536","2020-10-21","18:00:00",""
"4064445","16.0952","0.0004","10.0282","0.0003","31.9122","0.0009","90","","90.84","0.001","90","","5150.3","0.2","223","2","223","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C55 H39 B2 F20 N3 -","- C55 H39 B2 F20 N3 -","- C220 H156 B8 F80 N12 -","4","1","","Spannhoff, Kirsten; Rojas, Rene; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard","Reactions of Topologically Related “nacnacH-CN” and “P-nacnacH-CN” Chelate Ligand Systems with HB(C6F5)2","Organometallics","2011","30","8","2377","","10.1021/om200116q","","","1.54178","CuKα","","0.0735","0.0507","","","0.123","0.1399","","","","","","1.022","","","","has coordinates","178538","2020-10-21","18:00:00",""
"4064525","14.7687","0.0012","12.0964","0.001","30.477","0.003","90","","101.537","0.002","90","","5334.7","0.8","123","2","123","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C29 H44 N Ni P -","- C29 H44 N Ni P -","- C232 H352 N8 Ni8 P8 -","8","2","","Ohashi, Masato; Ikawa, Masashi; Ogoshi, Sensuke","Intramolecular Oxidative Cyclization of Alkenes and Nitriles with Nickel(0)","Organometallics","2011","30","10","2765","","10.1021/om2001603","","","0.71075","MoKα","","0.1661","0.0768","","","0.1602","0.1984","","","","","","1.013","","","","has coordinates","178539","2020-10-21","18:00:00",""
"4064769","13.4746","0.0017","12.1227","0.0015","20.8669","0.0019","90","","125.462","0.005","90","","2776.3","0.6","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C60 H88 Mg N4 O -","- C60 H88 Mg N4 O -","- C120 H176 Mg2 N8 O2 -","2","0.5","","Gao, Jing; Liu, Yanyan; Zhao, Yanxia; Yang, Xiao-Juan; Sui, Yunxia","Syntheses and Structures of Magnesium Complexes with Reduced α-Diimine Ligands","Organometallics","2011","30","22","6071","","10.1021/om2003199","","","0.71073","MoKα","","0.1248","0.0668","","","0.1862","0.2294","","","","","","1.034","","","","has coordinates","189195","2020-10-21","18:00:00",""
"4065081","20.034","0.016","16.208","0.013","13.63","0.011","90","","100.972","0.009","90","","4345","6","213","2","213","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C45 H49 Au2 N3 O3 P2 -","- C45 H49 Au2 N3 O3 P2 -","- C180 H196 Au8 N12 O12 P8 -","4","1","","Melgarejo, Doris Y.; Chiarella, Gina M.; Fackler, John P.","Novel Mixed Coordination of N and C Donors to Gold‒Gold Centers","Organometallics","2011","30","20","5374","","10.1021/om200556x","","","0.71073","MoKα","","0.1147","0.0682","","","0.1271","0.137","","","","","","1.099","","","","has coordinates","178503","2020-10-21","18:00:00",""
"4065860","15.55","0.006","16.668","0.006","14.904","0.005","90","","116.273","0.008","90","","3464","2","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C62 H102 Ca3 I4 N8 -","- C62 H102 Ca3 I4 N8 -","- C124 H204 Ca6 I8 N16 -","2","0.5","","Sarish, Sankaranarayana Pillai; Jana, Anukul; Roesky, Herbert W.; Schulz, Thomas; Stalke, Dietmar","A [I−Ca−I−Ca−I−Ca−I]2+Chain Stabilized by Two Chelating β-Diketiminate Ligands","Organometallics","2010","29","13","2901","","10.1021/om100165s","","","0.71073","MoKα","","0.0911","0.0577","","","0.0938","0.1027","","","","","","1.075","","","","has coordinates,has disorder","178551","2020-10-21","18:00:00",""
"4066039","14.8276","0.0004","11.9847","0.0003","17.5574","0.0005","90","","104.178","0.002","90","","3024.99","0.14","123","2","123","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Tricarbonyl{[eta6-1,2,3,4,4a,8a]-1-tert-butyldimethylsiloxy-2,3-diethyl- 4-methoxy-7-[(E)-2'-phenylethylene]naphthalene}chromium(0)","","- C32 H38 Cr O5 Si -","- C32 H38 Cr O5 Si -","- C128 H152 Cr4 O20 Si4 -","4","1","","Hegele, Peter; Santhamma, Bindu; Schnakenburg, Gregor; Fröhlich, Roland; Kataeva, Olga; Nieger, Martin; Kotsis, Konstantinos; Neese, Frank; Dötz, Karl Heinz","Hydroquinoid Chromium Complexes Bearing an Acyclic Conjugated Bridge: Chromium-Templated Synthesis, Molecular Structure, and Haptotropic Metal Migration","Organometallics","2010","29","23","6172","","10.1021/om100257x","","","0.71073","MoKα","","0.0544","0.0329","","","0.0795","0.0855","","","","","","0.963","","","","has coordinates","178504","2020-10-21","18:00:00",""
"4066041","14.898","0.001","12.022","0.001","17.71","0.001","90","","104.62","0.01","90","","3069.2","0.4","223","2","223","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C32 H38 Cr O5 Si -","- C32 H38 Cr O5 Si -","- C128 H152 Cr4 O20 Si4 -","4","1","","Hegele, Peter; Santhamma, Bindu; Schnakenburg, Gregor; Fröhlich, Roland; Kataeva, Olga; Nieger, Martin; Kotsis, Konstantinos; Neese, Frank; Dötz, Karl Heinz","Hydroquinoid Chromium Complexes Bearing an Acyclic Conjugated Bridge: Chromium-Templated Synthesis, Molecular Structure, and Haptotropic Metal Migration","Organometallics","2010","29","23","6172","","10.1021/om100257x","","","0.71073","MoKα","","0.118","0.0515","","","0.1118","0.1328","","","","","","1.017","","","","has coordinates","178504","2020-10-21","18:00:00",""
"4067181","12.1451","0.0006","9.9693","0.0005","27.2606","0.0013","90","","93.774","0.001","90","","3293.5","0.3","220","2","220","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C33 H54 N3 Ti -","- C33 H54 N3 Ti -","- C132 H216 N12 Ti4 -","4","1","","Trunkely, Emily F.; Epshteyn, Albert; Zavalij, Peter Y.; Sita, Lawrence R.","Synthesis, Structural Characterization, and Preliminary Reactivity Profile of a Series of Monocyclopentadienyl, Monoacetamidinate Titanium(III) Alkyl Complexes Bearing β-Hydrogens","Organometallics","2010","29","23","6587","","10.1021/om100877d","","","0.71073","MoKα","","0.0467","0.0363","","","0.0751","0.0792","","","","","","1","","","","has coordinates,has disorder","178562","2020-10-21","18:00:00",""
"4068559","13.5208","0.0019","8.1518","0.001","26.366","0.004","90","","104.592","0.003","90","","2812.3","0.7","200","2","200","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H27 Cl2 N5 Ni O2 -","- C20 H27 Cl2 N5 Ni O2 -","- C80 H108 Cl8 N20 Ni4 O8 -","4","1","","Lee, Way-Zen; Wang, Tzu-Li; Tsang, Huan-Sheng; Liu, Cheng-Yuan; Chen, Chien-Tien; Kuo, Ting-Shen","Temperature-Dependent Nuclearity in Bis(benzimidazoyl) Nickel Complexes and Their Catalysis toward Conjugate Addition of Thiophenols to α,β-Enones","Organometallics","2009","28","2","652","","10.1021/om8009427","","","0.71073","MoKα","","0.1178","0.0978","","","0.2603","0.2864","","","","","","1.028","","","","has coordinates","178575","2020-10-21","18:00:00",""
"4068635","9.7136","0.0003","3.0571","0.0001","29.97","0.001","90","","90.363","0.003","90","","889.95","0.05","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18 H22 Au N2 P -","- C18 H22 Au N2 P -","- C36 H44 Au2 N4 P2 -","2","0.5","","Koutsantonis, George A.; Jenkins, Gareth I.; Schauer, Phil A.; Szczepaniak, Barbara; Skelton, Brian W.; Tan, Colin; White, Allan H.","Coordinating Tectons: Bipyridyl-Terminated Group 8 Alkynyl Complexes","Organometallics","2009","28","7","2195","","10.1021/om800992p","","","0.71073","MoKα","","0.0544","0.0334","","","0.044","0.0459","","","","","","0.852","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4068706","12.5225","0.001","8.4242","0.0007","13.9239","0.001","90","","112.577","0.003","90","","1356.29","0.19","93","2","93","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C34 H28 N2 O4 -","- C34 H28 N2 O4 -","- C68 H56 N4 O8 -","2","0.5","","Lippe, Katrin; Gerlach, Daniela; Kroke, Edwin; Wagler, Jörg","Hypercoordinate Organosilicon Complexes of an ONN′O′ Chelating Ligand: Regio- and Diastereoselectivity of Rearrangement Reactions in Si−Salphen Systems","Organometallics","2009","28","2","621","","10.1021/om801049q","","","0.71073","MoKα","","0.04","0.0357","","","0.0952","0.0979","","","","","","1.072","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4069382","15.141","0.003","13.854","0.003","13.565","0.003","90","","90","0.03","90","","2845.4","1","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C18 H42 Cl3 F6 N6 P Ru2 -","- C18 H42 Cl3 F6 N6 P Ru2 -","- C72 H168 Cl12 F24 N24 P4 Ru8 -","4","1","","Wong, Chun-Yuen; Lai, Lo-Ming; Leung, Hung-Fan; Wong, Sze-Ho","Ruthenium(II) Isocyanide Complexes Supported by Triazacyclononane/Trithiacyclononane and Aromatic Diimine: Structural, Spectroscopic, and Theoretical Studies","Organometallics","2009","28","12","3537","","10.1021/om9001654","","","0.71073","MoKα","","0.0445","0.0372","","","0.0846","0.0871","","","","","","1.056","","","","has coordinates,has disorder","178582","2020-10-21","18:00:00",""
"4069402","19.195","0.003","10.0767","0.0016","41.554","0.006","90","","105.297","0.006","90","","7753","2","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C30 H61 F5 Ni2 P4 -","- C30 H61 F5 Ni2 P4 -","- C240 H488 F40 Ni16 P32 -","8","2","","Johnson, Samuel A.; Taylor, Erin T.; Cruise, Sean J.","A Combined Experimental and Computational Study of Unexpected C−F Bond Activation Intermediates and Selectivity in the Reaction of Pentafluorobenzene with a (PEt3)2Ni Synthon","Organometallics","2009","28","13","3842","","10.1021/om900176v","","","0.71073","MoKα","","0.0603","0.0501","","","0.1102","0.1155","","","","","","1.147","","","","has coordinates","178583","2020-10-21","18:00:00",""
"4069404","19.371","0.0019","10.0468","0.001","41.31","0.004","90","","105.496","0.004","90","","7747.4","1.3","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C30 H60 F6 Ni2 P4 -","- C30 H60 F6 Ni2 P4 -","- C240 H480 F48 Ni16 P32 -","8","2","","Johnson, Samuel A.; Taylor, Erin T.; Cruise, Sean J.","A Combined Experimental and Computational Study of Unexpected C−F Bond Activation Intermediates and Selectivity in the Reaction of Pentafluorobenzene with a (PEt3)2Ni Synthon","Organometallics","2009","28","13","3842","","10.1021/om900176v","","","0.71073","MoKα","","0.0534","0.0382","","","0.0903","0.0983","","","","","","0.976","","","","has coordinates","178583","2020-10-21","18:00:00",""
"4069705","10.4638","0.0007","14.5915","0.0009","19.9999","0.0012","90","","95.887","0.004","90","","3037.5","0.3","173","1","173","1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C56 H102 N6 Zn4 -","- C56 H102 N6 Zn4 -","- C112 H204 N12 Zn8 -","2","0.5","","Schmidt, Sarah; Gondzik, Sebastian; Schulz, Stephan; Bläser, Dieter; Boese, Roland","Zinc Carbodiimide Cluster Complexes: Synthesis, X-ray Crystal Structures, and Reaction Mechanism","Organometallics","2009","28","15","4371","","10.1021/om900373p","","","0.71073","MoKα","","0.0759","0.0435","","","0.0983","0.1152","","","","","","1.077","","","","has coordinates,has disorder","178586","2020-10-21","18:00:00",""
"4070124","16.4415","0.0003","12.2233","0.0003","27.9952","0.0006","90","","107.063","0.001","90","","5378.5","0.2","100","2","100","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C60 H50 Br0.5 Cl2 F3 O2 P3.5 Ru -","- C60 H50 Br0.5 Cl2 F3 O2 P3.5 Ru -","- C240 H200 Br2 Cl8 F12 O8 P14 Ru4 -","4","1","","Ang, Wee Han; Cordiner, Richard L.; Hill, Anthony F.; Perry, Tamara L.; Wagler, Jörg","Reactions of [Ru(CO)2(PPh3)3] with Alkynylphosphonium Salts: A Phosphinoallene Complex","Organometallics","2009","28","18","5568","","10.1021/om900621v","","","0.71073","MoKα","","0.0624","0.0417","","","0.0833","0.0886","","","","","","1.02","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4070663","15.664","0.0001","9.659","0.0001","36.012","0.0003","90","","93.325","0.001","90","","5439.39","0.08","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C22 H35 Cl2 N4 O5.5 Ru -","- C22 H35 Cl2 N4 O5.5 Ru -","- C176 H280 Cl16 N32 O44 Ru8 -","8","2","","Ellul, Charles E.; Saker, Olly; Mahon, Mary F.; Apperley, David C.; Whittlesey, Michael K.","Cleavage of Ru3(CO)12 by N-Heterocyclic Carbenes: Isolation of cis- and trans-Ru(NHC)2(CO)3 and Reaction with O2To Form Ru(NHC)2(CO)2(CO3)","Organometallics","2008","27","1","100","","10.1021/om700915t","","","0.71073","MoKα","","0.0496","0.0313","","","0.0698","0.0764","","","","","","1.028","","","","has coordinates","178595","2020-10-21","18:00:00",""
"4070822","16.863","0.0004","7.252","0.0002","12.828","0.0005","90","","95.604","0.0014","90","","1561.24","0.08","100","2","100","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C8 H11 Ga -","- C8 H11 Ga -","- C64 H88 Ga8 -","8","2","","Jutzi, Peter; Izundu, Joseph; Neumann, Beate; Mix, Andreas; Stammler, Hans-Georg","Aryl(dimethyl)gallium Compounds and Methyl(diphenyl)gallium: Synthesis, Structure, and Redistribution Reactions","Organometallics","2008","27","18","4565","","10.1021/om701055a","","","0.71073","MoKα","","0.0559","0.0355","","","0.0796","0.0862","","","","","","1.055","","","","has coordinates","178597","2020-10-21","18:00:00",""
"4071159","14.6947","0.0019","10.0558","0.0013","22.45","0.002","90","","104.286","0.006","90","","3214.8","0.7","113","2","113","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C66 H84 N6 Ni O12 S2 -","- C66 H84 N6 Ni O12 S2 -","- C132 H168 N12 Ni2 O24 S4 -","2","0.5","","Li, Jianfeng; Tian, Dawei; Song, Haibin; Wang, Chunhua; Zhu, Xiaoqing; Cui, Chunming; Cheng, Jin-Pei","Synthesis, Structures, and Reactivity of Nickel Complexes Incorporating Sulfonamido-Imine Ligands","Organometallics","2008","27","7","1605","","10.1021/om800001w","","","0.7107","MoKα","","0.068","0.0593","","","0.1295","0.1345","","","","","","1.111","","","","has coordinates,has disorder","178600","2020-10-21","18:00:00",""
"4071371","21.0678","0.0013","9.8086","0.0013","23.437","0.003","90","","107.596","0.003","90","","4616.6","0.9","103","2","103","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","compound9","","","- C80 H136 O2 Si14 -","- C80 H136 O2 Si14 -","- C160 H272 O4 Si28 -","2","0.5","","Ozaki, Shuhei; Sasamori, Takahiro; Tokitoh, Norihiro","Synthesis of a 1-Hydrosilene Stable in Solution and Its Unique Properties#","Organometallics","2008","27","10","2163","","10.1021/om8001334","","","0.71069","MoKα","","0.1654","0.0754","","","0.1405","0.1768","","","","","","1.013","","","","has coordinates","178602","2020-10-21","18:00:00",""
"4071429","11.6074","0.0015","12.2988","0.0015","22.4969","0.0019","90","","120.287","0.004","90","","2773.2","0.6","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","[Ag(L)0.5(AgCF3COO)4(H2O)2]","","","- C17 H10 Ag5 F12 O11 -","- C17 H10 Ag5 F12 O11 -","- C68 H40 Ag20 F48 O44 -","4","1","","Zang, Shuang-Quan; Zhao, Liang; Mak, Thomas C. W.","Diverse Intermolecular Interactions in Metal−Organic Frameworks Constructed with the New Supramolecular Synthon Agn−L−Agn(n= 4, 5) (H2L = 2,2′-Bis(prop-2-ynyloxy)biphenyl)","Organometallics","2008","27","11","2396","","10.1021/om800165x","","","0.71073","MoKα","","0.0481","0.0408","","","0.1033","0.1072","","","","","","1.057","","","","has coordinates","178603","2020-10-21","18:00:00",""
"4071526","25.5669","0.0005","11.378","0.0003","53.1036","0.0011","90","","91.512","0.002","90","","15442.5","0.6","100","","293","2","","","","","","","","9","P 1 2/c 1","-P 2yc","13","","","","- C171 H145 Cl9 Fe2 N4 O6 P4 Re2 Ru2 -","- C171 H145 Cl9 Fe2 N4 O6 P4 Re2 Ru2 -","- C684 H580 Cl36 Fe8 N16 O24 P16 Re8 Ru8 -","4","1","","Packheiser, Rico; Ecorchard, Petra; Rüffer, Tobias; Lohan, Manja; Bräuer, Björn; Justaud, Frédéric; Lapinte, Claude; Lang, Heinrich","Heterotrimetallic M−M′−M′′ Transition Metal Complexes Based on 1,3,5-Triethynylbenzene: Synthesis, Solid State Structure, and Electrochemical and UV−Vis Characterization. EPR Analysis of thein SituGenerated Associated Radical Cations","Organometallics","2008","27","14","3444","","10.1021/om800206k","","","0.71073","MoKα","","0.1543","0.1036","","","0.2156","0.2347","","","","","","1.122","","","","has coordinates,has disorder","178604","2020-10-21","18:00:00",""
"4071527","25.7473","0.0014","11.4332","0.0006","53.214","0.003","90","","91.527","0.005","90","","15659.3","1.5","125","","293","2","","","","","","","","9","P 1 2/c 1","-P 2yc","13","","","","- C171 H141 Cl9 Fe2 N4 O6 Os2 P4 Re2 -","- C171 H141 Cl9 Fe2 N4 O6 Os2 P4 Re2 -","- C684 H564 Cl36 Fe8 N16 O24 Os8 P16 Re8 -","4","1","","Packheiser, Rico; Ecorchard, Petra; Rüffer, Tobias; Lohan, Manja; Bräuer, Björn; Justaud, Frédéric; Lapinte, Claude; Lang, Heinrich","Heterotrimetallic M−M′−M′′ Transition Metal Complexes Based on 1,3,5-Triethynylbenzene: Synthesis, Solid State Structure, and Electrochemical and UV−Vis Characterization. EPR Analysis of thein SituGenerated Associated Radical Cations","Organometallics","2008","27","14","3444","","10.1021/om800206k","","","1.54184","CuKα","","0.1007","0.0695","","","0.1729","0.195","","","","","","1.032","","","","has coordinates,has disorder","178604","2020-10-21","18:00:00",""
"4071814","24.8131","0.0013","15.2421","0.0012","17.6737","0.0015","90","","96.919","0.013","90","","6635.6","0.9","220","2","220","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C66 H74 Cl2 Cu2 N8 O4 Pt2 S2 -","- C66 H74 Cl2 Cu2 N8 O4 Pt2 S2 -","- C264 H296 Cl8 Cu8 N32 O16 Pt8 S8 -","4","1","","Moret, Marc-Etienne; Chen, Peter","Mononuclear Organometallic Platinum(II) Complexes and Platinum(II)−Copper(I) Mixed Complexes from Symmetrical 3,5-Bis(iminoacetyl)pyrazolate Ligands","Organometallics","2008","27","19","4903","","10.1021/om800403y","","","0.7107","MoKα","","0.1106","0.0704","","","0.1623","0.1901","","","","","","1.08","","","","has coordinates","178607","2020-10-21","18:00:00",""
"4072064","25.692","0.003","10.8489","0.0013","18.007","0.002","90","","104.287","0.002","90","","4863.9","1","130","2","130","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C44 H46 B F20 In O3 Si2 -","- C44 H46 B F20 In O3 Si2 -","- C176 H184 B4 F80 In4 O12 Si8 -","4","1","","Peckermann, Ilja; Robert, Dominique; Englert, Ulli; Spaniol, Thomas P.; Okuda, Jun","Neutral and Cationic Trimethylsilylmethyl Complexes of Indium","Organometallics","2008","27","18","4817","","10.1021/om800562z","","","0.71073","MoKα","","0.0876","0.0812","","","0.2065","0.2094","","","","","","1.191","","","","has coordinates","178609","2020-10-21","18:00:00",""
"4072352","12.23","0.02","8.46","0.015","23.49","0.04","90","","101.43","0.02","90","","2382","7","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C44 H52 Cu2 F6 N4 -","- C44 H52 Cu2 F6 N4 -","- C88 H104 Cu4 F12 N8 -","2","0.5","","Dubinina, Galyna G.; Ogikubo, Junichi; Vicic, David A.","Structure of Bis(trifluoromethyl)cuprate and Its Role in Trifluoromethylation Reactions","Organometallics","2008","27","23","6233","","10.1021/om800794m","","","0.71075","MoKα","","0.2065","0.0946","","","0.2139","0.2684","","","","","","1.043","","","","has coordinates","178612","2020-10-21","18:00:00",""
"4072447","17.658","0.003","8.2098","0.0013","25.878","0.004","90","","109.532","0.002","90","","3535.6","1","98","2","98","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C19 H30 Zr -","- C19 H30 Zr -","- C152 H240 Zr8 -","8","2","","Klamo, Sara B.; Wendt, Ola F.; Henling, Larry M.; Day, Michael W.; Bercaw, John E.","Dialkyl and Methyl-Alkyl Zirconocenes: Synthesis and Characterization of Zirconocene-Alkyls That Model the Polymeryl Chain in Alkene Polymerizations","Organometallics","2007","26","12","3018","","10.1021/om0601302","","","0.71073","MoKα","","0.0991","0.0571","","","0.0876","0.0958","","","","","","1.217","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4072664","10.098","0.002","8.529","0.002","12.334","0.002","90","","108.72","0.03","90","","1006.1","0.4","198","2","198","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C20 H34 Os2 -","- C20 H34 Os2 -","- C40 H68 Os4 -","2","0.5","","Gross, Christopher L.; Girolami, Gregory S.","Synthesis and Characterization of Osmium Polyhydrides. X-ray Crystal Structures of (C5Me5)OsH5and (C5Me5)2Os2H4","Organometallics","2007","26","1","160","","10.1021/om060920b","","","0.71073","MoKα","","0.0297","0.0246","","","0.0599","0.0631","","","","","","1.077","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072730","22.4467","0.0001","10.9348","0.0001","24.741","0.0002","90","","116.6","0.0004","90","","5429.92","0.07","173","1","173","1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","Compound X","","","- C63 H44 F10 O2 P2 Pt2 -","- C63 H44 F10 O2 P2 Pt2 -","- C252 H176 F40 O8 P8 Pt8 -","4","1","","Berenguer, Jesús R.; Bernechea, María; Lalinde, Elena","Rearrangement or C−H Activation Processes Promoted by Reaction with the Solvate [cis-Pt(C6F5)2(thf)2]","Organometallics","2007","26","5","1161","","10.1021/om060977y","","","0.71073","MoKα","","0.0479","0.0302","","","0.061","0.0659","","","","","","1.028","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4073174","12.59","0.005","8.383","0.003","20.993","0.006","90","","123.243","0.016","90","","1853.1","1.2","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C31 H32 B2 F8 N4 O7 Ru2 -","- C31 H32 B2 F8 N4 O7 Ru2 -","- C62 H64 B4 F16 N8 O14 Ru4 -","2","0.5","","Patra, Sanjib K.; Bera, Jitendra K.","C−C Bond Forming Reaction through Aldol-Type Addition Mediated by a [Ru2(CO)4]2+Core","Organometallics","2007","26","10","2598","","10.1021/om070139j","","","0.71073","MoKα","","0.1183","0.0833","","","0.1955","0.2143","","","","","","0.982","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073544","11.8591","0.0011","8.2372","0.0005","23.1905","0.0019","90","","100.31","0.007","90","","2228.8","0.3","173","2","173","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C38 H42 B2 K2 Mn2 N8 O8 -","- C38 H42 B2 K2 Mn2 N8 O8 -","- C76 H84 B4 K4 Mn4 N16 O16 -","2","0.5","","Kunz, Kerstin; Vitze, Hannes; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Mn(CO)2Complexes of Cyclopentadienyl/Scorpionate Hybrid Ligands","Organometallics","2007","26","18","4663","","10.1021/om700450j","","","0.71073","MoKα","","0.0491","0.0373","","","0.0951","0.0997","","","","","","1.024","","","","has coordinates,has disorder","178624","2020-10-21","18:00:00",""
"4073610","17.379","0.002","12.243","0.001","17.594","0.002","90","","113.064","0.001","90","","3444.3","0.6","155.2","","","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C31 H51 Ir N2 O0.5 P3 Si -","- C31 H51 Ir N2 O0.5 P3 Si -","- C124 H204 Ir4 N8 O2 P12 Si4 -","4","1","","Sangtrirutnugul, Preeyanuch; Tilley, T. Don","Silyl Derivatives of [Bis(8-quinolyl)methylsilyl]iridium(III) Complexes: Catalytic Redistribution of Arylsilanes and Dehydrogenative Arene Silylation","Organometallics","2007","26","23","5557","","10.1021/om700494q","","","0.7107","MoKα","","0.0372","0.0372","","0.0368","","0.0368","","","","","","1.266","","","","has coordinates","264242","2021-04-16","08:50:19",""
"4073754","16.7336","0.0018","11.2402","0.0012","22.3834","0.0016","90","","100.888","0.007","90","","4134.3","0.7","120","2","120","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C97 H104 N8 O8 Pd4 -","- C97 H104 N8 O8 Pd4 -","- C194 H208 N16 O16 Pd8 -","2","0.5","","Stylianides, Neoklis; Danopoulos, Andreas A.; Pugh, David; Hancock, Fred; Zanotti-Gerosa, Antonio","Cyclometalated and Alkoxyphenyl-Substituted Palladium Imidazolin-2-ylidene Complexes. Synthetic, Structural, and Catalytic Studies","Organometallics","2007","26","23","5627","","10.1021/om700603d","","","0.71073","MoKα","","0.164","0.0617","","","0.0975","0.1224","","","","","","1.006","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073756","22.4014","0.0007","8.0114","0.0003","24.4471","0.0008","90","","114.925","0.002","90","","3978.8","0.2","120","2","120","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C44 H58 N4 Pd -","- C44 H58 N4 Pd -","- C176 H232 N16 Pd4 -","4","1","","Stylianides, Neoklis; Danopoulos, Andreas A.; Pugh, David; Hancock, Fred; Zanotti-Gerosa, Antonio","Cyclometalated and Alkoxyphenyl-Substituted Palladium Imidazolin-2-ylidene Complexes. Synthetic, Structural, and Catalytic Studies","Organometallics","2007","26","23","5627","","10.1021/om700603d","","","0.71073","MoKα","","0.0713","0.0421","","","0.0833","0.0927","","","","","","1.024","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4074157","17.96","0.005","11.306","0.003","23.267","0.007","90","","105.502","0.005","90","","4553","2","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C48 H40 B F4 O8 P2 Rh -","- C48 H40 B F4 O8 P2 Rh -","- C192 H160 B4 F16 O32 P8 Rh4 -","4","1","","Son, Seung Uk; Reingold, Jeffrey A.; Carpenter, Gene B.; Czech, Paul T.; Sweigart, Dwight A.","Charge-Assisted Hydrogen Bonding and Other Noncovalent Interactions in the Self-Assembly of the Organometallic Building Block [(η6-hydroquinone)Rh(P(OPh)3)2]+with a Range of Counteranions","Organometallics","2006","25","22","5276","","10.1021/om0604425","","","0.71073","MoKα","","0.1886","0.1212","","","0.2917","0.3183","","","","","","1.067","","","","has coordinates,has disorder","178630","2020-10-21","18:00:00",""
"4074893","14.288","0.003","12.824","0.003","35.951","0.007","90","","92.968","0.012","90","","6578","2","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C62 H51 B2 F24 N7 O W -","- C62 H51 B2 F24 N7 O W -","- C248 H204 B8 F96 N28 O4 W4 -","4","1","","Garrett, Andrew D.; Vogeley, Neil J.; Varner, James R.; White, Peter S.; Templeton, Joseph L.","Reactivity Relationships between Chiral Cyclic Amido and Imine Tungsten(II) Complexes","Organometallics","2006","25","7","1728","","10.1021/om0509746","","","0.71073","MoKα","","0.0596","0.0433","","","0.0963","0.1034","","","","","","1.037","","","","has coordinates","178637","2020-10-21","18:00:00",""
"4074978","11.199","0.0002","17.443","0.0003","14.026","0.0002","90","","103.438","0.001","90","","2664.88","0.08","273","2","273","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C21 H30 F6 Fe N2 O3 P2 -","- C21 H30 F6 Fe N2 O3 P2 -","- C84 H120 F24 Fe4 N8 O12 P8 -","4","1","","Kubo, Kazuyuki; Baba, Takayuki; Mizuta, Tsutomu; Miyoshi, Katsuhiko","Trapping of Unsaturated Small Molecules through Cyclization with Iron−Iminophosphorane Complexes","Organometallics","2006","25","13","3238","","10.1021/om0510728","","","0.71069","MoKα","","0.0471","0.0414","","","0.1036","0.1056","","","","","","1.029","","","","has coordinates","178638","2020-10-21","18:00:00",""
"4074986","20.4653","0.0019","12.1974","0.0011","22.708","0.002","90","","112.026","0.002","90","","5254.7","0.8","293","2","293","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C62 H44 Cl4 F6 Ir N2 O P -","- C62 H44 Cl4 F6 Ir N2 O P -","- C248 H176 Cl16 F24 Ir4 N8 O4 P4 -","4","1","","Ionkin, Alex S.; Marshall, William J.; Fish, Brian M.","Synthesis and Structural Characterization of a Series of Novel Polyaromatic Ligands Containing Pyrene and Related Biscyclometalated Iridium(III) Complexes","Organometallics","2006","25","6","1461","1471","10.1021/om0510775","","","0.71069","MoKα","","0.0505","0.034","","","0.0812","0.0903","","","","","","1.041","","","","has coordinates","209813","2020-10-21","18:00:00",""
"4074987","20.579","0.003","12.2266","0.0019","22.819","0.004","90","","113.766","0.003","90","","5254.6","1.5","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C66 H50 F6 Ir N2 O3 P -","- C66 H40 F6 Ir N2 O3 P -","- C264 H160 F24 Ir4 N8 O12 P4 -","4","1","","Ionkin, Alex S.; Marshall, William J.; Fish, Brian M.","Synthesis and Structural Characterization of a Series of Novel Polyaromatic Ligands Containing Pyrene and Related Biscyclometalated Iridium(III) Complexes","Organometallics","2006","25","6","1461","1471","10.1021/om0510775","","","0.71069","MoKα","","0.0666","0.0394","","","0.0901","0.1039","","","","","","1.027","","","","has coordinates","209813","2020-10-21","18:00:00",""
"4075376","18.4562","0.0014","5.0962","0.0002","19.1459","0.0016","90","","91.022","0.009","90","","1800.5","0.2","153","2","153","2","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","","","- C29 H18 -","- C29 H18 -","- C116 H72 -","4","1","","Schröder, Kai; Haase, Detlev; Saak, Wolfgang; Lützen, Arne; Beckhaus, Rüdiger; Wichmann, Silke; Schellenberg, Jürgen","Tetrabenzo[a,c,g,i]fluorenyllithium and η5-Tetrabenzo[a,c,g,i]fluorenyltitanium Complexes","Organometallics","2006","25","16","3824","","10.1021/om0602613","","","0.71073","MoKα","","0.0465","0.0326","","","0.0794","0.0836","","","","","","0.947","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4075580","18.289","0.008","12.197","0.005","12.852","0.006","90","","107.713","0.006","90","","2731","2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H38 B10 Ir2 O2 Se2 -","- C20 H38 B10 Ir2 O2 Se2 -","- C80 H152 B40 Ir8 O8 Se8 -","4","1","","Wang, Jian-Qiang; Herberhold, Max; Jin, Guo-Xin","Formation of Cup-Shaped Metallic Clusters via B−H Activation at the B(3)/B(6) Site of anortho-Carborane-1,2-dichalcogenolato Ligand","Organometallics","2006","25","14","3508","","10.1021/om060381a","","","0.71073","MoKα","","0.0673","0.0513","","","0.1321","0.1388","","","","","","1.149","","","","has coordinates","178644","2020-10-21","18:00:00",""
"4075686","12.873","0.001","10.995","0.001","19.49","0.003","90","","106.92","0.01","90","","2639.2","0.5","160","2","160","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C54 H52 Cl6 O2 P2 Pd2 -","- C54 H52 Cl6 O2 P2 Pd2 -","- C108 H104 Cl12 O4 P4 Pd4 -","2","0.5","","Lindsell, W. Edward; Palmer, Daniel D.; Preston, Peter N.; Rosair, Georgina M.; Jones, Ray V. H.; Whitton, Alan J.","Investigations of Benzyl and Aryl Palladium Complexes with Pendant Hydroxy Substituents and Their Transformation into Benzolactones on Carbonylation","Organometallics","2005","24","6","1119","","10.1021/om049131p","","","0.71073","MoKα","","0.0343","0.0292","","","0.0721","0.0754","","","","","","1.035","","","","has coordinates,has disorder","178645","2020-10-21","18:00:00",""
"4075828","10.091","0.001","9.3702","0.0007","23.476","0.003","90","","111.232","0.007","90","","2069.1","0.4","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C45 H48 Br2 N2 P2 Pt -","- C45 H48 Br2 N2 P2 Pt -","- C90 H96 Br4 N4 P4 Pt2 -","2","0.5","","Amijs, Catelijne H. M.; van Klink, Gerard P. M.; Lutz, Martin; Spek, Anthony L.; van Koten, Gerard","Functionalized Homolepticcis- andtrans-C,N-ortho-Chelated Aminoaryl Platinum(II) Complexes","Organometallics","2005","24","12","2944","","10.1021/om050144s","","","0.71073","MoKα","","0.0339","0.0322","","","0.0881","0.0891","","","","","","1.095","","","","has coordinates","178647","2020-10-21","18:00:00",""
"4075985","10.117","0.005","8.542","0.004","12.384","0.005","90","","108.73","0.03","90","","1013.5","0.8","233","2","233","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C20 H34 Os2 -","- C20 H34 Os2 -","- C40 H68 Os4 -","2","0.5","","Shima, Takanori; Suzuki, Hiroharu","Heterobimetallic Polyhydride Complex, Cp*Ru(μ-H)4OsCp* (Cp* = η5-C5Me5). Synthesis and Reaction with Ethylene","Organometallics","2005","24","16","3939","","10.1021/om0503996","","","0.71069","MoKα","","0.0288","0.0231","","","0.0579","0.0601","","","","","","1.09","","","","has coordinates","178648","2020-10-21","18:00:00",""
"4077271","19.811","0.002","11.8642","0.0012","23.391","0.002","90","","90.717","0.002","90","","5497.4","0.9","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Ru2(ap)4(C4TMS)","","","- C58 H54 N8 Ru2 Si2 -","- C58 H54 N8 Ru2 Si2 -","- C232 H216 N32 Ru8 Si8 -","4","1","","Xu, Guolin; Ren, Tong","Ru-σ-butadiynyl Complexes of the Tetraanilinopyridinatodiruthenium Core: Formation of a Bis-adduct","Organometallics","2001","20","11","2400","","10.1021/om001064l","","","0.71073","MoKα","","0.1095","0.065","","","0.1582","0.1811","","","","","","0.988","","","","has coordinates,has disorder","178661","2020-10-21","18:00:00",""
"4077347","14.007","0.003","11.252","0.002","20.389","0.004","90","","100.52","0.03","90","","3159.4","1.1","200","2","200","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C34 H21 B F15 Ti -","- C34 H21 B F15 Ti -","- C136 H84 B4 F60 Ti4 -","4","1","","Burlakov, V. V.; Arndt, P.; Baumann, W.; Spannenberg, A.; Rosenthal, U.; Letov, A. V.; Lyssenko, K. A.; Korlyukov, A. A.; Strunkina, L. I.; Minacheva, M. Kh.; Shur, V. B.","Synthesis and X-ray Crystal Structure Determination of New Zwitterionic Complexes of Titanocene","Organometallics","2001","20","19","4072","","10.1021/om0103052","","","0.71073","MoKα","","0.0532","0.0373","","","0.083","0.0869","","","","","","0.935","","","","has coordinates","178662","2020-10-21","18:00:00",""
"4078195","20.64","0.0011","10.3043","0.0005","17.9554","0.0009","90","","91.095","0.002","90","","3818.1","0.3","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C38 H40 Cl2 Cu2 Hg N4 O4 -","- C38 H40 Cl2 Cu2 Hg N4 O4 -","- C152 H160 Cl8 Cu8 Hg4 N16 O16 -","4","1","","Biswas, Saptarshi; Saha, Rajat; Ghosh, Ashutosh","Copper(II)‒Mercury(II) Heterometallic Complexes Derived from a Salen-Type Ligand: A New Coordination Mode of the Old Schiff Base Ligand","Organometallics","2012","31","10","3844","","10.1021/om201033q","","","0.71073","MoKα","","0.1488","0.0761","","","0.1862","0.2271","","","","","","1.024","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078322","11.201","0.012","9.608","0.011","16.174","0.013","90","","132.85","0.05","90","","1276","2","110","2","110","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H32 Ag I N4 -","- C26 H32 Ag I N4 -","- C52 H64 Ag2 I2 N8 -","2","0.5","","Su, Haw-Lih; Pérez, Lisa M.; Lee, Sheng-Jui; Reibenspies, Joseph H.; Bazzi, Hassan S.; Bergbreiter, David E.","Studies of Ligand Exchange in N-Heterocyclic Carbene Silver(I) Complexes","Organometallics","2012","31","10","4063","","10.1021/om300340w","","","0.71073","MoKα","","0.1106","0.076","","","0.1834","0.2425","","","","","","1.08","","","","has coordinates","271475","2021-12-16","11:44:43",""
"4079268","21.766","0.0019","10.8346","0.0009","23.806","0.002","90","","150.061","0.001","90","","2801.9","0.4","100","2","100","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C55 H50 Cl6 I2 O P2 Rh2 S2 -","- C55 H50 Cl6 I2 O P2 Rh2 S2 -","- C110 H100 Cl12 I4 O2 P4 Rh4 S4 -","2","0.5","","Nguyen, Duc Hanh; Modrego, F. Javier; Cetina-Casas, J. Miguel; Gómez-Bautista, Daniel; Jiménez, M. Victoria; Castarlenas, Ricardo; Lahoz, Fernando J.; Oro, Luis A.; Pérez-Torrente, Jesús J.","Steric Effects in the Oxidative Addition of MeI to a Sulfido-Bridged ZrRh2Early‒Late Heterobimetallic Compound","Organometallics","2012","31","17","6395","","10.1021/om300629k","","","0.71073","MoKα","","0.0772","0.0504","","","0.1134","0.1238","","","","","","1.027","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079648","18.488","0.011","16.061","0.013","23.785","0.014","90","","108.99","0.07","90","","6678","8","140","1","140","1","","","","","","","","7","P 1 2/c 1","-P 2yc","13","Compound 1A1","","","- C112 H144 Ag4 Au4 F40 N8 O12 -","- C107.4 H82.4 Ag4 Au4 F40 N7.6 O12 -","- C214.8 H164.8 Ag8 Au8 F80 N15.2 O24 -","2","0.5","","Savjani, Nicky; Wilkinson, Luke A.; Hughes, David L.; Schormann, Mark; Bochmann, Manfred","Synthesis, Structure, and Luminescent Behavior of Anionic Oligomeric and Polymeric Ag2Au2Clusters","Organometallics","2012","31","21","7600","","10.1021/om300911h","","","0.71073","Mo-Kα","","0.1763","0.1178","","","0.2286","0.2485","","","","","","1.042","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079824","10.303","0.0005","13.6864","0.0006","17.109","0.0008","90","","90.143","0.001","90","","2412.55","0.19","153","2","153","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H24 N2 O6 Pd -","- C26 H24 N2 O6 Pd -","- C104 H96 N8 O24 Pd4 -","4","1","","Hauwert, Peter; Dunsford, Jay J.; Tromp, Dorette S.; Weigand, Jan J.; Lutz, Martin; Cavell, Kingsley J.; Elsevier, Cornelis J.","Zerovalent [Pd(NHC)(Alkene)1,2] Complexes Bearing Expanded-Ring N-Heterocyclic Carbene Ligands in Transfer Hydrogenation of Alkynes","Organometallics","2013","32","1","131","","10.1021/om300930w","","","0.71073","MoKα","","0.0502","0.0325","","","0.0785","0.086","","","","","","1.041","","","","has coordinates","178687","2020-10-21","18:00:00",""
"4080153","11.506","0.004","9.706","0.004","18.323","0.005","90","","127.603","0.014","90","","1621.2","1","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","(Me-PNP-iPr)RhCl","","","- C26 H40 Cl N P2 Rh -","- C26 H40 Cl N P2 Rh -","- C52 H80 Cl2 N2 P4 Rh2 -","2","0.5","","Smith, Dan A.; Herbert, David E.; Walensky, Justin R.; Ozerov, Oleg V.","Monomeric Rhodium(II) Complexes Supported by a Diarylamido/Bis(phosphine) PNP Pincer Ligand and Their Reactivity Toward Dihydrogen","Organometallics","2013","32","7","2050","","10.1021/om300760j","","","0.71073","MoKα","","0.0365","0.0316","","","0.0785","0.0805","","","","","","1.064","","","","has coordinates","178690","2020-10-21","18:00:00",""
"4080470","16.7558","0.001","12.3342","0.0007","25.7292","0.0012","90","","95.714","0.002","90","","5291","0.5","100","2","100","2","","","","","","","synthesis as described","6","P 1 2/c 1","-P 2yc","13","","","","- C102 H108 Cl10 F12 Fe2 P6 -","- C102 H108 Cl10 F12 Fe2 P6 -","- C204 H216 Cl20 F24 Fe4 P12 -","2","0.5","","Burgun, Alexandre; Gendron, Frédéric; Roisnel, Thierry; Sinbandhit, Sourisak; Costuas, Karine; Halet, Jean-François; Bruce, Michael I.; Lapinte, Claude","Oxidative Activation of Aryldiynyl‒Iron Complexes: Regioselective Dimerization","Organometallics","2013","32","6","1866","","10.1021/om400014g","","x-ray","0.71073","MoKα","","0.112","0.0867","","","0.2057","0.2237","","","","","","1.034","","","","has coordinates","178693","2020-10-21","18:00:00",""
"4080644","24.97","0.002","15.7974","0.0012","21.8435","0.0017","90","","105.631","0.003","90","","8297.7","1.1","200","2","200","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C58 H106 Ag3 F18 N12 O Sb3 -","- C58 H106 Ag3 F18 N12 O Sb3 -","- C232 H424 Ag12 F72 N48 O4 Sb12 -","4","1","","Kriechbaum, Margit; Hölbling, Johanna; Stammler, Hans-Georg; List, Manuela; Berger, Raphael J. F.; Monkowius, Uwe","Unprecedented Large Temperature Dependence of Silver(I)‒Silver(I) Distances in Some N-Heterocyclic Carbene Silver(I) Complex Salts","Organometallics","2013","32","10","2876","","10.1021/om300932r","","","0.71073","MoKα","","0.0697","0.0428","","","0.1094","0.1195","","","","","","1.061","","","","has coordinates,has disorder","178695","2020-10-21","18:00:00",""
"4080829","11.119","0.002","17.365","0.004","18.3179","0.0019","90","","81.104","0.014","90","","3494.3","1.1","200","2","200","2","","","","","","","synthesis as described","7","P 1 2/c 1","-P 2yc","13","Ag[Ag(NHC)2].2H2O","","","- C54 H68 Ag2 N4 Na2 O15 S4 -","- C54 H68 Ag2 N4 Na2 O15 S4 -","- C108 H136 Ag4 N8 Na4 O30 S8 -","2","0.5","","Baquero, Edwin A.; Silbestri, Gustavo F.; Gómez-Sal, Pilar; Flores, Juan C.; de Jesús, Ernesto","Sulfonated Water-Soluble N-Heterocyclic Carbene Silver(I) Complexes: Behavior in Aqueous Medium and as NHC-Transfer Agents to Platinum(II)","Organometallics","2013","32","9","2814","","10.1021/om400228s","","x-ray","0.71073","MoKα","","0.1421","0.11","","","0.2993","0.3227","","","","","","1.137","","","","has coordinates,has disorder","178697","2020-10-21","18:00:00",""
"4080895","11.0258","0.0014","7.9891","0.0008","11.8817","0.0013","90","","100.068","0.014","90","","1030.5","0.2","293","2","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","[(COD)Pt(CC(3Me)Ph)2]","Bis((3-methylphenyl)ethynyl)(1,5-cyclooctadien)platinum(II)","","- C26 H26 Pt -","- C26 H26 Pt -","- C52 H52 Pt2 -","2","0.5","","Lüning, Anna; Schur, Julia; Hamel, Laura; Ott, Ingo; Klein, Axel","Strong Cytotoxicity of Organometallic Platinum Complexes with Alkynyl Ligands","Organometallics","2013","32","13","3662","","10.1021/om400293u","","","0.71073","MoKα","","0.0346","0.0274","","","0.0629","0.0648","","","","","","1.18","","","","has coordinates","178697","2020-10-21","18:00:00",""
"4080896","10.3303","0.0011","7.9232","0.0012","11.9632","0.0013","90","","90.055","0.008","90","","979.2","0.2","293","2","170","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","[(COD)Pt(CC(4Me)Ph)2]","Bis((4-methylphenyl)ethynyl)(1,5-cyclooctadien)platinum(II)","","- C26 H26 Pt -","- C26 H26 Pt -","- C52 H52 Pt2 -","2","0.5","","Lüning, Anna; Schur, Julia; Hamel, Laura; Ott, Ingo; Klein, Axel","Strong Cytotoxicity of Organometallic Platinum Complexes with Alkynyl Ligands","Organometallics","2013","32","13","3662","","10.1021/om400293u","","","0.71073","MoKα","","0.027","0.0242","","","0.063","0.0638","","","","","","1.172","","","","has coordinates","178697","2020-10-21","18:00:00",""
"4080897","10.0746","0.0017","7.8999","0.0017","11.7544","0.0017","90","","95.684","0.019","90","","930.9","0.3","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","[(COD)Pt(CC(4F)Ph)2]","Bis((4-fluorophenyl)ethynyl)(1,5-cyclooctadien)platinum(II)","","- C24 H20 F2 Pt -","- C24 H20 F2 Pt -","- C48 H40 F4 Pt2 -","2","0.5","","Lüning, Anna; Schur, Julia; Hamel, Laura; Ott, Ingo; Klein, Axel","Strong Cytotoxicity of Organometallic Platinum Complexes with Alkynyl Ligands","Organometallics","2013","32","13","3662","","10.1021/om400293u","","","0.71073","MoKα","","0.0654","0.0339","","","0.0541","0.0594","","","","","","0.863","","","","has coordinates","178697","2020-10-21","18:00:00",""
"4080898","11.326","0.002","7.898","0.0007","12.0525","0.0018","90","","93.06","0.02","90","","1076.6","0.3","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","[(COD)Pt(CC(4OMe)Ph)2]","Bis((4-methoxyphenyl)ethynyl)(1,5-cyclooctadien)platinum(II)","","- C26 H20 O2 Pt -","- C26 H20 O2 Pt -","- C52 H40 O4 Pt2 -","2","0.5","","Lüning, Anna; Schur, Julia; Hamel, Laura; Ott, Ingo; Klein, Axel","Strong Cytotoxicity of Organometallic Platinum Complexes with Alkynyl Ligands","Organometallics","2013","32","13","3662","","10.1021/om400293u","","","0.71073","MoKα","","0.1028","0.0614","","","0.1255","0.1429","","","","","","1.051","","","","has coordinates","178697","2020-10-21","18:00:00",""
"4081528","18.754","0.002","13.3093","0.0018","12.2583","0.0012","90","","108.671","0.008","90","","2898.7","0.6","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C27 H35 F3 Fe N6 O3 S -","- C27 H35 F3 Fe N6 O3 S -","- C108 H140 F12 Fe4 N24 O12 S4 -","4","1","","Klapp, Lutz R. R.; Bruhn, Clemens; Leibold, Michael; Siemeling, Ulrich","Ferrocene-Based Bis(guanidines): Superbases for Tridentate N,Fe,N-Coordination","Organometallics","2013","32","20","5862","","10.1021/om400454v","","","0.71073","MoKα","","0.1736","0.0771","","","0.1696","0.2123","","","","","","0.828","","","","has coordinates","178704","2020-10-21","18:00:00",""
"4081576","14.1265","0.0003","9.1841","0.0002","24.2253","0.0005","90","","91.143","0.002","90","","3142.35","0.12","293","2","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C37 H52 Fe2 -","- C37 H52 Fe2 -","- C148 H208 Fe8 -","4","1","","Malberg, Jennifer; Lupton, Elizabeth; Schnöckelborg, Eva-Maria; de Bruin, Bas; Sutter, Jörg; Meyer, Karsten; Hartl, František; Wolf, Robert","Synthesis and Electronic Structure of Dissymmetrical, Naphthalene-Bridged Sandwich Complexes [Cp′Fe(μ-C10H8)MCp*]x(x= 0, +1; M = Fe, Ru; Cp′ = η5-C5H2-1,2,4-tBu3; Cp* = η5-C5Me5)","Organometallics","2013","32","20","6040","","10.1021/om4005862","","","1.54178","CuKα","","0.0605","0.0553","","","0.1663","0.1739","","","","","","1.126","","","","has coordinates","178704","2020-10-21","18:00:00",""
"4082310","4.266","0.005","12.434","0.005","35.955","0.005","90","","91.706","0.005","90","","1906","2","200","2","200","2","","","","","","","synthesis as described","6","P 1 2/c 1","-P 2yc","13","","","","- C22.5 H20 Ag0.5 Br0.5 N O2 -","- C22.5 H20 Ag0.5 Br0.5 N O2 -","- C90 H80 Ag2 Br2 N4 O8 -","4","1","","Ortiz, Alba M.; Gómez-Sal, Pilar; Flores, Juan C.; de Jesús, Ernesto","Learning about Steric Effects in NHC Complexes from a 1D Silver Coordination Polymer with Fréchet Dendrons","Organometallics","2014","33","2","600","","10.1021/om401060u","","x-ray","0.71069","MoKα","","0.0952","0.0541","","","0.1315","0.1505","","","","","","0.989","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4082329","17.126","0.003","8.1375","0.0014","24.219","0.002","90","","135","0.005","90","","2386.6","0.7","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C24 H38 S2 Zn -","- C24 H38 S2 Zn -","- C96 H152 S8 Zn4 -","4","1","","Chilleck, Maren A.; Braun, Thomas; Braun, Beatrice; Mebs, Stefan","Neutral and Cationic Zinc Complexes with N- and S-Donor-Functionalized Cyclopentadienyl Ligands","Organometallics","2014","33","2","551","","10.1021/om401076g","","","1.54178","CuKα","","0.0657","0.0638","","","0.1835","0.1842","","","","","","1.287","","","","has coordinates","178712","2020-10-21","18:00:00",""
"4082682","10.5663","0.001","7.9451","0.0005","23.736","0.003","90","","91.6","0.009","90","","1991.9","0.3","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C16 H24 B2 Br2 Li2 O -","- C16 H24 B2 Br2 Li2 O -","- C64 H96 B8 Br8 Li8 O4 -","4","1","","Seven, Ömer; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","High-Yield Syntheses and Reactivity Studies of 1,2-Diborylated and 1,2,4,5-Tetraborylated Benzenes","Organometallics","2014","33","5","1291","","10.1021/om500104w","","","0.71073","MoKα","","0.052","0.0371","","","0.0842","0.0889","","","","","","1.018","","","","has coordinates","178715","2020-10-21","18:00:00",""
"4082913","15.5329","0.0012","8.4482","0.0006","24.9274","0.0018","90","","102.76","0.006","90","","3190.3","0.4","200","2","200","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C21 H35 Cl7 N2 O2 P Re Sb -","- C21 H35 Cl7 N2 O2 P Re Sb -","- C84 H140 Cl28 N8 O8 P4 Re4 Sb4 -","4","1","","Pichaandi, Kothanda Rama; Mazzotta, Michael G.; Harwood, John S.; Fanwick, Phillip E.; Abu-Omar, Mahdi M.","Synthesis, Dynamics, and DFT Studies of Rhenium Dicarbonyl PNN Pincer Complexes in Three Different Oxidation States","Organometallics","2014","33","7","1672","","10.1021/om500007m","","","1.54178","CuKα","","0.077","0.0631","","","0.1783","0.1905","","","","","","1.156","","","","has coordinates","178718","2020-10-21","18:00:00",""
"4083176","12.4033","0.0004","16.7348","0.0006","20.6758","0.0006","90","","95.449","0.001","90","","4272.2","0.2","150","2","150","2","","","","","","","synthesis as described","6","P 1 2/c 1","-P 2yc","13","","","","- C83 H88 Cl10 F6 Fe2 P5 -","- C83 H88 Cl10 F6 Fe2 P5 -","- C166 H176 Cl20 F12 Fe4 P10 -","2","0.5","","Burgun, Alexandre; Gendron, Frédéric; Sumby, Christopher J.; Roisnel, Thierry; Cador, Olivier; Costuas, Karine; Halet, Jean-François; Bruce, Michael I.; Lapinte, Claude","Hexatriynediyl Chain Spanning Two Cp*(dppe)M Termini (M = Fe, Ru): Evidence for the Dependence of Electronic and Magnetic Couplings on the Relative Orientation of the Termini","Organometallics","2014","33","10","2613","","10.1021/om500328y","","x-ray","0.71073","MoKα","","0.0697","0.0497","","","0.1254","0.1385","","","","","","1.042","","","","has coordinates","178720","2020-10-21","18:00:00",""
"4084485","37.37","0.003","8.0272","0.0006","34.986","0.003","90","","116.886","0.004","90","","9360.6","1.3","100","","100","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H37 Cl N2 Ni P2 -","- C20 H37 Cl N2 Ni P2 -","- C320 H592 Cl16 N32 Ni16 P32 -","16","4","","Murugesan, Sathiyamoorthy; Stöger, Berthold; Carvalho, Maria Deus; Ferreira, Liliana P.; Pittenauer, Ernst; Allmaier, Günter; Veiros, Luis F.; Kirchner, Karl","Synthesis and Reactivity of Four- and Five-Coordinate Low-Spin Cobalt(II) PCP Pincer Complexes and Some Nickel(II) Analogues","Organometallics","2014","","","141009125933001","","10.1021/om5007769","","x-ray","0.71073","MoKα","","0.0766","0.0629","","","0.077","0.0779","","","","4.26","4.26","3.93","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4084935","20.407","0.007","11.594","0.004","17.802","0.006","90","","110.72","0.006","90","","3940","2","200","2","200","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C31 H44 Cl8 N4 O2 Pd -","- C31 H44 Cl8 N4 O2 Pd -","- C124 H176 Cl32 N16 O8 Pd4 -","4","1","","Zhai, Feng; Jordan, Richard F.","Hydrogen Bonding Behavior of Amide-Functionalized α-Diimine Palladium Complexes","Organometallics","2014","33","24","7176","","10.1021/om500978n","","","0.71073","MoKα","","0.0913","0.0614","","","0.1371","0.1464","","","","","","0.988","","","","has coordinates","178738","2020-10-21","18:00:00",""
"4085665","18.7988","0.0003","10.5392","0.0002","18.3902","0.0003","90","","100.016","0.001","90","","3588.02","0.11","200","2","200","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C31.5 H52 Si4 U -","- C31.5 H52 Si4 U -","- C126 H208 Si16 U4 -","4","1","","Le Roy, Jennifer J.; Gorelsky, Serge I.; Korobkov, Ilia; Murugesu, Muralee","Slow Magnetic Relaxation in Uranium(III) and Neodymium(III) Cyclooctatetraenyl Complexes","Organometallics","2015","34","8","1415","","10.1021/om501214c","","","0.71073","MoKα","","0.0611","0.0366","","","0.0634","0.0701","","","","","","1.012","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4085955","11.2267","0.0009","13.8576","0.0011","20.1437","0.0016","90","","106.046","0.002","90","","3011.8","0.4","120","2","120","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C32 H44 O P2 -","- C32 H44 O P2 -","- C128 H176 O4 P8 -","4","1","","Babbini, Dominic C.; Iluc, Vlad M.","Iridium PCsp3P-type Complexes with a Hemilabile Anisole Tether","Organometallics","2015","34","13","3141","","10.1021/acs.organomet.5b00165","","","0.71073","MoKα","","0.0419","0.0338","","","0.0817","0.0886","","","","","","1.036","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"4086519","20.825","0.012","22.131","0.012","17.786","0.01","90","","110.706","0.01","90","","7668","7","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C43 H49 N3 Th -","- C43 H49 N3 Th -","- C344 H392 N24 Th8 -","8","2","","Yang, Pikun; Zhou, Enwei; Fang, Bo; Hou, Guohua; Zi, Guofu; Walter, Marc D.","Preparation of (η5-C5Me5)2Th(bipy) and Its Reactivity toward Small Molecules","Organometallics","2016","","","","","10.1021/acs.organomet.6b00357","","","0.71073","MoKα","","0.1108","0.0639","","","0.1517","0.1782","","","","","","1.004","","","","has coordinates","190287","2020-10-21","18:00:00",""
"4086540","21.0498","0.0009","9.0223","0.0004","17.5494","0.0008","90","","99.5","0.002","90","","3287.2","0.3","193","2","193","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C26 H24.33 B0.67 Co F2 N P0.33 -","- C26 H24.3333 B0.666667 Co F2 N P0.333333 -","- C156 H146 B4 Co6 F12 N6 P2 -","6","1.5","","Vanicek, Stefan; Kopacka, Holger; Wurst, Klaus; Müller, Thomas; Hassenrück, Christopher; Winter, Rainer F.; Bildstein, Benno","Monofunctionalized Cobaltocenium Compounds by Dediazoniation Reactions of Cobaltoceniumdiazonium Bis(hexafluorophosphate)","Organometallics","2016","35","12","2101","","10.1021/acs.organomet.6b00329","","","0.71073","MoKα","","0.0473","0.0394","","","0.1022","0.107","","","","","","1.048","","","","has coordinates,has disorder","184942","2020-10-21","18:00:00",""
"4087181","18.5059","0.0006","18.4989","0.0006","38.0938","0.0012","90","","90.809","0.002","90","","13039.7","0.7","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C128 H104 B2 Br2 F48 Ni2 P4 -","- C128 H104 B2 Br2 F48 Ni2 P4 -","- C512 H416 B8 Br8 F192 Ni8 P16 -","4","1","","Jia, Xiaofei; Zhang, Mengru; Li, Maohua; Pan, Fan; Ding, Kuiling; Jia, Li; Crandall, Laura A.; Engle, James T.; Ziegler, Christopher J.","Zwitterionic Nickel(II) Catalysts for CO‒Ethylene Alternating Copolymerization","Organometallics","2017","36","6","1122","","10.1021/acs.organomet.6b00932","","","1.54178","CuKα","","0.0731","0.0536","","","0.1375","0.1519","","","","","","1.029","","","","has coordinates,has disorder","194873","2020-10-21","18:00:00",""
"4087517","15.0546","0.0006","12.9697","0.0004","15.2621","0.0004","90","","108.171","0.002","90","","2831.37","0.16","200","2","200","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C32 H36 O4 U -","- C32 H36 O4 U -","- C128 H144 O16 U4 -","4","1","","Johnson, Sara A.; Kiernicki, John J.; Fanwick, Phillip E.; Bart, Suzanne C.","New Benzylpotassium Reagents and Their Utility for the Synthesis of Homoleptic Uranium(IV) Benzyl Derivatives","Organometallics","2015","34","12","2889","","10.1021/acs.organomet.5b00212","","","1.54178","CuKα","","0.0467","0.0411","","","0.1205","0.1271","","","","","","1.13","","","","has coordinates","236832","2020-10-21","18:00:00",""
"4087633","18.289","0.005","15.117","0.004","33.538","0.01","90","","101.814","0.003","90","","9076","4","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C80 H104 Cl2 Fe2 O4 S4 Y2 -","- C80 H104 Cl2 Fe2 O4 S4 Y2 -","- C320 H416 Cl8 Fe8 O16 S16 Y8 -","4","1","","Wang, Xinke; Brosmer, Jonathan L.; Thevenon, Arnaud; Diaconescu, Paula L.","Highly Active Yttrium Catalysts for the Ring-Opening Polymerization of ε-Caprolactone and δ-Valerolactone","Organometallics","2015","34","19","4700","","10.1021/acs.organomet.5b00442","","","0.71073","MoKα","","0.0671","0.046","","","0.1179","0.1258","","","","","","1.04","","","","has coordinates","236892","2020-10-21","18:00:00",""
"4087860","16.1463","0.0004","12.769","0.0002","23.6131","0.0005","90","","130.002","0.001","90","","3729.27","0.15","173","2","173","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","[(PMe)3Au(MeCN)]4-(POM)2","","","- C28 H60 Au4 N8 O40 P4 Si W12 -","- C28 H60 Au4 N8 O40 P4 Si W12 -","- C56 H120 Au8 N16 O80 P8 Si2 W24 -","2","0.5","","Hueber, Damien; Hoffmann, Marie; de Frémont, Pierre; Pale, Patrick; Blanc, Aurélien","Polyoxometalate-Gold(I)/H+ Complexes: Air-Stable, Efficient, Polyvalent, and Bifunctional Catalysts","Organometallics","2015","34","20","5065","","10.1021/acs.organomet.5b00656","","x-ray","0.71073","MoKα","","0.0631","0.0532","","","0.1346","0.1395","","","","","","1.143","","","","has coordinates,has disorder","237056","2020-10-21","18:00:00",""
"4087930","21.281","0.01","9.058","0.004","19.919","0.009","90","","106.919","0.008","90","","3673","3","200","2","200","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C36 H44 F4 N2 Ni2 P2 -","- C36 H44 F4 N2 Ni2 P2 -","- C144 H176 F16 N8 Ni8 P8 -","4","1","","Wang, Lin; Sun, Hongjian; Li, Xiaoyan","Imine Nitrogen Bridged Binuclear Nickel Complexes via N‒H Bond Activation: Synthesis, Characterization, Unexpected C,N-Coupling Reaction, and Their Catalytic Application in Hydrosilylation of Aldehydes","Organometallics","2015","34","20","5175","","10.1021/acs.organomet.5b00734","","","0.71073","MoKα","","0.1256","0.0717","","","0.1664","0.1927","","","","","","1.055","","","","has coordinates","237131","2020-10-21","18:00:00",""
"4088312","16.8362","0.0003","12.092","0.0003","23.6248","0.0004","90","","91.107","0.002","90","","4808.72","0.17","130","2","130","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","2DAC-BH3","","","- C48 H59 B N4 O4 -","- C48 H59 B N4 O4 -","- C192 H236 B4 N16 O16 -","4","1","","Lastovickova, Dominika N.; Bielawski, Christopher W.","Diamidocarbene Induced B‒H Activation: A New Class of Initiator-Free Olefin Hydroboration Reagents","Organometallics","2016","35","5","706","","10.1021/acs.organomet.5b00997","","","1.54184","CuKα","","0.0565","0.0428","","","0.1073","0.1188","","","","","","1.006","","","","has coordinates","237453","2020-10-21","18:00:00",""
"4088833","12.715","0.003","8.6713","0.0017","16.752","0.006","90","","119.13","0.02","90","","1613.4","0.8","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C16 H50 Ge O Si8 -","- C16 H50 Ge O Si8 -","- C32 H100 Ge2 O2 Si16 -","2","0.5","","Walewska, Małgorzata; Hlina, Johann; Baumgartner, Judith; Müller, Thomas; Marschner, Christoph","Basic Reactivity Pattern of a Cyclic Disilylated Germylene.","Organometallics","2016","35","16","2728","2737","10.1021/acs.organomet.6b00482","","","0.71073","MoKα","","0.0251","0.0238","","","0.0639","0.0645","","","","","","1.094","","","","has coordinates","237850","2020-10-21","18:00:00",""
"4100154","22.0188","0.0011","10.7399","0.0004","17.5903","0.0009","90","","102.75","0.01","90","","4057.2","0.3","100","2","100","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C31 H53 B F12 Mn2 N6 O4 P2 -","- C31 H53 B F12 Mn2 N6 O4 P2 -","- C124 H212 B4 F48 Mn8 N24 O16 P8 -","4","1","","","","Journal of the American Chemical Society","2005","","","","","10.1021/ja042655w","","","","","","","0.0526","","","0.109","","","","","","","","","","","has coordinates,has disorder","178747","2020-10-21","18:00:00",""
"4100548","11.6882","0.0008","13.7871","0.0009","32.499","0.002","90","","97.748","0.001","90","","5189.3","0.6","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C62 H18 Ag20 F42 N2 O37 -","- C62 H18 Ag19.996 F42 N2 O37 -","- C124 H36 Ag39.992 F84 N4 O74 -","2","0.5","","","","Journal of the American Chemical Society","2005","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","178751","2020-10-21","18:00:00",""
"4100605","17.4879","0.0011","12.5107","0.0008","21.5927","0.0013","90","","93.604","0.001","90","","4714.8","0.5","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H36 Cu5 N21 O5 -","- C48 H36 Cu5 N21 O5 -","- C192 H144 Cu20 N84 O20 -","4","1","","Zhang, Jie-Peng; Lin, Yan-Yong; Huang, Xiao-Chun; Chen, Xiao-Ming","Copper(I) 1,2,4-Triazolates and Related Complexes: Studies of the Solvothermal Ligand Reactions, Network Topologies, and Photoluminescence Properties","Journal of the American Chemical Society","2005","","","","","10.1021/ja042222t","","","","","","","","","","","","","","","","","","","","","has coordinates","178752","2020-10-21","18:00:00",""
"4100698","19.2722","0.001","10.1801","0.0005","20.1124","0.001","90","","92.995","0.001","90","","3940.5","0.3","294","1","294","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C40 H40 B2 Fe N12 -","- C40 H40 B2 Fe N12 -","- C160 H160 B8 Fe4 N48 -","4","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","178752","2020-10-21","18:00:00",""
"4100699","19.1932","0.001","10.1436","0.0005","19.6711","0.001","90","","93.812","0.001","90","","3821.3","0.3","150","1","150","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C40 H40 B2 Fe N12 -","- C40 H40 B2 Fe N12 -","- C160 H160 B8 Fe4 N48 -","4","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","178752","2020-10-21","18:00:00",""
"4100700","18.7923","0.001","10.1073","0.0005","19.8578","0.001","90","","94.987","0.001","90","","3757.5","0.3","90","1","90","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C40 H40 B2 Fe N12 -","- C40 H40 B2 Fe N12 -","- C160 H160 B8 Fe4 N48 -","4","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","178753","2020-10-21","18:00:00",""
"4101027","16.8289","0.0016","12.6197","0.0016","13.8203","0.0015","90","","94.394","0.006","90","","2926.5","0.6","143","1","143","1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C35 H30 Cl N7 O3.5 Ru -","- C33.057 H26.09 Cl N6.0285 O3.5 Ru -","- C132.228 H104.36 Cl4 N24.114 O14 Ru4 -","4","1","","","","Journal of the American Chemical Society","2006","","","","","10.1021/ja055523r","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4101688","14.7861","0.0006","12.0082","0.0006","15.9814","0.001","90","","105.197","0.004","90","","2738.3","0.3","103","2","103","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C32 H26 N4 O4 -","- C32 H26 N4 O4 -","- C128 H104 N16 O16 -","4","1","","Kawabata, Takeo; Jiang, Changsheng; Hayashi, Kazuhiro; Tsubaki, Kazunori; Yoshimura, Tomoyuki; Majumdar, Swapan; Sasamori, Takahiro; Tokitoh, Norihiro","Axially chiral binaphthyl surrogates with an inner N-H-N hydrogen bond.","Journal of the American Chemical Society","2009","131","1","54","55","10.1021/ja808213r","","","0.71069","MoKα","","0.075","0.0423","","","0.0966","0.1113","","","","","","1.016","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4101936","10.0564","0.0004","9.5585","0.0004","17.2269","0.0007","90","","98.8441","0.0018","90","","1636.23","0.12","15","2","15","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C96 H64 B2 N4 O4 -","2","0.5","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0671","0.0482","","","0.1319","0.1493","","","","","","1.071","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00",""
"4101937","10.0768","0.0004","9.5915","0.0004","17.2589","0.0006","90","","98.9481","0.0004","90","","1647.8","0.11","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C96 H64 B2 N4 O4 -","2","0.5","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0557","0.0465","","","0.1304","0.1385","","","","","","1.064","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00",""
"4101938","10.085","0.0003","9.592","0.0003","17.2635","0.0005","90","","98.9476","0.0004","90","","1649.67","0.09","110","2","110","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C96 H64 B2 N4 O4 -","2","0.5","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0563","0.0468","","","0.1311","0.1392","","","","","","1.066","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00",""
"4101944","10.0865","0.0003","9.6443","0.0003","17.2734","0.0005","90","","98.9999","0.0005","90","","1659.62","0.09","175","2","175","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C96 H64 B2 N4 O4 -","2","0.5","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.057","0.0457","","","0.132","0.1418","","","","","","1.086","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00",""
"4101945","10.0856","0.0003","9.6576","0.0003","17.2759","0.0005","90","","99.0203","0.0004","90","","1661.91","0.09","185","2","185","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C96 H64 B2 N4 O4 -","2","0.5","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0566","0.0452","","","0.128","0.1374","","","","","","1.086","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00",""
"4101946","10.0785","0.0004","9.6735","0.0004","17.2616","0.0007","90","","99.0046","0.0007","90","","1662.17","0.12","200","2","200","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C96 H64 B2 N4 O4 -","2","0.5","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0613","0.0466","","","0.1291","0.1397","","","","","","1.087","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00",""
"4101947","10.0913","0.0005","9.7249","0.0005","17.2789","0.0008","90","","99.1054","0.0008","90","","1674.33","0.14","250","2","250","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C96 H64 B2 N4 O4 -","2","0.5","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0602","0.0454","","","0.1293","0.1411","","","","","","1.089","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00",""
"4101948","10.0982","0.001","9.7433","0.001","17.2806","0.0017","90","","99.1317","0.0016","90","","1678.7","0.3","270","2","270","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C96 H64 B2 N4 O4 -","2","0.5","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0605","0.0449","","","0.1271","0.1401","","","","","","1.065","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00",""
"4101949","10.096","0.002","9.766","0.002","17.292","0.004","90","","99.234","0.003","90","","1682.9","0.6","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C96 H64 B2 N4 O4 -","2","0.5","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0591","0.0461","","","0.135","0.1481","","","","","","1.073","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00",""
"4103137","9.9282","0.0004","9.1895","0.0003","14.1922","0.0005","90","","91.579","0.002","90","","1294.34","0.08","193","2","193","2","","","","","","","chemical synthesis","4","P 1 2/c 1","-P 2yc","13","","Bis[2-(N,N-dimethylaminomethyl)phenyl-C,N]pyridineiron(II) Benzene Solvate","","- C29 H35 Fe N3 -","- C29 H35 Fe N3 -","- C58 H70 Fe2 N6 -","2","0.5","","Wu, Jessica Y.; Stanzl, Benjamin N.; Ritter, Tobias","A Strategy for the Synthesis of Well-Defined Iron Catalysts and Application to Regioselective Diene Hydrosilylation","Journal of the American Chemical Society","2010","132","38","13214","13216","10.1021/ja106853y","","","0.71073","MoKα","","0.0529","0.032","","","0.0589","0.0656","","","","","","1.04","","","","has coordinates,has disorder","276389","2022-06-29","09:14:29",""
"4103244","18.799","0.004","7.4924","0.0015","23.685","0.005","90","","125.38","0.03","90","","2720","1.4","223","2","223","1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C54 H68 N16 O5 -","- C54 H68 N16 O5 -","- C108 H136 N32 O10 -","2","0.5","","Jonathan L. Sessler; Jiajia Cai; Han-Yuan Gong; Xiaoping Yang; Jonathan F. Arambula; Benjamin P. Hay","A Pyrrolyl-Based Triazolophane: A Macrocyclic Receptor With CH and NH Donor Groups That Exhibits a Preference for Pyrophosphate Anions","Journal of the American Chemical Society","2010","132","","14058","14060","10.1021/ja107098r","","","0.710747","MoKα","","0.1945","0.0929","","","0.2083","0.27","","","","","","0.986","","","","has coordinates","178778","2020-10-21","18:00:00",""
"4103269","17.8217","0.0013","6.837","0.0005","26.0357","0.0016","90","","124.977","0.004","90","","2599.4","0.3","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C61 H49 Cl2 N2 Pd -","- C61 H49 Cl2 N2 Pd -","- C122 H98 Cl4 N4 Pd2 -","2","0.5","","Revital Kaminker; Leila Motiei; Antonino Gulino; Ignazio Fragalà; Linda J. W. Shimon; Guennadi Evmenenko; Pulak Dutta; Mark A. Iron; Milko E. van der Boom","Stepwise Assembly of Coordination-Based Metal-Organic Networks","Journal of the American Chemical Society","2010","132","","14554","14561","10.1021/ja105518n","","","0.71073","MoKα","","0.0985","0.0589","","","0.1419","0.1663","","","","","","1.033","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00",""
"4103575","14.87","0.003","7.1093","0.0012","14.467","0.002","90","","114.471","0.002","90","","1392","0.4","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H16 D16 N14 O9 -","- C24 H16 D16 N14 O9 -","- C48 H32 D32 N28 O18 -","2","0.5","","Matthew W. Powner; John D. Sutherland; Jack W. Szostak","Chemoselective Multicomponent One-Pot Assembly of Purine Precursors in Water","Journal of the American Chemical Society","2010","132","","16677","16688","10.1021/ja108197s","","","0.71073","MoKα","","0.0598","0.0479","","","0.122","0.133","","","","","","1.055","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00",""
"4103712","24.806","0.002","9.6651","0.0008","24.423","0.002","90","","106.87","0.02","90","","5603.5","1","110","2","110","2","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","","","- C38 H34 -","- C38 H34 -","- C304 H272 -","8","2","","Enrico Faggi; Rosa M. Sebastián; Roser Pleixats; Adelina Vallribera; Alexandr Shafir; Alejandra Rodríguez-Gimeno; Carmen Ramírez de Arellano","Direct Assembly of Polyarenes via C-C Coupling Using PIFA/BF3.Et2O","Journal of the American Chemical Society","2010","132","","17980","17982","10.1021/ja107467c","","","0.71073","MoKα","","0.0905","0.0426","","","0.0824","0.09","","","","","","0.802","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4104651","15.171","0.002","9.7939","0.0014","19.8","0.003","90","","107.199","0.003","90","","2810.4","0.7","273","2","273","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C63 H56 Al2 N2 O4 S2 -","- C63 H53 Al2 N2 O4 S2 -","- C126 H106 Al4 N4 O8 S4 -","2","0.5","","Masato Ohashi; Osamu Kishizaki; Haruo Ikeda; Sensuke Ogoshi","Ni(0)-Catalyzed Formation of Azaaluminacyclopentenes via Azanickelacyclopentenes: A Unique Nickel/Aluminum Double Transmetalation Reaction","Journal of the American Chemical Society","2009","131","","9160","9161","10.1021/ja903175g","","","0.71075","MoKα","","0.1018","0.0685","","","0.1801","0.2089","","","","","","1.042","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104719","21.933","0.004","11.176","0.002","23.927","0.005","90","","97.41","0.03","90","","5816","2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C52.8 H32.8 Cu4 F18 N4 O13 -","- C50 H28 Cu4 F18 N4 O13 -","- C200 H112 Cu16 F72 N16 O52 -","4","1","","Andrew Ozarowski; Iwona B. Szymańska; Tadeusz Muzioł; Julia Jezierska","High-Field EPR and Magnetic Susceptibility Studies on Binuclear and Tetranuclear Copper Trifluoroacetate Complexes. X-ray Structure Determination of Three Tetranuclear Quinoline Adducts of Copper(II) Trifluoroacetate","Journal of the American Chemical Society","2009","131","","10279","10292","10.1021/ja902695y","","","0.71073","MoKα","","0.1085","0.0845","","","0.2032","0.224","","","","","","1.114","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4105010","14.8299","0.0013","10.5763","0.0008","24.935","0.002","90","","100.616","0.002","90","","3844","0.5","173.1","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C41 H104 Fe8 N8 S9 Si8 -","- C41 H104 Fe8 N8 S9 Si8 -","- C82 H208 Fe16 N16 S18 Si16 -","2","0.5","","Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi","Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster","Journal of the American Chemical Society","2009","131","","13168","13178","10.1021/ja9055036","","","0.7107","MoKα","","","0.0478","","","","0.1179","","","","","","1.023","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105484","16.3473","0.001","6.2913","0.0004","7.0714","0.0004","90","","95.929","0.002","90","","723.37","0.08","90","2","90","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Zn(CO2C6H5-CN4-C6H4CO2)(H2O)2","","","- C15 H10 N4 O5 Zn -","- C15 H10 N4 O5 Zn -","- C30 H20 N8 O10 Zn2 -","2","0.5","","Shao-Liang Zheng; Yizhong Wang; Zhipeng Yu; Qing Lin; Philip Coppens","Direct Observation of a Photoinduced Nonstabilized Nitrile Imine Structure in the Solid State","Journal of the American Chemical Society","2009","131","","18036","18037","10.1021/ja9094523","","x-ray","0.71073","MoKα","","0.0321","0.0264","","","0.0693","0.072","","","","","","1.104","","","","has coordinates,has disorder","178800","2020-10-21","18:00:00",""
"4105485","16.3448","0.0017","6.3194","0.0007","7.1439","0.0007","90","","96.469","0.003","90","","733.19","0.13","90","2","90","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C15 H10 N3.89 O5 Zn -","- C15 H10 N3.894 O5 Zn -","- C30 H20 N7.788 O10 Zn2 -","2","0.5","","Shao-Liang Zheng; Yizhong Wang; Zhipeng Yu; Qing Lin; Philip Coppens","Direct Observation of a Photoinduced Nonstabilized Nitrile Imine Structure in the Solid State","Journal of the American Chemical Society","2009","131","","18036","18037","10.1021/ja9094523","","x-ray","0.71073","MoKα","","0.0582","0.0437","","","0.1087","0.1167","","","","","","1.129","","","","has coordinates,has disorder","178800","2020-10-21","18:00:00",""
"4106178","10.089","0.007","11.036","0.008","25.286","0.018","90","","98.095","0.015","90","","2787","3","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","[(HL)2Fe6(NCMe)2]PF6","","","- C54 H60 F6 Fe6 N16 P -","- C54 H60 F6 Fe6 N16 P -","- C108 H120 F12 Fe12 N32 P2 -","2","0.5","","Qinliang Zhao; T. David Harris; Theodore A. Betley","[(HL)2Fe6(NCMe)m]n+ (m = 0, 2, 4, 6; n= -1, 0, 1, 2, 3, 4, 6): An Electron-Transfer Series Featuring Octahedral Fe6 Clusters Supported by a Hexaamide Ligand Platform","Journal of the American Chemical Society","2011","133","","8293","8306","10.1021/ja2015845","","","0.71073","MoKα","","0.1558","0.0932","","","0.2412","0.2792","","","","","","1.102","","","","has coordinates","178807","2020-10-21","18:00:00",""
"4106603","16.105","0.0012","4.7876","0.0004","9.2686","0.0007","90","","90.024","0.004","90","","714.65","0.1","123","1","123","1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C6 H8 O4 Zn -","- C6 H8 O4 Zn -","- C24 H32 O16 Zn4 -","4","1","","Stephan Klaus; Maximilian W. Lehenmeier; Eberhardt Herdtweck; Peter Deglmann; Anna K. Ott; Bernhard Rieger","Mechanistic Insights into Heterogeneous Zinc Dicarboxylates and Theoretical Considerations for CO2-Epoxide Copolymerization","Journal of the American Chemical Society","2011","133","","13151","13161","10.1021/ja204481w","","","0.71073","MoKα","","0.0171","0.017","","","0.0436","0.0437","","","","","","1.204","","","","has coordinates","178812","2020-10-21","18:00:00",""
"4106755","11.7943","0.0001","12.0767","0.0001","22.5791","0.0003","90","","111.838","0.001","90","","2985.29","0.06","100","2","100","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C20 H20 B F6 N5 O5 Ru S -","- C20 H20 B F6 N5 O5 Ru S -","- C80 H80 B4 F24 N20 O20 Ru4 S4 -","4","1","","Brian L. Conley; Denver Guess; Travis J. Williams","A Robust, Air-Stable, Reusable Ruthenium Catalyst for Dehydrogenation of Ammonia Borane","Journal of the American Chemical Society","2011","133","","14212","14215","10.1021/ja2058154","","","0.71073","MoKα","","0.0431","0.0314","","","0.063","0.0657","","","","","","1.078","","","","has coordinates,has disorder","178813","2020-10-21","18:00:00",""
"4107091","15.051","0.001","9.7","0.001","27.781","0.003","90","","93.933","0.003","90","","4046.3","0.7","295","2","295","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C38 H27 Ag F15 O2 P -","- C38 H27 Ag F15 O2 P -","- C152 H108 Ag4 F60 O8 P4 -","4","1","","Feng Cai; Xiaotao Pu; Xiangbing Qi; Vincent Lynch; Akella Radha; Joseph M. Ready","Chiral Allene-Containing Phosphines in Asymmetric Catalysis","Journal of the American Chemical Society","2011","133","","18066","18069","10.1021/ja207748r","","","0.71069","MoKα","","0.1421","0.0894","","","0.1878","0.2167","","","","","","1.057","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107247","19.7871","0.0005","8.1334","0.0002","20.1056","0.0005","90","","95.943","0.001","90","","3218.33","0.14","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C33 H15 B F20 Si -","- C33 H15 B F20 Si -","- C132 H60 B4 F80 Si4 -","4","1","","Muhammad Farooq Ibad; Peter Langer; Axel Schulz; Alexander Villinger","Silylium-Arene Adducts: An Experimental and Theoretical Study","Journal of the American Chemical Society","2011","133","","21016","21027","10.1021/ja209693a","","","0.71073","MoKα","","0.0879","0.0429","","","0.0959","0.1074","","","","","","1.024","","","","has coordinates","178818","2020-10-21","18:00:00",""
"4107248","19.7831","0.0008","8.1266","0.0003","20.0827","0.0009","90","","95.903","0.002","90","","3211.6","0.2","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C33 H15 B F20 Si -","- C33 H15 B F20 Si -","- C132 H60 B4 F80 Si4 -","4","1","","Muhammad Farooq Ibad; Peter Langer; Axel Schulz; Alexander Villinger","Silylium-Arene Adducts: An Experimental and Theoretical Study","Journal of the American Chemical Society","2011","133","","21016","21027","10.1021/ja209693a","","","0.71073","MoKα","","0.1023","0.0456","","","0.1021","0.1167","","","","","","0.949","","","","has coordinates","178818","2020-10-21","18:00:00",""
"4108877","17.104","0.005","19.452","0.005","13.778","0.004","90","","101.422","0.004","90","","4493","2","203","2","203","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C51 H63 N4 Th -","- C51 H63 N4 Th -","- C204 H252 N16 Th4 -","4","1","","Thibault Cantat; Christopher R. Graves; Kimberly C. Jantunen; Carol J. Burns; Brian L. Scott; Eric J. Schelter; David E. Morris; P. Jeffrey Hay; Jaqueline L. Kiplinger","Evidence for the Involvement of 5f Orbitals in the Bonding and Reactivity of Organometallic Actinide Compounds: Thorium(IV) and Uranium(IV) Bis(hydrazonato) Complexes","Journal of the American Chemical Society","2008","130","","17537","17551","10.1021/ja8067287","","","0.71073","MoKα","","0.0461","0.0357","","","0.0907","0.0946","","","","","","1.262","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4109157","8.168","0.0017","6.5842","0.0014","9.3127","0.0014","90","","116.089","0.013","90","","449.81","0.16","571","2","571","2","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","","","- Np2 O5 -","- Np2 O5 -","- Np8 O20 -","4","1","","Tori Z. Forbes; Peter C. Burns; S. Skanthakumar; L. Soderholm","Synthesis, Structure, and Magnetism of Np2O5","Journal of the American Chemical Society","2007","129","","2760","2761","10.1021/ja069250r","","","0.71073","MoKα","","0.0659","0.0291","","","0.0608","0.0635","","","","","","0.749","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109205","15.137","0.0007","9.235","0.0002","23.225","0.001","90","","91.05","0.0014","90","","3246.1","0.2","130","2","130","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","SMK002","SMK002","","- C38 H46 N2 Pt -","- C38 H46 N2 Pt -","- C152 H184 N8 Pt4 -","4","1","","Susan M. Kloek; Karen I. Goldberg","Competitive C-H Bond Activation and β-Hydride Elimination at Platinum(II)","Journal of the American Chemical Society","2007","129","","3460","3461","10.1021/ja0669629","","","0.71073","MoKα","","0.0932","0.0432","","","0.0873","0.096","","","","","","0.997","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109665","18.323","0.002","18.073","0.002","17.688","0.002","90","","93.657","0.002","90","","5845.5","1.1","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C61.25 H81.5 B Cl0.5 N2 Os P2 -","- C61.255 H81 B Cl0.5 N2 Os P2 -","- C245.02 H324 B4 Cl2 N8 Os4 P8 -","4","1","","Tamara Bolaño; Ricardo Castarlenas; Miguel A. Esteruelas; Enrique Oñate","Sequential and Selective Hydrogenation of the Cα-Cβ and M-Cα Double Bonds of an Allenylidene Ligand Coordinated to Osmium: New Reaction Patterns between an Allenylidene Complex and Alcohols","Journal of the American Chemical Society","2007","129","","8850","8859","10.1021/ja071972a","","","0.71073","MoKα","","0.1134","0.0668","","","0.1518","0.1735","","","","","","1.043","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4110162","14.6527","0.0014","4.1102","0.0004","37.163","0.004","90","","92.642","0.002","90","","2235.8","0.4","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C41 H50 Br2 N2 O S6 -","- C41 H46 Br2 N2 O S6 -","- C82 H92 Br4 N4 O2 S12 -","2","0.5","","Wai-Yeung Wong; Xing-Zhu Wang; Ze He; Kwok-Kwan Chan; Aleksandra B. Djurišić; Kai-Yin Cheung; Cho-Tung Yip; Alan Man-Ching Ng; Yan Yan Xi; Chris S. K. Mak; Wai-Kin Chan","Tuning the Absorption, Charge Transport Properties, and Solar Cell Efficiency with the Number of Thienyl Rings in Platinum-Containing Poly(aryleneethynylene)s","Journal of the American Chemical Society","2007","129","","14372","14380","10.1021/ja074959z","","","0.71073","MoKα","","0.0973","0.059","","","0.1428","0.1635","","","","","","1.026","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110623","14.88","0.006","6.954","0.003","18.075","0.007","90","","93.056","0.005","90","","1867.7","1.3","151.2","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C20 H21 Cl O5 -","- C20 H21 Cl O5 -","- C80 H84 Cl4 O20 -","4","1","","Brian G. Pujanauski; B. A. Bhanu Prasad; Richmond Sarpong","Pt-Catalyzed Tandem Epoxide Fragmentation/Pentannulation of Propargylic Esters","Journal of the American Chemical Society","2006","128","","6786","6787","10.1021/ja061549m","","","0.7107","MoKα","","0.0718","0.0441","","0.0802","","0.0664","","","","","","1.418","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4111354","15.765","0.006","11.994","0.005","24.584","0.008","90","","114.619","0.005","90","","4226","3","173","1","173","1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C11 H24 F6 O6 P2 S2 -","- C11 H24 F6 O6 P2 S2 -","- C88 H192 F48 O48 P16 S16 -","8","2","","Jan J. Weigand; Susanne D. Riegel; Neil Burford; Andreas Decken","Prototypical Phosphorus Analogues of Ethane: General and Versatile Synthetic Approaches to Hexaalkylated P-P Diphosphonium Cations","Journal of the American Chemical Society","2007","129","","7969","7976","10.1021/ja071306+","","x-ray","0.71073","MoKα","","0.0652","0.04","","","0.0976","0.1177","","","","","","1.047","","","","has coordinates,has disorder","178884","2020-10-21","18:00:00",""
"4111820","22.605","0.004","12.583","0.002","19.132","0.003","90","","102.68","0.02","90","","5309.2","1.6","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C58 H82 Al2 N4 O2 -","- C58 H82 Al2 N4 O2 -","- C232 H328 Al8 N16 O8 -","4","1","","Hongping Zhu; Jianfang Chai; Vojtech Jancik; Herbert W. Roesky; William A. Merrill; Philip P. Power","The Selective Preparation of an Aluminum Oxide and Its Isomeric C-H-Activated Hydroxide","Journal of the American Chemical Society","2005","127","","10170","10171","10.1021/ja052400y","","","1.54178","CuKα","","0.0421","0.0344","","","0.085","0.0895","","","","","","1.025","","","","has coordinates,has disorder","178889","2020-10-21","18:00:00",""
"4112017","17.995","0.002","13.483","0.001","18.008","0.002","90","","90.06","0.008","90","","4369.2","0.8","130","","130","1","","","","","","","see text","5","P 1 2/c 1","-P 2yc","13","","","","- C52 H66 B O2 Ti -","- C52 H64.776 B O2 Ti -","- C208 H259.104 B4 O8 Ti4 -","4","1","","Marco W. Bouwkamp; Peter H. M. Budzelaar; Jeroen Gercama; Isabel Del Hierro Morales; Jeanette de Wolf; Auke Meetsma; Sergei I. Troyanov; Jan H. Teuben; Bart Hessen","Naked (C5Me5)2M Cations (M = Sc, Ti, and V) and Their Fluoroarene Complexes","Journal of the American Chemical Society","2005","127","","14310","14319","10.1021/ja054544i","","","0.71073","MoKα","","","0.1322","","","0.0535","","","","","","","1.025","","","","has coordinates","178891","2020-10-21","18:00:00",""
"4112175","12.937","0.002","12.0613","0.0018","25.706","0.004","90","","97.777","0.002","90","","3974.2","1.1","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C70 H120 Si6 Y4 -","- C70 H120 Si6 Y4 -","- C140 H240 Si12 Y8 -","2","0.5","","Dongmei Cui; Olivier Tardif; Zhaomin Hou","Tetranuclear Rare Earth Metal Polyhydrido Complexes Composed of ""(C5Me4SiMe3)LnH2"" Units. Unique Reactivities toward Unsaturated C-C, C-N, and C-O Bonds","Journal of the American Chemical Society","2004","126","","1312","1313","10.1021/ja039324o","","","0.71073","MoKα","","0.1222","0.0528","","","0.0896","0.1068","","","","","","0.956","","","","has coordinates,has disorder","178892","2020-10-21","18:00:00",""
"4112191","19.684","0.002","10.1828","0.0011","14.0169","0.0016","90","","110.408","0.002","90","","2633.2","0.5","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20.5 H46 B2 Br Cl P2 -","- C20.5 H46 B2 Br Cl P2 -","- C82 H184 B8 Br4 Cl4 P8 -","4","1","","Hideki Amii; Lidija Vranicar; Heinz Gornitzka; Didier Bourissou; Guy Bertrand","Radical-Type Reactivity of the 1,3-Dibora-2,4-Diphosphoniocyclobutane-1,3-diyl","Journal of the American Chemical Society","2004","126","","1344","1345","10.1021/ja039920i","","","0.71073","MoKα","","0.0377","0.0301","","","0.072","0.0761","","","","","","1.033","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4112253","19.3458","0.0008","10.7479","0.0004","18.3294","0.0007","90","","113.714","0.001","90","","3489.4","0.2","120","2","120","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C30 H56 N3 P2 Re Si2 -","- C30 H56 N3 P2 Re Si2 -","- C120 H224 N12 P8 Re4 Si8 -","4","1","","Oleg V. Ozerov; Maren Pink; Lori A. Watson; Kenneth G. Caulton","Aromatic vs Aliphatic C-H Cleavage of Alkyl-Substituted Pyridines by (PNPiPr)Re Compounds","Journal of the American Chemical Society","2004","126","","2105","2113","10.1021/ja036999i","","","0.71073","MoKα","","0.036","0.0266","","","0.0588","0.0622","","","","","","1.025","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4112602","25.2946","0.0013","38.864","0.0011","50.4327","0.0019","90","","93.234","0.002","90","","49499","3","100","2","100","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C378 H475 F24 N8 O76.5 P8 Pt4 S8 -","- C353 H304 F24 N8 O64 P8 Pt4 S8 -","- C1412 H1216 F96 N32 O256 P32 Pt16 S32 -","4","1","","Roberta Pinalli; Veronica Cristini; Valerio Sottili; Silvano Geremia; Mara Campagnolo; Andrea Caneschi; Enrico Dalcanale","Cavitand-Based Nanoscale Coordination Cages","Journal of the American Chemical Society","2004","126","","6516","6517","10.1021/ja038694+","","","1.2","synchrotron","","0.1319","0.11","","","0.2752","0.2971","","","","","","1.159","","","","has coordinates","178897","2020-10-21","18:00:00",""
"4112795","12.4977","0.0007","12.4868","0.0005","19.579","0.001","90","","102.338","0.001","90","","2984.9","0.3","150.2","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C30 H20 B Br2 F12 Fe2 -","- C30 H20 B0.5 Br2 F12 Fe2 -","- C120 H80 B2 Br8 F48 Fe8 -","4","1","","Masato Takano; Masaaki Okazaki; Hiromi Tobita","Stepwise Bromination of Two Acetylene Molecules on a Butterfly-Type Tetrairon Core and Reactivity of the Resulting Bromoacetylene Fragment toward Nucleophiles","Journal of the American Chemical Society","2004","126","","9190","9191","10.1021/ja047569a","","","0.7107","MoKα","","","0.0581","","","","0.1663","","","","","","1.609","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4112826","13.5222","0.0006","22.7307","0.0011","18.1594","0.0009","90","","105.379","0.001","90","","5381.8","0.4","193","2","293","2","","","","","","","","10","P 1 2/c 1","-P 2yc","13","","","","- C51 H44 Ag Au3 B2 F8 N3 O P3 S -","- C51 H42 Ag Au3 B2 F8 N3 O2 P3 S -","- C204 H168 Ag4 Au12 B8 F32 N12 O8 P12 S4 -","4","1","","Quan-Ming Wang; Young-A. Lee; Olga Crespo; Joseph Deaton; Ching Tang; Henry J. Gysling; M. Concepción Gimeno; Carmen Larraz; M. Dolores Villacampa; Antonio Laguna; Richard Eisenberg","Intensely Luminescent Gold(I)-Silver(I) Cluster Complexes with Tunable Structural Features","Journal of the American Chemical Society","2004","126","","9488","9489","10.1021/ja048091d","","","0.71073","MoKα","","0.0494","0.0356","","","0.0897","0.0946","","","","","","1.036","","","","has coordinates","178899","2020-10-21","18:00:00",""
"4112827","13.6315","0.0011","22.7608","0.0019","18.331","0.0015","90","","105.227","0.002","90","","5487.8","0.8","193","2","193","2","","","","","","","","10","P 1 2/c 1","-P 2yc","13","","","","- C52 H47 Ag Au3 B2 F8 N3 O1.5 P3 Se -","- C52 H42 Ag Au3 B2 F8 N3 O1.5 P3 Se -","- C208 H168 Ag4 Au12 B8 F32 N12 O6 P12 Se4 -","4","1","","Quan-Ming Wang; Young-A. Lee; Olga Crespo; Joseph Deaton; Ching Tang; Henry J. Gysling; M. Concepción Gimeno; Carmen Larraz; M. Dolores Villacampa; Antonio Laguna; Richard Eisenberg","Intensely Luminescent Gold(I)-Silver(I) Cluster Complexes with Tunable Structural Features","Journal of the American Chemical Society","2004","126","","9488","9489","10.1021/ja048091d","","","0.71073","MoKα","","0.0448","0.0336","","","0.0887","0.0932","","","","","","1.037","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4113103","17.5859","0.0007","6.6451","0.0001","24.7237","0.001","90","","107.946","0.0012","90","","2748.65","0.16","150","1","150","1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C13 H16 Cl2 Zr -","- C13 H16 Cl2 Zr -","- C104 H128 Cl16 Zr8 -","8","2","","Asha Rajapakshe; Nadine E. Gruhn; Dennis L. Lichtenberger; Rehan Basta; Atta M. Arif; Richard D. Ernst","Pentadienyls vs Cyclopentadienyls and Reversal of Metal-Ligand Bonding Affinity with Metal Oxidation State: Synthesis, Molecular Structures, and Electronic Structures of High-Valent Zirconium Pentadienyl Complexes","Journal of the American Chemical Society","2004","126","","14105","14116","10.1021/ja040123+","","","0.71073","MoKα","","0.0579","0.0376","","","0.0684","0.075","","","","","","1.082","","","","has coordinates","178902","2020-10-21","18:00:00",""
"4113586","18.713","0.002","14.8714","0.0008","27.042","0.002","90","","97.767","0.002","90","","7456.4","1","193","2","193","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C86 H76 Cl44 Mn12 O48 P2 -","- C85 H70 Cl41 Mn12 O48 P2 -","- C170 H140 Cl82 Mn24 O96 P4 -","2","0.5","","Monica Soler; Wolfgang Wernsdorfer; Khalil A. Abboud; John C. Huffman; Ernest R. Davidson; David N. Hendrickson; George Christou","Single-Molecule Magnets: Two-Electron Reduced Version of a Mn12 Complex and Environmental Influences on the Magnetization Relaxation of (PPh4)2[Mn12O12(O2CCHCl2)16(H2O)4]","Journal of the American Chemical Society","2003","125","","3576","3588","10.1021/ja021066s","","","0.71073","MoKα","","0.1364","0.0623","","","0.1614","0.1804","","","","","","0.992","","","","has coordinates,has disorder","178906","2020-10-21","18:00:00",""
"4113642","14.825","0.002","10.574","0.001","24.9363","0.0006","90","","100.624","0.0005","90","","3842","0.6","193.2","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C41 H104 Fe8 N8 S9 Si8 -","- C79 H207 Fe16 N16 S17 Si16 -","- C158 H414 Fe32 N32 S34 Si32 -","2","0.5","","Yasuhiro Ohki; Yusuke Sunada; Masaru Honda; Motomi Katada; Kazuyuki Tatsumi","Synthesis of the P-Cluster Inorganic Core of Nitrogenases","Journal of the American Chemical Society","2003","125","","4052","4053","10.1021/ja029383m","","","0.7107","MoKα","","","0.038","","","","0.0433","","","","","","2.823","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4113971","16.581","0.003","17.679","0.003","18.365","0.003","90","","110.131","0.003","90","","5054.5","1.5","213","2","213","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","[Mo2(DAniF)3]2(mu-2,3-dicyano-5,6-dioxypyrazinate),2(CH2Cl2),Et2O","","","- C102 H104 Cl4 Mo4 N16 O15 -","- C102.262 H93.582 Cl4 Mo4 N16 O14.998 -","- C204.524 H187.164 Cl8 Mo8 N32 O29.996 -","2","0.5","","F. A. Cotton; James P. Donahue; Carlos A. Murillo; Lisa M. Pérez; Rongmin Yu","Cyclic Polyamidato Dianions as Bridges between Mo24+ Units: Synthesis, Crystal Structures, Electrochemistry, Absorption Spectra, and Electronic Structures","Journal of the American Chemical Society","2003","125","","8900","8910","10.1021/ja0358044","","","0.71073","MoKα","","0.0833","0.0671","","","0.1547","0.1668","","","","","","1.142","","","","has coordinates,has disorder","178910","2020-10-21","18:00:00",""
"4114491","15.034","0.002","8.4086","0.0011","19.42","0.003","90","","94.592","0.005","90","","2447.1","0.6","158","2","158","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C28 H36 N2 O2 -","- C28 H36 N2 O2 -","- C112 H144 N8 O8 -","4","1","","David A. Shultz; Rosario M. Fico; Hyoyoung Lee; Jeff W. Kampf; Kristin Kirschbaum; A. Alan Pinkerton; Paul D. Boyle","Mechanisms of Exchange Modulation in Trimethylenemethane-type Biradicals: The Roles of Conformation and Spin Density","Journal of the American Chemical Society","2003","125","","15426","15432","10.1021/ja037787o","","","0.71073","MoKα","","0.1185","0.0584","","","0.133","0.1642","","","","","","0.983","","","","has coordinates","178915","2020-10-21","18:00:00",""
"4114741","17.0899","0.0003","9.0332","0.0001","15.8559","0.0001","90","","102.86","","90","","2386.38","0.05","296","2","296","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C19 H19 N3 -","- C19 H19 N3 -","- C114 H114 N18 -","6","1.5","","Man-kit Leung; Ashis B. Mandal; Chih-Chieh Wang; Gene-Hsiang Lee; Shie-Ming Peng; Hsing-Ling Cheng; Guor-Rong Her; Ito Chao; Hsiu-Feng Lu; Ying-Chieh Sun; Mei-Ying Shiao; Pi-Tai Chou","Self-Complementarity of Oligo-2-aminopyridines: A New Class of Hydrogen-Bonded Ladders","Journal of the American Chemical Society","2002","124","","4287","4297","10.1021/ja011679p","","","0.71073","MoKα","","0.1497","0.0778","","0.2142","0.1773","","","","1.08","1.258","1.258","","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114756","14.278","0.002","13.516","0.002","20.452","0.002","90","","106.06","0.01","90","","3792.8","0.9","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C16 H22 I8 N8 S4 -","- C16 H22 I8 N8 S4 -","- C64 H88 I32 N32 S16 -","4","1","","M. Carla Aragoni; Massimiliano Arca; Francesco Demartin; Francesco A. Devillanova; Alessandra Garau; Francesco Isaia; Vito Lippolis; Gaetano Verani","Anti-Thyroid Drug Methimazole: X-ray Characterization of Two Novel Ionic Disulfides Obtained from Its Chemical Oxidation by I2","Journal of the American Chemical Society","2002","124","","4538","4539","10.1021/ja012731k","","","0.71073","MoKα","","0.0978","0.0463","","0.1229","0.1147","","","","0.927","1.19","1.19","","","","","has coordinates","209504","2020-10-21","18:00:00",""
"4115249","17.995","0.002","13.483","0.001","18.008","0.002","90","","90.06","0.008","90","","4369.2","0.8","130","","130","1","","","","","","","see text","5","P 1 2/c 1","-P 2yc","13","","","","- C52 H66 B O2 Ti -","- C208 H259.104 B4 O8 Ti4 -","- C208 H259.104 B4 O8 Ti4 -","1","0.25","","Marco W. Bouwkamp; Jeanette de Wolf; Isabel del Hierro Morales; Jeroen Gercama; Auke Meetsma; Sergei I. Troyanov; Bart Hessen; Jan H. Teuben","Structure of the Decamethyl Titanocene Cation, a Metallocene with Two Agostic C-H Bonds, and Its Interaction with Fluorocarbons","Journal of the American Chemical Society","2002","124","","12956","12957","10.1021/ja027617w","","","0.71073","MoKα","","","0.1322","","","0.0535","","","","","","","1.025","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115927","14.936","0.003","13.216","0.003","31.407","0.006","90","","95.43","0.03","90","","6172","2","114","2","114","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C30 H57.5 Ag F12 N23 O22.75 P2 Pt3 -","- C30 H42 Ag F12 N23 O22.75 P2 Pt3 -","- C120 H168 Ag4 F48 N92 O91 P8 Pt12 -","4","1","","Ralf-Dieter Schnebeck; Eva Freisinger; Frank Glahé; Bernhard Lippert","Molecular Architecture Based on Metal Triangles Derived from 2,2'-Bipyrazine (Bpz) and EnMII (M = Pt, Pd)","Journal of the American Chemical Society","2000","122","","1381","1390","10.1021/ja9931325","","","0.71073","MoKα","","0.1058","0.0528","","0.1702","0.1276","","","","0.94","1.121","1.121","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4116329","21.199","0.004","8.1123","0.0007","20.854","0.003","90","","105.51","0.03","90","","3455.7","1","293","","293","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","HMPB-N-methylaniline","","","- C38 H44 N4 P2 -","- C38 H44 N4 P2 -","- C152 H176 N16 P8 -","4","1","","Douglas E. Berning; Kattesh V. Katti; Charles L. Barnes; Wynn A. Volkert","Chemical and Biomedical Motifs of the Reactions of Hydroxymethylphosphines with Amines, Amino Acids, and Model Peptides","Journal of the American Chemical Society","1999","121","","1658","1664","10.1021/ja9827604","","","1.54056","CopperKα","","0.047","0.047","","0.073","0.073","","","","","2.43","2.43","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116400","15.789","0.002","6.188","0.004","16.816","0.002","90","","111.115","0.007","90","","1532.7","1","296.2","","296.2","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C32 H20 Ag3 Cl3 O12 -","- C32 H20 Ag3 Cl3 O12 -","- C64 H40 Ag6 Cl6 O24 -","2","0.5","","Munakata, Megumu; Wu, Liang Ping; Ning, Gui Ling; Kuroda-Sowa, Takayoshi; Maekawa, Masahiko; Suenaga, Yusaku; Maeno, Naoto","Construction of Metal Sandwich Systems Derived from Assembly of Silver(I) Complexes with Polycyclic Aromatic Compounds","Journal of the American Chemical Society","1999","121","21","4968","4976","10.1021/ja983950h","","","0.7107","MoKα","","0.0302","0.0302","","","0.0404","0.0403","","","","","","1.515","","","","has coordinates","219221","2020-10-21","18:00:00",""
"4118151","10.448","0.003","6.4192","0.0018","23.051","0.006","90","","97.22","0.003","90","","1533.7","0.7","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Samarium(III) Borate Chloride","","","- B18 Cl3 O38 Sm4 -","- B18 Cl3 O38 Sm4 -","- B36 Cl6 O76 Sm8 -","2","0.5","","Matthew J. Polinski; Daniel J. Grant; Shuao Wang; Evgeny V. Alekseev; Justin N. Cross; Eric M. Villa; Wulf Depmeier; Laura Gagliardi; Thomas E. Albrecht-Schmitt","Differentiating between Trivalent Lanthanides and Actinides","Journal of the American Chemical Society","2012","134","","10682","10692","10.1021/ja303804r","","","0.71073","MoKα","","0.0601","0.0398","","","0.0851","0.093","","","","","","1.042","","","","has coordinates","178952","2020-10-21","18:00:00",""
"4118152","10.4397","0.0003","6.4189","0.0002","23.0367","0.0006","90","","97.196","0.002","90","","1531.56","0.08","296","2","296","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Europium(III) Borate Chloride","","","- B18 Cl3 Eu4 O38 -","- B18 Cl3 Eu4 O38 -","- B36 Cl6 Eu8 O76 -","2","0.5","","Matthew J. Polinski; Daniel J. Grant; Shuao Wang; Evgeny V. Alekseev; Justin N. Cross; Eric M. Villa; Wulf Depmeier; Laura Gagliardi; Thomas E. Albrecht-Schmitt","Differentiating between Trivalent Lanthanides and Actinides","Journal of the American Chemical Society","2012","134","","10682","10692","10.1021/ja303804r","","","0.71073","MoKα","","0.0441","0.0288","","","0.0543","0.0574","","","","","","0.904","","","","has coordinates","178952","2020-10-21","18:00:00",""
"4118472","18.053","0.006","7.261","0.002","21.693","0.007","90","","94.324","0.004","90","","2835.5","1.5","110","2","110","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C16 H32.2 Fe2 N O4.1 P2 S2 -","- C16 H32.2 Fe2 N O4.1 P2 S2 -","- C64 H128.8 Fe8 N4 O16.4 P8 S8 -","4","1","","Chung-Hung Hsieh; Özlen F. Erdem; Scott D. Harman; Michael L. Singleton; Edward Reijerse; Wolfgang Lubitz; Codrina V. Popescu; Joseph H. Reibenspies; Scott M. Brothers; Michael B. Hall; Marcetta Y. Darensbourg","Structural and Spectroscopic Features of Mixed Valent FeIIFeI Complexes and Factors Related to the Rotated Configuration of Diiron Hydrogenase","Journal of the American Chemical Society","2012","134","","13089","13102","10.1021/ja304866r","","","0.71073","MoKα","","0.0748","0.0587","","","0.1524","0.165","","","","","","1.054","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4119139","11.1737","0.0003","18.9646","0.0005","33.8761","0.0008","90","","90.818","0.001","90","","7177.8","0.3","100","2","100","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C80 H66 F24 N6 P4 -","- C80 H66 F24 N6 P4 -","- C320 H264 F96 N24 P16 -","4","1","","Jonathan C. Barnes; Michal Juríček; Nathan L. Strutt; Marco Frasconi; Srinivasan Sampath; Marc A. Giesener; Psaras L. McGrier; Carson J. Bruns; Charlotte L. Stern; Amy A. Sarjeant; J. Fraser Stoddart","ExBox: A Polycyclic Aromatic Hydrocarbon Scavenger","Journal of the American Chemical Society","2013","135","","183","192","10.1021/ja307360n","","","1.54178","CuKα","","0.0519","0.0383","","","0.0954","0.1068","","","","","","1.036","","","","has coordinates","178962","2020-10-21","18:00:00",""
"4119500","16.564","0.003","7.2675","0.0015","16.904","0.003","90","","114.72","0.03","90","","1848.4","0.8","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C22 H18 I N O -","- C22 H18 I N O -","- C88 H72 I4 N4 O4 -","4","1","","Qiuzheng Tang; Dexin Xia; Xiqing Jin; Qing Zhang; Xiao-Qiang Sun; Congyang Wang","Re/Mg Bimetallic Tandem Catalysis for [4+2] Annulation of Benzamides and Alkynes via C-H/N-H Functionalization","Journal of the American Chemical Society","2013","135","","4628","4631","10.1021/ja400020e","","","0.71073","MoKα","","0.0618","0.0596","","","0.1302","0.1315","","","","","","1.118","","","","has coordinates","178966","2020-10-21","18:00:00",""
"4119585","15.1476","0.0016","9.9236","0.001","14.1593","0.0015","90","","102.873","0.002","90","","2074.9","0.4","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C19 H15 N2 O10 S2 Sc -","- C19 H15 N2 O10 S2 Sc -","- C76 H60 N8 O40 S8 Sc4 -","4","1","","Richard F. D'Vries; Victor A. de la Peña-O'Shea; Natalia Snejko; Marta Iglesias; Enrique Gutiérrez-Puebla; M. Angeles Monge","H3O2 Bridging Ligand in a Metal-Organic Framework. Insight into the Aqua-Hydroxo\λeftarrow\ρightarrowHydroxyl Equilibrium: A Combined Experimental and Theoretical Study","Journal of the American Chemical Society","2013","135","","5782","5792","10.1021/ja4005046","","","0.71073","MoKα","","0.126","0.069","","","0.1571","0.2018","","","","","","1.061","","","","has coordinates","178966","2020-10-21","18:00:00",""
"4120040","10.3826","0.0009","5.8079","0.0005","4.9429","0.0004","90","","90.072","0.004","90","","298.06","0.04","100","2","100.04","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- Ag F4 Na O4 V2 -","- Ag F4 Na O4 V2 -","- Ag2 F8 Na2 O8 V4 -","2","0.5","","Martin D. Donakowski; Arno Görne; John T. Vaughey; Kenneth R. Poeppelmeier","AgNa(VO2F2)2: A Trioxovanadium Fluoride with Unconventional Electrochemical Properties","Journal of the American Chemical Society","2013","135","","9898","9906","10.1021/ja404189t","","","0.71073","MoKα","","0.0166","0.0165","","","0.0439","0.044","","","","","","0.952","","","","has coordinates","178977","2020-10-21","18:00:00",""
"4120041","9.9951","0.0004","5.6771","0.0002","4.868","0.0002","90","","90.596","0.002","90","","276.211","0.019","100","2","99.97","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- Ag F4 Li O4 V2 -","- Ag F4 Li O4 V2 -","- Ag2 F8 Li2 O8 V4 -","2","0.5","","Martin D. Donakowski; Arno Görne; John T. Vaughey; Kenneth R. Poeppelmeier","AgNa(VO2F2)2: A Trioxovanadium Fluoride with Unconventional Electrochemical Properties","Journal of the American Chemical Society","2013","135","","9898","9906","10.1021/ja404189t","","","1.54184","CUKα","","0.02","0.0199","","","0.0539","0.0542","","","","","","1.192","","","","has coordinates","178977","2020-10-21","18:00:00",""
"4120367","22.135","0.005","11.333","0.003","22.798","0.006","90","","109.147","0.007","90","","5403","2","120","2","120","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Yb@C2(13)-C84-Ad","YbC84(II)Ad","","- C68.67 H13.33 Cl2 Yb0.67 -","- C68.7227 H13.3333 Cl2 Yb0.613333 -","- C412.336 H80 Cl12 Yb3.68 -","6","1.5","","Wenjun Zhang; Mitsuaki Suzuki; Yunpeng Xie; Lipiao Bao; Wenting Cai; Zdenek Slanina; Shigeru Nagase; Ming Xu; Takeshi Akasaka; Xing Lu","Molecular Structure and Chemical Property of a Divalent Metallofullerene Yb@C2(13)-C84","Journal of the American Chemical Society","2013","135","","12730","12735","10.1021/ja405223t","","","1","synchrotron","","0.2056","0.1545","","","0.414","0.4395","","","","","","1.624","","","","has coordinates,has disorder","178980","2020-10-21","18:00:00",""
"4120789","21.7034","0.0009","11.9656","0.0005","28.3255","0.0012","90","","90.602","0.002","90","","7355.6","0.5","193","2","193","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C72 H52 Au B F24 P2 Sn2 -","- C72 H52 Au B F24 P2 Sn2 -","- C288 H208 Au4 B4 F96 P8 Sn8 -","4","1","","Nicolas Lassauque; Pauline Gualco; Sonia Mallet-Ladeira; Karinne Miqueu; Abderrahmane Amgoune; Didier Bourissou","Activation of a σ-SnSn Bond at Copper, Followed by Double Addition to an Alkyne","Journal of the American Chemical Society","2013","135","","13827","13834","10.1021/ja405516j","","x-ray","0.71073","MoKα","","0.0693","0.038","","","0.0838","0.0976","","","","","","1.013","","","","has coordinates,has disorder","178984","2020-10-21","18:00:00",""
"4121178","9.764","0.001","8.2135","0.0006","15.6688","0.0015","90","","90.694","0.008","90","","1256.5","0.2","183","2","183","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","[TcO2(L2)2](PF6)xH2O","","","- C18 H26 F6 N8 O3 P Tc -","- C18 H26 F6 N8 O3 P Tc -","- C36 H52 F12 N16 O6 P2 Tc2 -","2","0.5","","Michael Benz; Bernhard Spingler; Roger Alberto; Henrik Braband","Toward Organometallic 99mTc Imaging Agents: Synthesis of Water-Stable 99Tc-NHC Complexes","Journal of the American Chemical Society","2013","135","","17566","17572","10.1021/ja409499u","","","0.71069","MoKα","","0.0657","0.0496","","","0.1202","0.1278","","","","","","1.118","","","","has coordinates","179013","2020-10-21","18:00:00",""
"4121221","11.452","0.002","8.527","0.002","13.432","0.003","90","","113.31","0.02","90","","1204.6","0.5","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H40 Cl N P2 Rh -","- C20 H40 Cl N P2 Rh -","- C40 H80 Cl2 N2 P4 Rh2 -","2","0.5","","Markus G. Scheibel; Yanlin Wu; A. Claudia Stückl; Lennard Krause; Elena Carl; Dietmar Stalke; Bas de Bruin; Sven Schneider","Synthesis and Reactivity of a Transient, Terminal Nitrido Complex of Rhodium","Journal of the American Chemical Society","2013","135","","17719","17722","10.1021/ja409764j","","","0.71073","MoKα","","0.0202","0.0183","","","0.0472","0.0481","","","","","","1.085","","","","has coordinates","179014","2020-10-21","18:00:00",""
"4121254","13.5742","0.0015","6.4041","0.0007","8.1012","0.0009","90","","99.001","0.001","90","","695.57","0.13","100","2","100","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","[2,2-binaphthol-ligand]","","","- C10 H7 O -","- C10 H7 O -","- C40 H28 O4 -","4","1","","Keith W. Bentley; Yea G. Nam; Jaslynn M. Murphy; Christian Wolf","Chirality Sensing of Amines, Diamines, Amino Acids, Amino Alcohols, and α-Hydroxy Acids with a Single Probe","Journal of the American Chemical Society","2013","135","","18052","18055","10.1021/ja410428b","","","0.71073","MoKα","","0.0409","0.0382","","","0.118","0.1201","","","","","","1.082","","","","has coordinates","179014","2020-10-21","18:00:00",""
"4121256","5.4328","0.00054","5.41122","0.00058","11.9143","0.0015","90","","107.696","0.0049","90","","333.69","0.07","16","","16","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","Lithium TCNE","","","- C6 Li N4 -","- C6 Li N4 -","- C12 Li2 N8 -","2","0.5","","Jae-Hyuk Her; Peter W. Stephens; Royce A. Davidson; Kil Sik Min; Joshua D. Bagnato; Kipp van Schooten; Christoph Boehme; Joel S. Miller","Weak Ferromagnetic Ordering of the Li+[TCNE].- (TCNE = Tetracyanoethylene) Organic Magnet with an Interpenetrating Diamondoid Structure","Journal of the American Chemical Society","2013","135","","18060","18063","10.1021/ja410818e","powder diffraction","","0.700296","","","","","","","","","","0.019","1.45","","","","","","","has coordinates","179014","2020-10-21","18:00:00",""
"4121257","5.43283","0.00045","5.40633","0.00065","11.91039","0.00084","90","","107.655","0.0046","90","","333.35","0.05","20","","20","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C6 Li N4 -","- C6 Li N4 -","- C12 Li2 N8 -","2","0.5","","Jae-Hyuk Her; Peter W. Stephens; Royce A. Davidson; Kil Sik Min; Joshua D. Bagnato; Kipp van Schooten; Christoph Boehme; Joel S. Miller","Weak Ferromagnetic Ordering of the Li+[TCNE].- (TCNE = Tetracyanoethylene) Organic Magnet with an Interpenetrating Diamondoid Structure","Journal of the American Chemical Society","2013","135","","18060","18063","10.1021/ja410818e","powder diffraction","","0.690779","","","","","","","","","","","","","","","","","","has coordinates","179014","2020-10-21","18:00:00",""
"4121258","5.43311","0.0005","5.40704","0.00062","11.91853","0.00083","90","","107.547","0.0044","90","","333.84","0.05","50","","50","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C6 Li N4 -","- C6 Li N4 -","- C12 Li2 N8 -","2","0.5","","Jae-Hyuk Her; Peter W. Stephens; Royce A. Davidson; Kil Sik Min; Joshua D. Bagnato; Kipp van Schooten; Christoph Boehme; Joel S. Miller","Weak Ferromagnetic Ordering of the Li+[TCNE].- (TCNE = Tetracyanoethylene) Organic Magnet with an Interpenetrating Diamondoid Structure","Journal of the American Chemical Society","2013","135","","18060","18063","10.1021/ja410818e","powder diffraction","","0.690779","","","","","","","","","","","","","","","","","","has coordinates","179014","2020-10-21","18:00:00",""
"4121259","5.429","0.00044","5.40499","0.00076","11.9282","0.001","90","","107.284","0.0065","90","","334.21","0.06","100","","100","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C6 Li N4 -","- C6 Li N4 -","- C12 Li2 N8 -","2","0.5","","Jae-Hyuk Her; Peter W. Stephens; Royce A. Davidson; Kil Sik Min; Joshua D. Bagnato; Kipp van Schooten; Christoph Boehme; Joel S. Miller","Weak Ferromagnetic Ordering of the Li+[TCNE].- (TCNE = Tetracyanoethylene) Organic Magnet with an Interpenetrating Diamondoid Structure","Journal of the American Chemical Society","2013","135","","18060","18063","10.1021/ja410818e","powder diffraction","","0.690779","","","","","","","","","","","","","","","","","","has coordinates","179014","2020-10-21","18:00:00",""
"4121260","5.42859","0.00053","5.40755","0.00057","11.94771","0.0007","90","","106.995","0.0064","90","","335.41","0.05","150","","150","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C6 Li N4 -","- C6 Li N4 -","- C12 Li2 N8 -","2","0.5","","Jae-Hyuk Her; Peter W. Stephens; Royce A. Davidson; Kil Sik Min; Joshua D. Bagnato; Kipp van Schooten; Christoph Boehme; Joel S. Miller","Weak Ferromagnetic Ordering of the Li+[TCNE].- (TCNE = Tetracyanoethylene) Organic Magnet with an Interpenetrating Diamondoid Structure","Journal of the American Chemical Society","2013","135","","18060","18063","10.1021/ja410818e","powder diffraction","","0.690779","","","","","","","","","","","","","","","","","","has coordinates","179014","2020-10-21","18:00:00",""
"4121261","5.42943","0.00033","5.41232","0.00088","11.9671","0.0018","90","","106.692","0.0041","90","","336.84","0.08","200","","200","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C6 Li N4 -","- C6 Li N4 -","- C12 Li2 N8 -","2","0.5","","Jae-Hyuk Her; Peter W. Stephens; Royce A. Davidson; Kil Sik Min; Joshua D. Bagnato; Kipp van Schooten; Christoph Boehme; Joel S. Miller","Weak Ferromagnetic Ordering of the Li+[TCNE].- (TCNE = Tetracyanoethylene) Organic Magnet with an Interpenetrating Diamondoid Structure","Journal of the American Chemical Society","2013","135","","18060","18063","10.1021/ja410818e","powder diffraction","","0.690779","","","","","","","","","","","","","","","","","","has coordinates","179014","2020-10-21","18:00:00",""
"4121262","5.42769","0.00052","5.41077","0.00057","11.9807","0.001","90","","106.379","0.0075","90","","337.57","0.06","250","","250","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C6 Li N4 -","- C6 Li N4 -","- C12 Li2 N8 -","2","0.5","","Jae-Hyuk Her; Peter W. Stephens; Royce A. Davidson; Kil Sik Min; Joshua D. Bagnato; Kipp van Schooten; Christoph Boehme; Joel S. Miller","Weak Ferromagnetic Ordering of the Li+[TCNE].- (TCNE = Tetracyanoethylene) Organic Magnet with an Interpenetrating Diamondoid Structure","Journal of the American Chemical Society","2013","135","","18060","18063","10.1021/ja410818e","powder diffraction","","0.690779","","","","","","","","","","","","","","","","","","has coordinates","179014","2020-10-21","18:00:00",""
"4121263","5.42719","0.00039","5.41329","0.00045","12.002","0.0011","90","","106.067","0.0041","90","","338.83","0.05","295","","295","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C6 Li N4 -","- C6 Li N4 -","- C12 Li2 N8 -","2","0.5","","Jae-Hyuk Her; Peter W. Stephens; Royce A. Davidson; Kil Sik Min; Joshua D. Bagnato; Kipp van Schooten; Christoph Boehme; Joel S. Miller","Weak Ferromagnetic Ordering of the Li+[TCNE].- (TCNE = Tetracyanoethylene) Organic Magnet with an Interpenetrating Diamondoid Structure","Journal of the American Chemical Society","2013","135","","18060","18063","10.1021/ja410818e","powder diffraction","","0.690779","","","","","","","","","","","","","","","","","","has coordinates","179014","2020-10-21","18:00:00",""
"4121489","25.87","0.008","8.298","0.003","24.8","0.008","90","","107.769","0.006","90","","5070","3","200","2","200","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C54 H80 Cr N6 -","- C54 H80 Cr N6 -","- C216 H320 Cr4 N24 -","4","1","","Shen, Jingmei; Yap, Glenn P. A.; Theopold, Klaus H.","Chromium mediated reductive coupling of isonitrile forms unusual heterocycles.","Journal of the American Chemical Society","2014","136","9","3382","3384","10.1021/ja501291p","","","0.71073","MoKα","","0.1084","0.0682","","","0.1568","0.1837","","","","","","1.04","","","","has coordinates,has disorder","179016","2020-10-21","18:00:00",""
"4121582","16.473","0.005","6.98","0.005","18.804","0.005","90","","105.675","0.005","90","","2081.7","1.7","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C21 H16 Au F6 N6 P -","- C21 H16 Au F6 N6 P -","- C84 H64 Au4 F24 N24 P4 -","4","1","","Akerman, Kate J.; Fagenson, Alexander M.; Cyril, Vidusha; Taylor, Michael; Muller, Mark T.; Akerman, Matthew P.; Munro, Orde Q.","Gold(III) Macrocycles: Nucleotide-Specific Unconventional Catalytic Inhibitors of Human Topoisomerase I.","Journal of the American Chemical Society","2014","136","15","5670","","10.1021/ja412350f","","","0.71073","MoKα","","0.0452","0.032","","","0.0703","0.0733","","","","","","0.94","","","","has coordinates","179017","2020-10-21","18:00:00",""
"4122108","8.25345","0.00018","7.57776","0.00017","17.1862","0.0003","90","","94.4721","0.0018","90","","1071.6","0.04","110","2","110","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C8 H6 Cl2 Cu I N -","- C8 H6 Cl2 Cu I N -","- C32 H24 Cl8 Cu4 I4 N4 -","4","1","","Pitts, Cody Ross; Bloom, Steven; Woltornist, Ryan; Auvenshine, Dillon Jay; Ryzhkov, Lev R.; Siegler, Maxime A.; Lectka, Thomas","Direct, Catalytic Monofluorination of sp(3) C-H Bonds: A Radical-Based Mechanism with Ionic Selectivity.","Journal of the American Chemical Society","2014","136","27","9780","9791","10.1021/ja505136j","","","0.71073","MoKα","","0.0186","0.0167","","","0.0389","0.0398","","","","","","1.051","","","","has coordinates","179023","2020-10-21","18:00:00",""
"4123187","15.1861","0.0009","15.6922","0.0011","14.0997","0.0008","90","","113.341","0.007","90","","3085","0.4","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C58 H82 Al2 Cu4 N4 S4 -","- C58 H82 Al2 Cu4 N4 S4 -","- C116 H164 Al4 Cu8 N8 S8 -","2","0.5","","Li, Bin; Li, Jiancheng; Roesky, Herbert W.; Zhu, Hongping","Synthesis and characterization of coinage metal aluminum sulfur species.","Journal of the American Chemical Society","2015","137","1","162","164","10.1021/ja511722a","","","0.71073","MoKα","","0.0851","0.0524","","","0.0993","0.1098","","","","","","1.031","","","","has coordinates","179033","2020-10-21","18:00:00",""
"4123644","22.772","0.003","14.5752","0.0011","25.663","0.003","90","","103.502","0.013","90","","8282.3","1.6","100","","100","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C70 H97 Cl3 N6 O10 -","- C70.006 H97.007 Cl3 N6 O10 -","- C280.024 H388.028 Cl12 N24 O40 -","4","1","","Fisher, Brian F.; Guo, Li; Dolinar, Brian S.; Guzei, Ilia A.; Gellman, Samuel H.","Heterogeneous h-bonding in a foldamer helix.","Journal of the American Chemical Society","2015","137","20","6484","6487","10.1021/jacs.5b03382","","x-ray","1.54178","CuKα","","0.0732","0.0631","","","0.168","0.1764","","","","","","1.034","","","","has coordinates,has disorder","138220","2020-10-21","18:00:00",""
"4123951","6.362","","6.273","","12.165","","90","","93.15","","90","","484.757","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","Re Cl4","","- Cl4 Re -","- Cl4 Re -","- Cl16 Re4 -","4","1","","Cotton, F.A.; Mester, Z.C.; de Boer, B.G.","The chemistry of rhenium(IV) chloride. II. Structure of one of the polymorphs (beta) and evidence for a new polymorph (gamma)","Journal of the American Chemical Society","1973","95","","1159","1163","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124436","13.622","","12.807","","18.589","","90","","132.65","","90","","2385.23","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Ir6 (C O)16","","- C16 Ir6 O16 -","- C16 Ir6 O16 -","- C64 Ir24 O64 -","4","1","","Garlaschelli, L.; Martinengo, S.; Chiang, M.Y.; Bellon, P.L.; Demartin, F.; Manassero, M.; Bau, R.; Wei, C.Y.","Structures of two isomers of Ir6 (C O)16","Journal of the American Chemical Society","1984","106","","6664","6667","","","","","","","","","","","","","","","","","","","","","","has coordinates","154910","2020-10-21","18:00:00",""
"4124877","17.156","0.0006","26.5424","0.0009","21.8954","0.0007","90","","96.76","0.003","90","","9901","0.6","240","2","240","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Au28(SC6H11)20","","","- C120 H220 Au28 S20 -","- C120 H220 Au28 S20 -","- C240 H440 Au56 S40 -","2","0.5","","Chen, Yuxiang; Liu, Chong; Tang, Qing; Zeng, Chenjie; Higaki, Tatsuya; Das, Anindita; Jiang, De-En; Rosi, Nathaniel L.; Jin, Rongchao","Isomerism in Au28(SR)20 Nanocluster and Stable Structures.","Journal of the American Chemical Society","2016","138","5","1482","1485","10.1021/jacs.5b12094","","","1.54178","CuKα","","0.1986","0.1081","","","0.2596","0.3335","","","","","","1.007","","","","has coordinates","177406","2020-10-21","18:00:00",""
"4125203","18.758","0.003","5.7669","0.0008","13.563","0.002","90","","110.826","0.004","90","","1371.3","0.4","100","2","100","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C19 H20 O -","- C19 H20 O -","- C76 H80 O4 -","4","1","","Toriyama, Fumihiko; Cornella, Josep; Wimmer, Laurin; Chen, Tie-Gen; Dixon, Darryl D.; Creech, Gardner; Baran, Phil S.","Redox-Active Esters in Fe-Catalyzed C-C Coupling.","Journal of the American Chemical Society","2016","138","35","11132","11135","10.1021/jacs.6b07172","","x-ray","0.71073","MoKα","","0.0909","0.0819","","","0.2146","0.2226","","","","","","1.089","","","","has coordinates,has disorder","187894","2020-10-21","18:00:00",""
"4125445","17.216","0.006","9.185","0.003","17.525","0.006","90","","110.02","0.02","90","","2603.8","1.6","119","2","119","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C30 H44 B N -","- C30 H44 B N -","- C120 H176 B4 N4 -","4","1","","Braunschweig, Holger; Krummenacher, Ivo; Légaré, Marc-André; Matler, Alexander; Radacki, Krzysztof; Ye, Qing","Main-Group Metallomimetics: Transition Metal-like Photolytic CO Substitution at Boron.","Journal of the American Chemical Society","2017","139","5","1802","1805","10.1021/jacs.6b13047","","","0.71073","MoKα","","0.0691","0.0478","","","0.1124","0.1223","","","","","","1.024","","","","has coordinates,has disorder","193492","2020-10-21","18:00:00",""
"4125498","11.036","0.005","5.946","0.005","27.498","0.005","90","0.005","93.037","0.005","90","0.005","1801.9","1.8","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C19 H20 N2 O3 S -","- C19 H20 N2 O3 S -","- C76 H80 N8 O12 S4 -","4","1","","Karak, Suvendu; Kandambeth, Sharath; Biswal, Bishnu P.; Sasmal, Himadri Sekhar; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul","Constructing Ultraporous Covalent Organic Frameworks in Seconds via an Organic Terracotta Process.","Journal of the American Chemical Society","2017","139","5","1856","1862","10.1021/jacs.6b08815","","","0.71073","MoKα","","0.096","0.0769","","","0.1939","0.2017","","","","","","1.253","","","","has coordinates","193495","2020-10-21","18:00:00",""
"4125519","26.2971","0.001","7.0717","0.0002","22.6474","0.0008","90","","114.836","0.004","90","","3822.1","0.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C21 H21 B N2 O2 -","- C21 H21 B N2 O2 -","- C168 H168 B8 N16 O16 -","8","2","","Georgiou, Irene; Kervyn, Simon; Rossignon, Alexandre; De Leo, Federica; Wouters, Johan; Bruylants, Gilles; Bonifazi, Davide","Versatile Self-Adapting Boronic Acids for H-Bond Recognition: From Discrete to Polymeric Supramolecules.","Journal of the American Chemical Society","2017","139","7","2710","2727","10.1021/jacs.6b11362","","","1.54184","CuKα","","0.0663","0.056","","","0.1604","0.1776","","","","","","1.096","","","","has coordinates,has disorder","193516","2020-10-21","18:00:00",""
"4125527","8.9934","0.0005","15.8317","0.0007","7.2226","0.0004","90","","90.808","0.005","90","","1028.26","0.09","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C20 H16 B2 N4 O4 -","- C20 H16 B2 N4 O4 -","- C40 H32 B4 N8 O8 -","2","0.5","","Georgiou, Irene; Kervyn, Simon; Rossignon, Alexandre; De Leo, Federica; Wouters, Johan; Bruylants, Gilles; Bonifazi, Davide","Versatile Self-Adapting Boronic Acids for H-Bond Recognition: From Discrete to Polymeric Supramolecules.","Journal of the American Chemical Society","2017","139","7","2710","2727","10.1021/jacs.6b11362","","","1.54184","CuKα","","0.1288","0.108","","","0.2793","0.3144","","","","","","1.14","","","","has coordinates","193516","2020-10-21","18:00:00",""
"4126121","26.2225","0.0007","14.9508","0.0005","29.2628","0.0008","90","","99.579","0.002","90","","11312.4","0.6","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C60 H135 Ag Au20 S15 -","- C60 H135 Ag Au20 S15 -","- C240 H540 Ag4 Au80 S60 -","4","1","","Yang, Sha; Chai, Jinsong; Song, Yongbo; Fan, Jiqiang; Chen, Tao; Wang, Shuxin; Yu, Haizhu; Li, Xiaowu; Zhu, Manzhou","In Situ Two-Phase Ligand Exchange: A New Method for the Synthesis of Alloy Nanoclusters with Precise Atomic Structures.","Journal of the American Chemical Society","2017","139","16","5668","5671","10.1021/jacs.7b00668","","","1.54178","CuKα","","0.1157","0.0831","","","0.2223","0.2486","","","","","","1.041","","","","has coordinates","197262","2020-10-21","18:00:00",""
"4126122","26.1635","0.0017","15.0108","0.001","29.0512","0.0019","90","","99.1239","0.0009","90","","11265.1","1.3","296","2","296.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C60 H135 Ag5.2 Au15.81 S15 -","- C60 H135 Ag4.93 Au16.07 S15 -","- C240 H540 Ag19.72 Au64.28 S60 -","4","1","","Yang, Sha; Chai, Jinsong; Song, Yongbo; Fan, Jiqiang; Chen, Tao; Wang, Shuxin; Yu, Haizhu; Li, Xiaowu; Zhu, Manzhou","In Situ Two-Phase Ligand Exchange: A New Method for the Synthesis of Alloy Nanoclusters with Precise Atomic Structures.","Journal of the American Chemical Society","2017","139","16","5668","5671","10.1021/jacs.7b00668","","","0.71073","MoKα","","0.1415","0.0601","","","0.1267","0.156","","","","","","1.006","","","","has coordinates,has disorder","197263","2020-10-21","18:00:00",""
"4126591","21.6091","0.0005","12.366","0.0003","17.1126","0.0004","90","","99.589","0.002","90","","4508.91","0.19","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C96 H60 Cu2 F10 N4 -","- C96 H60 Cu2 F10 N4 -","- C192 H120 Cu4 F20 N8 -","2","0.5","","Ke, Xian-Sheng; Hong, Yongseok; Tu, Peiyu; He, Qing; Lynch, Vincent M.; Kim, Dongho; Sessler, Jonathan L.","Hetero Cu(III)-Pd(II) Complex of a Dibenzo[g,p]chrysene-Fused Bis-dicarbacorrole with Stable Organic Radical Character.","Journal of the American Chemical Society","2017","","","","","10.1021/jacs.7b09167","","","1.54184","CuKα","","0.1081","0.0824","","","0.2175","0.2454","","","","","","1.049","","","","has coordinates","201999","2020-10-21","18:00:00",""
"4126687","21.442","0.002","7.168","0.0006","19.93","0.003","90","","93.547","0.011","90","","3057.3","0.6","100","0.1","100","0.1","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","","","- C38 H46 -","- C38 H46 -","- C152 H184 -","4","1","","Zhang, Haoke; Zheng, Xiaoyan; Xie, Ni; He, Zikai; Liu, Junkai; Leung, Nelson L. C.; Niu, Yingli; Huang, Xuhui; Wong, Kam Sing; Kwok, Ryan T. K.; Sung, Herman H. Y.; Williams, Ian D.; Qin, Anjun; Lam, Jacky W. Y.; Tang, Ben Zhong","Why do simple molecules with ""isolated"" phenyl rings emit visible light?","Journal of the American Chemical Society","2017","","","","","10.1021/jacs.7b08592","","x-ray","0.71073","MoKα","","0.1292","0.0596","","","0.0959","0.1164","","","","","","1.001","","","","has coordinates","202570","2020-10-21","18:00:00",""
"4126775","18.234","0.0013","12.0654","0.0002","18.1135","0.0013","90","","90.69","0.006","90","","3984.7","0.4","85","2","85","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C49 H48 B N5 P Ru -","- C49 H48 B N5 P Ru -","- C196 H192 B4 N20 P4 Ru4 -","4","1","","Tseng, Kuei-Nin T; Kampf, Jeff W.; Szymczak, Nathaniel K.","Correction to ""Modular Attachment of Appended Boron Lewis Acids to a Ruthenium Pincer Catalyst: Metal-Ligand Cooperativity Enables Selective Alkyne Hydrogenation"".","Journal of the American Chemical Society","2017","","","","","10.1021/jacs.7b09662","","","1.54178","CuKα","","0.0376","0.0375","","","0.0979","0.098","","","","","","1.05","","","","has coordinates","203727","2020-10-21","18:00:00",""
"4126792","14.8368","0.0003","12.6939","0.0002","17.8201","0.0003","90","","94.864","0.0018","90","","3344.1","0.1","100.01","0.1","100.01","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C19 H22 B N O2 -","- C19 H22 B N O2 -","- C152 H176 B8 N8 O16 -","8","2","","Zhang, Fanjun; Song, Heng; Zhuang, Xuewen; Tung, Chen-Ho; Wang, Wenguang","Iron-Catalyzed 1,2-Selective Hydroboration of N-Heteroarenes.","Journal of the American Chemical Society","2017","","","","","10.1021/jacs.7b11416","","x-ray","1.54184","CuKα","","0.05","0.0446","","","0.1145","0.1192","","","","","","1.045","","","","has coordinates","252331","2020-10-21","18:00:00",""
"4127000","18.5359","0.0005","21.4911","0.0007","30.9657","0.0011","90","","105.024","0.003","90","","11913.7","0.7","100","0.1","100","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","syn-Di-μ-chlorodichloro{bis[5,8,11,14,17-penta(tert-butyl)hexa-peri- hexabenzocoronen-2-yl]phenylphosphine}dipalladium(II)","","- C262 H240 Cl10 P2 Pd2 -","- C262 H240 Cl10 P2 Pd2 -","- C524 H480 Cl20 P4 Pd4 -","2","0.5","","Smith, Jordan Neale; Hook, James M.; Lucas, Nigel T.","Superphenylphosphines: Nanographene-based Ligands That Control Coordination Geometry and Drive Supramolecular Assembly.","Journal of the American Chemical Society","2017","","","","","10.1021/jacs.7b12251","","","1.54184","CuKα","","0.1712","0.1185","","","0.314","0.3496","","","","","","1.045","","","","has coordinates,has disorder","204998","2020-10-21","18:00:00",""
"4127111","9.1759","0.0011","5.5211","0.0006","7.7323","0.0009","90","","98.691","0.002","90","","387.23","0.08","137","2","137","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Am Cr2 Cs O8 -","- Am Cr2 Cs O8 -","- Am2 Cr4 Cs2 O16 -","2","0.5","","Galley, Shane S.; Arico, Alexandra A.; Lee, Tsung-Han; Deng, Xiaoyu; Yao, Yong-Xin; Sperling, Joseph M.; Proust, Vanessa; Storbeck, Julia S.; Dobrosavljevic, Vladimir; Neu, Jennifer N.; Siegrist, Theo; Baumbach, Ryan E.; Albrecht-Schmitt, Thomas E; Kaltsoyannis, Nikolas; Lanatà, Nicola","Uncovering the Origin of Divergence in the CsM(CrO4)2 (M = La, Pr, Nd, Sm, Eu; Am) Family through Examination of the Chemical Bonding in a Molecular Cluster and by Band Structure Analysis.","Journal of the American Chemical Society","2018","","","","","10.1021/jacs.7b09474","","","0.71073","MoKα","","0.0198","0.0185","","","0.045","0.0459","","","","","","1.045","","","","has coordinates","205917","2020-10-21","18:00:00",""
"4127114","9.244","0.002","5.5676","0.0014","7.795","0.002","90","","98.785","0.006","90","","396.48","0.17","204","2","204","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Cr2 Cs Nd O8 -","- Cr2 Cs Nd O8 -","- Cr4 Cs2 Nd2 O16 -","2","0.5","","Galley, Shane S.; Arico, Alexandra A.; Lee, Tsung-Han; Deng, Xiaoyu; Yao, Yong-Xin; Sperling, Joseph M.; Proust, Vanessa; Storbeck, Julia S.; Dobrosavljevic, Vladimir; Neu, Jennifer N.; Siegrist, Theo; Baumbach, Ryan E.; Albrecht-Schmitt, Thomas E; Kaltsoyannis, Nikolas; Lanatà, Nicola","Uncovering the Origin of Divergence in the CsM(CrO4)2 (M = La, Pr, Nd, Sm, Eu; Am) Family through Examination of the Chemical Bonding in a Molecular Cluster and by Band Structure Analysis.","Journal of the American Chemical Society","2018","","","","","10.1021/jacs.7b09474","","","0.71073","MoKα","","0.0214","0.0203","","","0.0552","0.0567","","","","","","0.742","","","","has coordinates","205917","2020-10-21","18:00:00",""
"4127115","9.1977","0.0012","5.5221","0.0007","7.7074","0.001","90","","98.818","0.003","90","","386.84","0.09","298","2","298","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Cr2 Cs O8 Sm -","- Cr2 Cs O8 Sm -","- Cr4 Cs2 O16 Sm2 -","2","0.5","","Galley, Shane S.; Arico, Alexandra A.; Lee, Tsung-Han; Deng, Xiaoyu; Yao, Yong-Xin; Sperling, Joseph M.; Proust, Vanessa; Storbeck, Julia S.; Dobrosavljevic, Vladimir; Neu, Jennifer N.; Siegrist, Theo; Baumbach, Ryan E.; Albrecht-Schmitt, Thomas E; Kaltsoyannis, Nikolas; Lanatà, Nicola","Uncovering the Origin of Divergence in the CsM(CrO4)2 (M = La, Pr, Nd, Sm, Eu; Am) Family through Examination of the Chemical Bonding in a Molecular Cluster and by Band Structure Analysis.","Journal of the American Chemical Society","2018","","","","","10.1021/jacs.7b09474","","","0.71073","MoKα","","0.0163","0.0139","","","0.0342","0.0352","","","","","","1.084","","","","has coordinates","205917","2020-10-21","18:00:00",""
"4127116","9.1553","0.0006","5.4948","0.0004","7.6669","0.0005","90","","98.8121","0.0013","90","","381.14","0.04","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Cr2 Cs Eu O8 -","- Cr2 Cs Eu O8 -","- Cr4 Cs2 Eu2 O16 -","2","0.5","","Galley, Shane S.; Arico, Alexandra A.; Lee, Tsung-Han; Deng, Xiaoyu; Yao, Yong-Xin; Sperling, Joseph M.; Proust, Vanessa; Storbeck, Julia S.; Dobrosavljevic, Vladimir; Neu, Jennifer N.; Siegrist, Theo; Baumbach, Ryan E.; Albrecht-Schmitt, Thomas E; Kaltsoyannis, Nikolas; Lanatà, Nicola","Uncovering the Origin of Divergence in the CsM(CrO4)2 (M = La, Pr, Nd, Sm, Eu; Am) Family through Examination of the Chemical Bonding in a Molecular Cluster and by Band Structure Analysis.","Journal of the American Chemical Society","2018","","","","","10.1021/jacs.7b09474","","","0.71073","MoKα","","0.0122","0.0117","","","0.0272","0.0273","","","","","","1.177","","","","has coordinates","205917","2020-10-21","18:00:00",""
"4127278","16.556","0.003","5.9897","0.0011","17.839","0.002","90","","92.033","0.011","90","","1767.9","0.5","180","2","180","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C19 H26 N2 O2 -","- C19 H26 N2 O2 -","- C76 H104 N8 O8 -","4","1","","Flodén, Nils J; Trowbridge, Aaron; Willcox, Darren; Walton, Scarlett M.; Kim, Yongjoon; Gaunt, Matthew J.","Streamlined Synthesis of C(sp<sup>3</sup>)-Rich N-Heterospirocycles Enabled by Visible-Light-Mediated Photocatalysis.","Journal of the American Chemical Society","2019","141","21","8426","8430","10.1021/jacs.9b03372","","","1.54178","CuKα","","0.1315","0.075","","","0.1728","0.2021","","","","","","1.045","","","","has coordinates","223209","2020-10-21","18:00:00",""
"4127640","19.201","0.0017","8.8414","0.0005","37.707","0.003","90","","119.351","0.009","90","","5579.6","0.9","293","","293","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C32 H106 I25 N11 Pb7 -","- C31 H106 I25 N11 Pb7 -","- C62 H212 I50 N22 Pb14 -","2","0.5","","Hoffman, Justin M.; Che, Xiaoyang; Sidhik, Siraj; Li, Xiaotong; Hadar, Ido; Blancon, Jean-Christophe; Yamaguchi, Hisato; Kepenekian, Mikaël; Katan, Claudine; Even, Jacky; Stoumpos, Constantinos C.; Mohite, Aditya D.; Kanatzidis, Mercouri G.","From 2D to 1D Electronic Dimensionality in Halide Perovskites with Stepped and Flat Layers Using Propylammonium as a Spacer.","Journal of the American Chemical Society","2019","141","27","10661","10676","10.1021/jacs.9b02846","","x-ray","0.71073","MoKα","","0.4073","0.0361","","","0.0817","0.2329","","","","0.99","0.99","0.32","","","","has coordinates","220846","2020-10-21","18:00:00",""
"4127643","19.201","0.0017","8.8414","0.0005","37.707","0.003","90","","119.351","0.009","90","","5579.6","0.9","293","","293","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C32 H108 I25 N11 O Pb7 -","- C31 H106 I25 N11 O0.38 Pb7 -","- C62 H212 I50 N22 O0.76 Pb14 -","2","0.5","","Hoffman, Justin M.; Che, Xiaoyang; Sidhik, Siraj; Li, Xiaotong; Hadar, Ido; Blancon, Jean-Christophe; Yamaguchi, Hisato; Kepenekian, Mikaël; Katan, Claudine; Even, Jacky; Stoumpos, Constantinos C.; Mohite, Aditya D.; Kanatzidis, Mercouri G.","From 2D to 1D Electronic Dimensionality in Halide Perovskites with Stepped and Flat Layers Using Propylammonium as a Spacer.","Journal of the American Chemical Society","2019","141","27","10661","10676","10.1021/jacs.9b02846","","x-ray","0.71073","MoKα","","0.3456","0.0353","","","0.0783","0.2167","","","","0.96","0.96","0.3","","","","has coordinates","220849","2020-10-21","18:00:00",""
"4127644","24.1035","0.0005","8.798","0.0002","38.1538","0.0008","90","","94.4517","0.0012","90","","8066.6","0.3","293","","293","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H80 I18 N8 Pb5 -","- C24 H79 I18 N8 Pb5 -","- C96 H316 I72 N32 Pb20 -","4","1","","Hoffman, Justin M.; Che, Xiaoyang; Sidhik, Siraj; Li, Xiaotong; Hadar, Ido; Blancon, Jean-Christophe; Yamaguchi, Hisato; Kepenekian, Mikaël; Katan, Claudine; Even, Jacky; Stoumpos, Constantinos C.; Mohite, Aditya D.; Kanatzidis, Mercouri G.","From 2D to 1D Electronic Dimensionality in Halide Perovskites with Stepped and Flat Layers Using Propylammonium as a Spacer.","Journal of the American Chemical Society","2019","141","27","10661","10676","10.1021/jacs.9b02846","","x-ray","0.71073","MoKα","","0.054","0.0415","","","0.1092","0.1145","","","","3.1","3.1","2.92","","","","has coordinates","220850","2020-10-21","18:00:00",""
"4127645","24.1035","0.0005","8.798","0.0002","38.1538","0.0008","90","","94.4517","0.0012","90","","8066.6","0.3","293","","293","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C24 H82 I18 N8 O Pb5 -","- C24 H79 I18 N8 O0.5 Pb5 -","- C96 H316 I72 N32 O2 Pb20 -","4","1","","Hoffman, Justin M.; Che, Xiaoyang; Sidhik, Siraj; Li, Xiaotong; Hadar, Ido; Blancon, Jean-Christophe; Yamaguchi, Hisato; Kepenekian, Mikaël; Katan, Claudine; Even, Jacky; Stoumpos, Constantinos C.; Mohite, Aditya D.; Kanatzidis, Mercouri G.","From 2D to 1D Electronic Dimensionality in Halide Perovskites with Stepped and Flat Layers Using Propylammonium as a Spacer.","Journal of the American Chemical Society","2019","141","27","10661","10676","10.1021/jacs.9b02846","","x-ray","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","220851","2020-10-21","18:00:00",""
"4128242","22.2715","0.0004","7.77098","0.0001","21.1732","0.0003","90","","108.487","","90","","3475.37","0.09","93","","93","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C39 H16 B Cl F20 -","- C39 H16 B Cl F20 -","- C156 H64 B4 Cl4 F80 -","4","1","","Nakajima, Misuzu; Miyamoto, Kazunori; Hirano, Keiichi; Uchiyama, Masanobu","Diaryl-λ<sup>3</sup>-chloranes: Versatile Synthesis and Unique Reactivity as Aryl Cation Equivalent.","Journal of the American Chemical Society","2019","141","16","6499","6503","10.1021/jacs.9b02436","","","1.54187","CuKα","","","0.034","","","","0.0717","","","","","","1.161","","","","has coordinates","221367","2020-10-21","18:00:00",""
"4128658","31.4603","0.0019","15.0357","0.0009","20.4599","0.001","90","","104.239","0.004","90","","9380.8","0.9","100","2","100.01","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C87 H74 F24 N10 O P4 -","- C87 H74 F24 N10 O P4 -","- C348 H296 F96 N40 O4 P16 -","4","1","","Roy, Indranil; Bobbala, Sharan; Young, Ryan M.; Beldjoudi, Yassine; Nguyen, Minh T.; Cetin, M. Mustafa; Cooper, James A.; Allen, Sean; Anamimoghadam, Ommid; Scott, Evan A.; Wasielewski, Michael R.; Stoddart, J. Fraser","A Supramolecular Approach for Modulated Photoprotection, Lysosomal Delivery, and Photodynamic Activity of a Photosensitizer.","Journal of the American Chemical Society","2019","141","31","12296","12304","10.1021/jacs.9b03990","","","1.54178","CuKα","","0.1122","0.0925","","","0.2636","0.2865","","","","","","1.038","","","","has coordinates,has disorder","221739","2020-10-21","18:00:00",""
"4129221","19.1932","0.001","10.1436","0.0005","19.6711","0.001","90","","93.812","0.001","90","","3821.3","0.3","150","1","150","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C40 H40 B2 Fe N12 -","- C40 H40 B2 Fe N12 -","- C160 H160 B8 Fe4 N48 -","4","1","","Reger, Daniel L.; Gardinier, James R.; Gemmill, William R.; Smith, Mark D.; Shahin, Ahmed M.; Long, Gary J.; Rebbouh, Leila; Grandjean, Fernande","Formation of third generation poly(pyrazolyl)borate ligands from alkyne coupling reactions of Fe[(p-IC6H4)B(3-Rpz)3]2 (R = H, Me; pz = pyrazolyl): pathways toward controlling an iron(II) electronic spin-state crossover.","Journal of the American Chemical Society","2005","127","7","2303","2316","10.1021/ja044900h","","","0.71073","MoKα","","0.0471","0.0396","","","0.1036","0.1093","","","","","","1.025","","","","has coordinates","240003","2020-10-21","18:00:00",""
"4129223","19.2722","0.001","10.1801","0.0005","20.1124","0.001","90","","92.995","0.001","90","","3940.5","0.3","294","1","294","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C40 H40 B2 Fe N12 -","- C40 H40 B2 Fe N12 -","- C160 H160 B8 Fe4 N48 -","4","1","","Reger, Daniel L.; Gardinier, James R.; Gemmill, William R.; Smith, Mark D.; Shahin, Ahmed M.; Long, Gary J.; Rebbouh, Leila; Grandjean, Fernande","Formation of third generation poly(pyrazolyl)borate ligands from alkyne coupling reactions of Fe[(p-IC6H4)B(3-Rpz)3]2 (R = H, Me; pz = pyrazolyl): pathways toward controlling an iron(II) electronic spin-state crossover.","Journal of the American Chemical Society","2005","127","7","2303","2316","10.1021/ja044900h","","","0.71073","MoKα","","0.0619","0.0446","","","0.1156","0.127","","","","","","1.028","","","","has coordinates","240005","2020-10-21","18:00:00",""
"4129224","18.7923","0.001","10.1073","0.0005","19.8578","0.001","90","","94.987","0.001","90","","3757.5","0.3","90","1","90","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C40 H40 B2 Fe N12 -","- C40 H40 B2 Fe N12 -","- C160 H160 B8 Fe4 N48 -","4","1","","Reger, Daniel L.; Gardinier, James R.; Gemmill, William R.; Smith, Mark D.; Shahin, Ahmed M.; Long, Gary J.; Rebbouh, Leila; Grandjean, Fernande","Formation of third generation poly(pyrazolyl)borate ligands from alkyne coupling reactions of Fe[(p-IC6H4)B(3-Rpz)3]2 (R = H, Me; pz = pyrazolyl): pathways toward controlling an iron(II) electronic spin-state crossover.","Journal of the American Chemical Society","2005","127","7","2303","2316","10.1021/ja044900h","","","0.71073","MoKα","","0.0448","0.0382","","","0.0963","0.1008","","","","","","1.03","","","","has coordinates","240006","2020-10-21","18:00:00",""
"4129607","16.7165","0.0016","9.0824","0.0008","29.495","0.003","90","","101.756","0.007","90","","4384.2","0.7","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C47 H46.5 N5.5 O6 -","- C47 H46.5 N5.5 O6 -","- C188 H186 N22 O24 -","4","1","","Tresca, Blakely W.; Hansen, Ryan J.; Chau, Calvin V.; Hay, Benjamin P.; Zakharov, Lev N.; Haley, Michael M.; Johnson, Darren W.","Substituent Effects in CH Hydrogen Bond Interactions: Linear Free Energy Relationships and Influence of Anions.","Journal of the American Chemical Society","2015","137","47","14959","14967","10.1021/jacs.5b08767","","","1.54178","CuKα","","0.127","0.1023","","","0.284","0.3018","","","","","","1.083","","","","has coordinates","240299","2020-10-21","18:00:00",""
"4129814","16.9362","0.0005","11.0662","0.0003","31.4144","0.0009","90","","97.226","0.001","90","","5840.9","0.3","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C4.55 H7.09 Cl0.36 F1.27 N0 P0.18 Sb0.18 -","- C4.54545 H7.09091 Cl0.363636 F1.27273 P0.181818 Sb0.181818 -","- C200 H312 Cl16 F56 P8 Sb8 -","44","11","","Kawai, Hiroyuki; Wolf, William J.; DiPasquale, Antonio G.; Winston, Matthew S.; Toste, F. Dean","Phosphonium Formation by Facile Carbon-Phosphorus Reductive Elimination from Gold(III).","Journal of the American Chemical Society","2016","138","2","587","593","10.1021/jacs.5b10720","","","0.71073","MoKα","","0.0628","0.0463","","","0.0988","0.1064","","","","","","1.061","","","","has coordinates","240467","2020-10-21","18:00:00",""
"4130197","24.5357","0.001","8.7047","0.0004","26.4314","0.001","90","","122.616","0.002","90","","4754.9","0.4","100","","99.99","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C50 H12 F20 N4 O10 Pd2 -","- C50 H12 F20 N4 O10 Pd2 -","- C200 H48 F80 N16 O40 Pd8 -","4","1","","White, Paul B.; Jaworski, Jonathan N.; Fry, Charles G.; Dolinar, Brian S.; Guzei, Ilia A.; Stahl, Shannon S.","Structurally Diverse Diazafluorene-Ligated Palladium(II) Complexes and Their Implications for Aerobic Oxidation Reactions.","Journal of the American Chemical Society","2016","138","14","4869","4880","10.1021/jacs.6b01188","","x-ray","0.71073","MoKα","","0.0521","0.0344","","","0.0665","0.0727","","","","","","1.022","","","","has coordinates","240726","2020-10-21","18:00:00",""
"4130208","12.019","0.002","9.9038","0.0018","38.907","0.007","90","","93.446","0.003","90","","4622.9","1.4","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C33 H46 B10 Ir O3 P S2 -","- C33 H46 B10 Ir O3 P S2 -","- C132 H184 B40 Ir4 O12 P4 S8 -","4","1","","Zhang, Xiaolei; Dai, Huimin; Yan, Hong; Zou, Wenli; Cremer, Dieter","B-H···π Interaction: A New Type of Nonclassical Hydrogen Bonding.","Journal of the American Chemical Society","2016","138","13","4334","4337","10.1021/jacs.6b01249","","","0.71073","MoKα","","0.034","0.0299","","","0.0763","0.0778","","","","","","1.179","","","","has coordinates","240732","2020-10-21","18:00:00",""
"4130384","10.0188","0.0001","13.4363","0.0001","15.5834","0.0002","90","","90.1191","0.0007","90","","2097.76","0.04","253","0.1","253","0.1","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C28 H36 F8 I4 N4 O6 S2 -","- C28 H36 F8 I4 N4 O6 S2 -","- C56 H72 F16 I8 N8 O12 S4 -","2","0.5","","Topić, Filip; Rissanen, Kari","Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds.","Journal of the American Chemical Society","2016","138","20","6610","6616","10.1021/jacs.6b02854","","","0.71073","MoKα","","0.0445","0.0367","","","0.0822","0.0859","","","","","","1.031","","","","has coordinates,has disorder","240833","2020-10-21","18:00:00",""
"4130385","9.9852","0.0001","13.3367","0.0001","15.2415","0.0002","90","","90.7746","0.0006","90","","2029.52","0.04","123","0.1","123","0.1","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C28 H36 F8 I4 N4 O6 S2 -","- C28 H36 F8 I4 N4 O6 S2 -","- C56 H72 F16 I8 N8 O12 S4 -","2","0.5","","Topić, Filip; Rissanen, Kari","Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds.","Journal of the American Chemical Society","2016","138","20","6610","6616","10.1021/jacs.6b02854","","","0.71073","MoKα","","0.0307","0.0282","","","0.0603","0.0613","","","","","","1.122","","","","has coordinates,has disorder","240833","2020-10-21","18:00:00",""
"4130392","9.7851","0.0001","13.5446","0.0002","16.3773","0.0002","90","","96.9011","0.0009","90","","2154.84","0.05","253","0.1","253","0.1","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C32 H36 F8 I4 N4 O6 S2 -","- C32 H36 F8 I4 N4 O6 S2 -","- C64 H72 F16 I8 N8 O12 S4 -","2","0.5","","Topić, Filip; Rissanen, Kari","Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds.","Journal of the American Chemical Society","2016","138","20","6610","6616","10.1021/jacs.6b02854","","","0.71073","MoKα","","0.0461","0.0331","","","0.0656","0.0702","","","","","","1.041","","","","has coordinates","240833","2020-10-21","18:00:00",""
"4130481","18.234","0.0013","12.0654","0.0002","18.1135","0.0013","90","","90.69","0.006","90","","3984.7","0.4","85","2","85","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C49 H46 B N5 P Ru -","- C49 H46 B N5 P Ru -","- C196 H184 B4 N20 P4 Ru4 -","4","1","","Tseng, Kuei-Nin T; Kampf, Jeff W.; Szymczak, Nathaniel K.","Modular Attachment of Appended Boron Lewis Acids to a Ruthenium Pincer Catalyst: Metal-Ligand Cooperativity Enables Selective Alkyne Hydrogenation.","Journal of the American Chemical Society","2016","138","33","10378","10381","10.1021/jacs.6b03972","","","1.54178","CuKα","","0.0388","0.0387","","","0.1035","0.1036","","","","","","1.059","","","","has coordinates","240903","2020-10-21","18:00:00",""
"4131276","23.6164","0.0003","22.668","0.0003","36.3526","0.0004","90","","104.873","0.0012","90","","18808.9","0.4","123","2","123","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C39 H29 Al Cl3 N3 P2 Pd -","- C39 H29 Al Cl3 N3 P2 Pd -","- C624 H464 Al16 Cl48 N48 P32 Pd16 -","16","4","","Takaya, Jun; Iwasawa, Nobuharu","Synthesis, Structure, and Catalysis of Palladium Complexes Bearing a Group 13 Metalloligand: Remarkable Effect of an Aluminum-Metalloligand in Hydrosilylation of CO<sub>2</sub>.","Journal of the American Chemical Society","2017","139","17","6074","6077","10.1021/jacs.7b02553","","","0.71073","MoKα","","0.0715","0.0454","","","0.1071","0.1174","","","","","","1.039","","","","has coordinates","241512","2020-10-21","18:00:00",""
"4131802","15.4517","0.0007","9.0569","0.0004","20.8129","0.0009","90","","105.163","0.003","90","","2811.2","0.2","100","","100","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C54 H74 Br6.12 N2 -","- C54 H74 Br6.1204 N2 -","- C108 H148 Br12.2408 N4 -","2","0.5","","Hansmann, Max M.; Melaimi, Mohand; Munz, Dominik; Bertrand, Guy","Modular Approach to Kekulé Diradicaloids Derived from Cyclic (Alkyl)(amino)carbenes.","Journal of the American Chemical Society","2018","140","7","2546","2554","10.1021/jacs.7b11183","","x-ray","0.71073","MoKα","","0.0541","0.0328","","","0.0704","0.0778","","","","","","1.02","","","","has coordinates,has disorder","241950","2020-10-21","18:00:00",""
"4132774","16.3099","0.0005","15.3787","0.0004","14.4277","0.0004","90","","93.304","0.003","90","","3612.81","0.18","110","2","110","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C32 H34 Mo2 N6 O10 -","- C32 H34 Mo2 N6 O10 -","- C128 H136 Mo8 N24 O40 -","4","1","","Claire, F. James; Tenney, Stephanie M.; Li, Minyuan M.; Siegler, Maxime A.; Wagner, Justine S.; Hall, Anthony Shoji; Kempa, Thomas J.","Hierarchically Ordered Two-Dimensional Coordination Polymers Assembled from Redox-Active Dimolybdenum Clusters.","Journal of the American Chemical Society","2018","140","34","10673","10676","10.1021/jacs.8b06331","","","0.71073","MoKα","","0.0652","0.0403","","","0.0854","0.0961","","","","","","1.033","","","","has coordinates,has disorder","242676","2020-10-21","18:00:00",""
"4132853","12.9127","0.0005","15.209","0.0006","27.6092","0.0009","90","","90.251","0.003","90","","5422.1","0.3","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C54 H59 Cl2 Fe2 O2 P3 S3 -","- C54 H59 Cl2 Fe2 O2 P3 S3 -","- C216 H236 Cl8 Fe8 O8 P12 S12 -","4","1","","Yu, Xin; Pang, Maofu; Zhang, Shengnan; Hu, Xinlong; Tung, Chen-Ho; Wang, Wenguang","Terminal Thiolate-Dominated H/D Exchanges and H<sub>2</sub> Release: Diiron Thiol-Hydride.","Journal of the American Chemical Society","2018","140","36","11454","11463","10.1021/jacs.8b06996","","","0.71073","MoKα","","0.0784","0.0526","","","0.1155","0.1253","","","","","","1.012","","","","has coordinates","242745","2020-10-21","18:00:00",""
"4133169","11.379","0.002","11.659","0.002","18.521","0.004","90","","102.867","0.004","90","","2395.4","0.8","100","","100","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C16 H40 Cl2 Cr I N4 O -","- C16 H40 Cl2 Cr I N4 O -","- C64 H160 Cl8 Cr4 I4 N16 O4 -","4","1","","Werner, Daniel; Anwander, Reiner","Unveiling the Takai Olefination Reagent via Tris( tert-butoxy)siloxy Variants.","Journal of the American Chemical Society","2018","140","43","14334","14341","10.1021/jacs.8b08739","","","0.71073","MoKα","","0.1768","0.1002","","","0.1315","0.1499","","","","","","1.131","","","","has coordinates","243005","2020-10-21","18:00:00",""
"4133456","18.251","0.002","12.4803","0.0013","25.254","0.003","90","","94.868","0.01","90","","5731.6","1.1","154.7","","154.7","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C60 H83 N3 O10.5 -","- C60 H83 N3 O10.5 -","- C240 H332 N12 O42 -","4","1","","Li, Errui; Jie, Kecheng; Zhou, Yujuan; Zhao, Run; Huang, Feihe","Post-Synthetic Modification of Nonporous Adaptive Crystals of Pillar[4]arene[1]quinone by Capturing Vaporized Amines.","Journal of the American Chemical Society","2018","140","44","15070","15079","10.1021/jacs.8b10192","","","0.71073","MoKα","","0.2155","0.1157","","","0.2672","0.3411","","","","","","1.035","","","","has coordinates,has disorder","243230","2020-10-21","18:00:00",""
"4133503","18.686","0.005","15.184","0.004","25.496","0.006","90","","91.39","0.006","90","","7232","3","150","2","150","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C113 H45 Cl3 I0 N4 Ni S0 U -","- C113 H45 Cl3 N4 Ni U -","- C452 H180 Cl12 N16 Ni4 U4 -","4","1","","Cai, Wenting; Abella, Laura; Zhuang, Jiaxin; Zhang, Xingxing; Feng, Lai; Wang, Yaofeng; Morales-Martínez, Roser; Esper, Ronda; Boero, Mauro; Metta-Magaña, Alejandro; Rodríguez-Fortea, Antonio; Poblet, Josep M.; Echegoyen, Luis; Chen, Ning","Synthesis and Characterization of Non-Isolated-Pentagon-Rule Actinide Endohedral Metallofullerenes U@ C<sub>1</sub>(17418)-C<sub>76</sub>, U@ C<sub>1</sub>(28324)-C<sub>80</sub>, and Th@ C<sub>1</sub>(28324)-C<sub>80</sub>: Low-Symmetry Cage Selection Directed by a Tetravalent Ion.","Journal of the American Chemical Society","2018","140","51","18039","18050","10.1021/jacs.8b10435","","","0.71073","MoKα","","0.1754","0.1236","","","0.3435","0.375","","","","","","1.263","","","","has coordinates,has disorder","243273","2020-10-21","18:00:00",""
"4133576","25.6211","0.0003","13.0431","0.0002","47.8048","0.0007","90","","102.544","0.0013","90","","15594","0.4","120","1","120","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C39.25 H66 Fe N P2 -","- C38 H63 Fe N P2 -","- C608 H1008 Fe16 N16 P32 -","16","4","","Ott, Jonas C.; Wadepohl, Hubert; Enders, Markus; Gade, Lutz H.","Taking Solution Proton NMR to Its Extreme: Prediction and Detection of a Hydride Resonance in an Intermediate-Spin Iron Complex.","Journal of the American Chemical Society","2018","140","50","17413","17417","10.1021/jacs.8b11330","","x-ray","1.54184","CuKα","","0.0734","0.0522","","","0.1121","0.1203","","","","","","1.019","","","","has coordinates","243331","2020-10-21","18:00:00",""
"4133723","13.7763","0.0006","15.0391","0.0004","16.5372","0.0007","90","","109.983","0.005","90","","3219.9","0.2","110","2","110","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C14 H46 Si10 -","- C14 H46 Si10 -","- C56 H184 Si40 -","4","1","","Marro, Eric A.; Folster, Carlton P.; Press, Eric M.; Im, Hoyeon; Ferguson, John T.; Siegler, Maxime A.; Klausen, Rebekka S.","Stereocontrolled Syntheses of Functionalized <i>cis</i>- and <i>trans</i>-Siladecalins.","Journal of the American Chemical Society","2019","141","44","17926","17936","10.1021/jacs.9b09902","","","0.71073","MoKα","","0.0564","0.0364","","","0.087","0.0972","","","","","","1.044","","","","has coordinates,has disorder","243432","2020-10-21","18:00:00",""
"4133896","19.216","0.0005","14.5222","0.0003","38.5485","0.0009","90","","102.952","0.002","90","","10483.6","0.4","123","2","123","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C120 H261 Ag2 Cl8 N7 O68 Si2 W18 -","- C120 H261 Ag2 Cl8 N7 O68 Si2 W18 -","- C240 H522 Ag4 Cl16 N14 O136 Si4 W36 -","2","0.5","","Yonesato, Kentaro; Ito, Hiroyasu; Itakura, Hiroyuki; Yokogawa, Daisuke; Kikuchi, Takashi; Mizuno, Noritaka; Yamaguchi, Kazuya; Suzuki, Kosuke","Controlled Assembly Synthesis of Atomically Precise Ultrastable Silver Nanoclusters with Polyoxometalates.","Journal of the American Chemical Society","2019","141","50","19550","19554","10.1021/jacs.9b10569","","","0.71073","MoKα","","0.1305","0.0894","","","0.2045","0.2241","","","","","","1.065","","","","has coordinates,has disorder","246493","2020-10-21","18:00:00",""
"4134018","21.9597","0.0005","22.7867","0.0005","21.3984","0.0005","90","","92.534","0.002","90","","10697.1","0.4","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","(tBudmx)Cu2(NC6H4OMe)","","- C59.75 H70.62 Cu2 N5.88 O2.5 -","- C59.75 H70.625 Cu2 N5.875 O2.5 -","- C478 H565 Cu16 N47 O20 -","8","2","","Carsch, Kurtis M.; Lukens, James T.; DiMucci, Ida M.; Iovan, Diana A.; Zheng, Shao-Liang; Lancaster, Kyle M.; Betley, Theodore A.","Electronic Structures and Reactivity Profiles of Aryl Nitrenoid-Bridged Dicopper Complexes.","Journal of the American Chemical Society","2020","","","","","10.1021/jacs.9b09616","","","0.71073","MoKα","","0.1462","0.0988","","","0.2228","0.256","","","","","","1.147","","","","has coordinates,has disorder","247152","2020-10-21","18:00:00",""
"4134549","27.7413","0.0005","10.6411","0.0002","20.9606","0.0004","90","","108.051","0.001","90","","5882.98","0.19","133","2","133","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C57 H55 N6 Na0.5 Ni2 O1.5 -","- C57 H55 N6 Na0.5 Ni2 O1.5 -","- C228 H220 N24 Na2 Ni8 O6 -","4","1","","Stevens, Hendrik; Duan, Peng-Cheng; Dechert, Sebastian; Meyer, Franc","Competing H2 versus Intramolecular C-H Activation at a Dinuclear Nickel Complex via Metal-Metal Cooperative Oxidative Addition.","Journal of the American Chemical Society","2020","","","","","10.1021/jacs.0c00758","","","0.71073","MoKα","","0.0462","0.0336","","","0.0827","0.0881","","","","","","1.031","","","","has coordinates,has disorder","249739","2020-10-21","18:00:00",""
"4134634","17.8979","0.0006","14.7783","0.0005","16.9268","0.0005","90","","110.964","0.001","90","","4180.8","0.2","170","2","170","","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C78 H68 Cl2 F4 N8 O2 Pt2 S2 -","- C78 H68 Cl2 F4 N8 O2 Pt2 S2 -","- C156 H136 Cl4 F8 N16 O4 Pt4 S4 -","2","0.5","","Wu, Xiugang; Chen, Deng-Gao; Liu, Denghui; Liu, Shih-Hung; Shen, Shin-Wei; Wu, Chih-I; Xie, Guohua; Zhou, Jianwei; Huang, Zhi-Xuan; Huang, Chun-Ying; Su, Shi-Jian; Zhu, Weiguo; Chou, Pi-Tai","Highly Emissive Dinuclear Platinum(III) Complexes.","Journal of the American Chemical Society","2020","","","","","10.1021/jacs.9b13956","","","1.34139","GaKα","","0.0427","0.0411","","","0.1073","0.1084","","","","","","1.107","","","","has coordinates","250458","2020-10-21","18:00:00",""
"4134821","25.785","0.003","13.9805","0.0017","20.86","0.003","90","","106.277","0.003","90","","7218.4","1.6","99.97","","99.97","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C53.5 H110 O15 Si10 U -","- C53.5 H108 O15 Si10 U -","- C214 H432 O60 Si40 U4 -","4","1","","Assefa, Mikiyas K.; Wu, Guang; Hayton, Trevor W.","Uranyl oxo silylation promoted by silsesquioxane coordination.","Journal of the American Chemical Society","2020","","","","","10.1021/jacs.0c00990","","","0.71073","MoKα","","0.1386","0.0785","","","0.1681","0.1943","","","","","","1.02","","","","has coordinates,has disorder","251275","2020-10-21","18:00:00",""
"4134895","29.1661","0.0014","16.1141","0.0007","13.9552","0.0006","90","","98.847","0.001","90","","6480.7","0.5","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C64 H58 Fe4 N4 O20 -","- C64 H58 Fe4 N4 O20 -","- C256 H232 Fe16 N16 O80 -","4","1","","Amombo Noa, Francoise M.; Svensson Grape, Erik; Brülls, Steffen M; Cheung, Ocean; Malmberg, Per; Inge, A. Ken; McKenzie, Christine J.; Mårtensson, Jerker; Ohrstrom, Lars","Metal-Organic Frameworks with Hexakis(4-carboxyphenyl)benzene - Extensions to Reticular Chemistry and Introducing Foldable Nets.","Journal of the American Chemical Society","2020","","","","","10.1021/jacs.0c02984","","","0.71073","MoKα","","0.0626","0.0416","","","0.0966","0.1051","","","","","","1.075","","","","has coordinates","251766","2020-10-21","18:00:00",""
"4134896","29.075","0.006","16.016","0.004","13.826","0.003","90","","98.39","0.005","90","","6369","2","297","2","297","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C64 H58 Co4 N4 O20 -","- C64 H58 Co4 N4 O20 -","- C256 H232 Co16 N16 O80 -","4","1","","Amombo Noa, Francoise M.; Svensson Grape, Erik; Brülls, Steffen M; Cheung, Ocean; Malmberg, Per; Inge, A. Ken; McKenzie, Christine J.; Mårtensson, Jerker; Ohrstrom, Lars","Metal-Organic Frameworks with Hexakis(4-carboxyphenyl)benzene - Extensions to Reticular Chemistry and Introducing Foldable Nets.","Journal of the American Chemical Society","2020","","","","","10.1021/jacs.0c02984","","","0.71073","MoKα","","0.2717","0.1667","","","0.3598","0.4025","","","","","","1.107","","","","has coordinates","251767","2020-10-21","18:00:00",""
"4135211","18.7932","0.0011","12.7208","0.0006","24.3108","0.0013","90","","100.886","0.002","90","","5707.3","0.5","170","2","170.01","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C57 H80 N6 O10 -","- C57 H80 N6 O10 -","- C228 H320 N24 O40 -","4","1","","Li, Errui; Jie, Kecheng; Fang, Yu; Cai, Peiyu; Huang, Feihe","Transformation of Nonporous Adaptive Pillar[4]arene[1]quinone Crystals into Fluorescent Crystals via Multi-Step Solid-Vapor Postsynthetic Modification for Fluorescence Turn-on Sensing of Ethylenediamine.","Journal of the American Chemical Society","2020","","","","","10.1021/jacs.0c07482","","","0.71073","MoKα","","0.1764","0.0974","","","0.2821","0.3422","","","","","","1.03","","","","has coordinates,has disorder","255695","2020-10-21","18:00:00",""
"4135328","36.655","0.007","9.368","0.0019","32.952","0.007","90","","108.36","0.03","90","","10739","4","253","2","253","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C44 H43 F18 N Rh Sb3 -","- C44 H43 F18 N Rh Sb3 -","- C352 H344 F144 N8 Rh8 Sb24 -","8","2","","Kim, Jinwoo; Kim, Dongwook; Chang, Sukbok","Merging Two Functions in a Single Rh Catalyst System: Bimodular Conjugate for Light-Induced Oxidative Coupling","Journal of the American Chemical Society","2020","","","","","10.1021/jacs.0c09982","","","0.85","synchrotron","","0.2163","0.1155","","","0.3295","0.3865","","","","","","1.071","","","","has coordinates,has disorder","258656","2020-10-30","23:49:50",""
"4300411","16.6771","0.0012","10.9629","0.0008","19.3193","0.0014","90","","113.425","0.001","90","","3241","0.4","150","2","150","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C32 H52 F24 N10 O8 P4 Ru2 S8 -","- C32 H52 F24 N10 O8 P4 Ru2 S8 -","- C64 H104 F48 N20 O16 P8 Ru4 S16 -","2","0.5","","","","Inorganic Chemistry","2006","","","","","10.1021/ic051151b","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","179042","2020-10-21","18:00:00",""
"4300757","10.7337","0.0003","12.8604","0.0003","7.8919","0.0002","90","","104.91","0.02","90","","1052.71","0.04","","","","","","","","","","","","6","P 1 2/c 1","","","","","","- C8 H28 N2 O16 P4 Zr -","- C8 N2 O16 P4 Zr -","- C16 N4 O32 P8 Zr2 -","2","0.5","","","New architectures for zirconium polyphosphonates with a tailor-made open framework structure;","Inorganic Chemistry","2006","","","","","10.1021/ic052146a","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4300911","31.505","0.006","9.822","0.002","16.731","0.003","90","","90.69","0.03","90","","5176.9","1.7","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C22 H56 Ga N2 P2 Si4 -","- C22 H56 Ga N2 P2 Si4 -","- C132 H336 Ga6 N12 P12 Si24 -","6","1.5","","Karen L. Antcliff; Robert J. Baker; Cameron Jones; Damien M. Murphy; Richard P. Rose","Reactions of a Gallium(II)-Diazabutadiene Dimer, [{{[(H)C(But)N]2}GaI}2], with [ME(SiMe3)2] (M = Li or Na; E = N, P, or As): Structural, EPR, and ENDOR Characterization of Paramagnetic Gallium(III) Pnictide Complexes","Inorganic Chemistry","2005","44","","2098","2105","10.1021/ic0486825","","","0.71073","MoKα","","0.102","0.0551","","","0.1203","0.1391","","","","","","1.05","","","","has coordinates,has disorder","179047","2020-10-21","18:00:00",""
"4301258","20.1286","0.001","12.278","0.0006","18.2227","0.0009","90","","90.304","0.001","90","","4503.5","0.4","110","2","110","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C52 H48 B F4 Ir N2 P2 -","- C52 H48 B F4 Ir N2 P2 -","- C208 H192 B4 F16 Ir4 N8 P8 -","4","1","","Kevin D. Atkinson; Michael J. Cowley; Simon B. Duckett; Paul I. P. Elliott; Gary G. R. Green; Joaquín López-Serrano; Iman G. Khazal; Adrian C. Whitwood","Para-Hydrogen Induced Polarization without Incorporation of Para-Hydrogen into the Analyte","Inorganic Chemistry","2009","48","","663","670","10.1021/ic8020029","","","0.71073","MoKα","","0.0331","0.0248","","","0.0581","0.0612","","","","","","1.007","","","","has coordinates,has disorder","179050","2020-10-21","18:00:00",""
"4301719","17.929","0.004","6.0177","0.0012","17.734","0.004","90","","112.53","0.03","90","","1767.3","0.8","153","2","153","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C28 H36 F12 Hg N4 P2 S2 -","- C28 H36 F12 Hg N4 P2 S2 -","- C56 H72 F24 Hg2 N8 P4 S4 -","2","0.5","","Xiao-Yan Tang; Rong-Xin Yuan; Zhi-Gang Ren; Hong-Xi Li; Yong Zhang; Jian-Ping Lang","Interactions of a Cationic Mercury(II) Thiolate Complex [Hg(Tab)2](PF6)2 with N-Donor Ligands","Inorganic Chemistry","2009","48","","2639","2651","10.1021/ic8021744","","","0.71073","MoKα","","0.1303","0.1055","","","0.2553","0.2906","","","","","","1.045","","","","has coordinates,has disorder","179055","2020-10-21","18:00:00",""
"4302047","18.0838","0.0014","15.9439","0.0019","15.4641","0.0016","90","","91.886","0.004","90","","4456.3","0.8","203","2","203","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C46 H46 Fe N6 O4 -","- C46 H46 Fe N6 O4 -","- C184 H184 Fe4 N24 O16 -","4","1","","Bradley M. Wile; Ryan J. Trovitch; Suzanne C. Bart; Aaron M. Tondreau; Emil Lobkovsky; Carsten Milsmann; Eckhard Bill; Karl Wieghardt; Paul J. Chirik","Reduction Chemistry of Aryl- and Alkyl-Substituted Bis(imino)pyridine Iron Dihalide Compounds: Molecular and Electronic Structures of [(PDI)2Fe] Derivatives","Inorganic Chemistry","2009","48","","4190","4200","10.1021/ic801623m","","","0.71073","MoKα","","0.0787","0.05","","","0.1187","0.1306","","","","","","0.972","","","","has coordinates","179058","2020-10-21","18:00:00",""
"4303618","17.5999","0.0003","8.994","0.0001","32.2236","0.0006","90","","96.358","0.001","90","","5069.41","0.14","200","2","200","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C34 H40 Br Cu3 Fe6 N2 O18 Te2 -","- C34 H40 Br Cu3 Fe6 N2 O18 Te2 -","- C136 H160 Br4 Cu12 Fe24 N8 O72 Te8 -","4","1","","Bo-Gaun Chen; Chia-Hua Ho; Chang-Ju Lee; Minghuey Shieh","Copper Halide-Incorporated Tellurium-Iron Carbonyl Complexes: Transformation, Electrochemical Properties, and Theoretical Calculations","Inorganic Chemistry","2009","48","","10757","10768","10.1021/ic901647n","","","0.71073","MoKα","","0.1152","0.0667","","","0.1667","0.2074","","","","","","1.055","","","","has coordinates","179074","2020-10-21","18:00:00",""
"4303730","3.8197","0.0002","11.8571","0.0005","16.2617","0.0008","90","","103.62","0.005","90","","715.79","0.06","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- B6 Fe5 H3 O18 -","- B6 Fe5 O18 -","- B12 Fe10 O36 -","2","0.5","","Tao Yang; Junliang Sun; Guobao Li; Yingxia Wang; Jeppe Christensen; Zhanbing He; Kirsten E. Christensen; Xiaodong Zou; Fuhui Liao; Jianhua Lin","Fe5O5[B6O10(OH)3].nH2O: Wave-Layered Iron Borate and Frustrated Antiferromagnetism","Inorganic Chemistry","2009","48","","11209","11214","10.1021/ic9016867","","","0.71069","MoKα","","0.0436","0.0413","","","0.1071","0.1084","","","","","","1.023","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4303731","15.3013","0.0004","11.8762","0.0004","16.2894","0.0005","90","","103.627","0.002","90","","2876.8","0.15","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- B12 Fe10 H8 O37 -","- B12 Fe10 O37 -","- B48 Fe40 O148 -","4","1","","Tao Yang; Junliang Sun; Guobao Li; Yingxia Wang; Jeppe Christensen; Zhanbing He; Kirsten E. Christensen; Xiaodong Zou; Fuhui Liao; Jianhua Lin","Fe5O5[B6O10(OH)3].nH2O: Wave-Layered Iron Borate and Frustrated Antiferromagnetism","Inorganic Chemistry","2009","48","","11209","11214","10.1021/ic9016867","","","0.71073","MoKα","","0.1354","0.0569","","","0.1765","0.2189","","","","","","1.035","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4304201","10.75","0.002","6.9767","0.001","16.377","0.002","90","","100.653","0.007","90","","1207.1","0.3","291","2","291","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18 H34 Cu2 N2 O11 -","- C18 H34 Cu2 N2 O11 -","- C36 H68 Cu4 N4 O22 -","2","0.5","","Alexander M. Kirillov; Yauhen Y. Karabach; Matti Haukka; M. Fátima C. Guedes da Silva; Joaquin Sanchiz; Maximilian N. Kopylovich; Armando J. L. Pombeiro","Self-Assembled Copper(II) Coordination Polymers Derived from Aminopolyalcohols and Benzenepolycarboxylates: Structural and Magnetic Properties","Inorganic Chemistry","2008","47","","162","175","10.1021/ic701669x","","","0.71073","MoKα","","0.1362","0.0627","","","0.0989","0.1191","","","","","","1.019","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4304392","21.9205","0.0007","7.8885","0.0003","26.6533","0.001","90","","96.523","0.003","90","","4579","0.3","110","","110","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C51 H22 B Cu F20 N4 O -","- C51 H22 B Cu F20 N4 O -","- C204 H88 B4 Cu4 F80 N16 O4 -","4","1","","H. Christopher Fry; Heather R. Lucas; Amy A. Narducci Sarjeant; Kenneth D. Karlin; Gerald J. Meyer","Carbon Monoxide Coordination and Reversible Photodissociation in Copper(I) Pyridylalkylamine Compounds","Inorganic Chemistry","2008","47","","241","256","10.1021/ic701903h","","","0.71073","MoKα","","0.1033","0.0851","","","0.1806","0.1911","","","","","","1.165","","","","has coordinates","179081","2020-10-21","18:00:00",""
"4304549","11.453","0.003","5.531","0.0013","15.252","0.004","90","","95.385","0.004","90","","961.9","0.4","173","2","173","2","","","","","","","Chemical Synthesis","3","P 1 2/c 1","-P 2yc","13","Methylaminotriazolium azide","?1-amino-3-methyl-1,2,3-triazolium azide","","- C3 H7 N7 -","- C3 H7 N7 -","- C18 H42 N42 -","6","1.5","","Stefan Schneider; Tommy Hawkins; Michael Rosander; Jeffrey Mills; Adam Brand; Leslie Hudgens; Greg Warmoth; Ashwani Vij","Liquid Azide Salts","Inorganic Chemistry","2008","47","","3617","3624","10.1021/ic702068r","","x-ray","0.71073","MoKα","","0.035","0.0326","","","0.0928","0.0951","","","","","","1.067","","","","has coordinates,has disorder","179083","2020-10-21","18:00:00",""
"4305204","23.7788","0.0006","8.2593","0.0001","16.7947","0.0005","90","","104.501","0.001","90","","3193.34","0.13","120","2","120","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H33 N11 O14 Pt -","- C24 H33 N11 O14 Pt -","- C96 H132 N44 O56 Pt4 -","4","1","","Pavel V. Gushchin; Marina R. Tyan; Nadezhda A. Bokach; Mikhail D. Revenco; Matti Haukka; Meng-Jiy Wang; Cheng-Hsuan Lai; Pi-Tai Chou; Vadim Yu. Kukushkin","Novel Tailoring Reaction for Two Adjacent Coordinated Nitriles Giving Platinum 1,3,5-Triazapentadiene Complexes","Inorganic Chemistry","2008","47","","11487","11500","10.1021/ic702483w","","","0.71073","MoKα","","0.0486","0.0319","","","0.0586","0.0633","","","","","","1.042","","","","has coordinates,has disorder","179090","2020-10-21","18:00:00",""
"4305210","15.2442","0.0016","6.6431","0.0007","15.1095","0.0016","90","","103.071","0.002","90","","1490.5","0.3","233","2","233","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C34 H28 F4 N2 O4 Zn -","- C34 H28 F4 N2 O4 Zn -","- C68 H56 F8 N4 O8 Zn2 -","2","0.5","","Ho-Jin Son; Won-Sik Han; Ji-Yun Chun; Byoung-Kook Kang; Soon-Nam Kwon; Jaejung Ko; Su Jung Han; Chongmok Lee; Sung Joo Kim; Sang Ook Kang","Generation of Blue Light-Emitting Zinc Complexes by Band-Gap Control of the Oxazolylphenolate Ligand System: Syntheses, Characterizations, and Organic Light Emitting Device Applications of 4-Coordinated Bis(2-oxazolylphenolate) Zinc(II) Complexes","Inorganic Chemistry","2008","47","","5666","5676","10.1021/ic702491j","","","0.71073","MoKα","","0.1674","0.0616","","","0.1488","0.2178","","","","","","1.022","","","","has coordinates","179090","2020-10-21","18:00:00",""
"4305245","11.3146","0.0008","5.8353","0.0004","12.9236","0.0009","90","","95.3043","0.0014","90","","849.61","0.1","193","2","193","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C14 H16 Ag Cl N4 O4 -","- C14 H16 Ag Cl N4 O4 -","- C28 H32 Ag2 Cl2 N8 O8 -","2","0.5","","Emerson D. Genuis; Joel A. Kelly; Malay Patel; Robert McDonald; Michael J. Ferguson; Grace Greidanus-Strom","Coordination Polymers from the Self-Assembly of Silver(I) Salts and Two Nonlinear Aliphatic Dinitrile Ligands, cis-1,3-Cyclopentanedicarbonitrile and cis-1,3-Bis(cyanomethyl)cyclopentane: Synthesis, Structures, and Photoluminescent Properties","Inorganic Chemistry","2008","47","","6184","6194","10.1021/ic800069f","","","0.71073","MoKα","","0.0426","0.038","","","0.1164","0.1193","","","","","","1.153","","","","has coordinates","179090","2020-10-21","18:00:00",""
"4305246","5.9443","0.0008","11.3371","0.0015","13.0729","0.0017","90","","93.0094","0.0017","90","","879.8","0.2","193","2","193","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C14 H16 Ag F6 N4 P -","- C14 H16 Ag F6 N4 P -","- C28 H32 Ag2 F12 N8 P2 -","2","0.5","","Emerson D. Genuis; Joel A. Kelly; Malay Patel; Robert McDonald; Michael J. Ferguson; Grace Greidanus-Strom","Coordination Polymers from the Self-Assembly of Silver(I) Salts and Two Nonlinear Aliphatic Dinitrile Ligands, cis-1,3-Cyclopentanedicarbonitrile and cis-1,3-Bis(cyanomethyl)cyclopentane: Synthesis, Structures, and Photoluminescent Properties","Inorganic Chemistry","2008","47","","6184","6194","10.1021/ic800069f","","","0.71073","MoKα","","0.0323","0.0301","","","0.075","0.077","","","","","","1.094","","","","has coordinates","179090","2020-10-21","18:00:00",""
"4305424","7.0131","0.0011","10.059","0.002","28.818","0.005","90","","90.711","0.003","90","","2032.8","0.6","150","2","150","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C33 H36 Cu F12 N6 O9 P2 -","- C33 H32 Cu F12 N6 O9 P2 -","- C66 H64 Cu2 F24 N12 O18 P4 -","2","0.5","","Junhua Jia; Alexander J. Blake; Neil R. Champness; Peter Hubberstey; Claire Wilson; Martin Schröder","Multi-Dimensional Transition-Metal Coordination Polymers of 4,4'-Bipyridine-N,N'-dioxide: 1D Chains and 2D Sheets","Inorganic Chemistry","2008","47","","8652","8664","10.1021/ic800422g","","","0.71073","MoKα","","0.0766","0.0595","","","0.158","0.166","","","","","","1.08","","","","has coordinates","179092","2020-10-21","18:00:00",""
"4305458","7.5709","0.00011","7.3557","0.0001","12.9904","0.00018","90","","91.6093","0.0012","90","","723.141","0.018","100","2","100","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C H4 Mo N2 O4 -","- C H4 Mo N2 O4 -","- C6 H24 Mo6 N12 O24 -","6","1.5","","Sandra J. Veen; Soumyajit Roy; Yaroslav Filinchuk; Dmitry Chernyshov; Andrei V. Petukhov; Marjan Versluijs-Helder; Alfred Broersma; Fouad Soulimani; Tom Visser; Willem K. Kegel","Extended Structure Design with Simple Molybdenum Oxide Building Blocks and Urea As a Directing Agent","Inorganic Chemistry","2008","47","","6863","6866","10.1021/ic800444m","","","0.72906","synchrotron","","0.0414","0.0366","","","0.0943","0.0976","","","","","","1.175","","","","has coordinates","179092","2020-10-21","18:00:00",""
"4305461","31.543","0.002","6.2642","0.0002","25.3392","0.0017","90","","111.379","0.003","90","","4662.3","0.5","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C36 H36 F6 N16 O8 S2 U -","- C36 H36 F6 N16 O8 S2 U -","- C144 H144 F24 N64 O32 S8 U4 -","4","1","","Jean-Claude Berthet; Pierre Thuéry; Jean-Pierre Dognon; Denis Guillaneux; Michel Ephritikhine","Sterically Congested Uranyl Complexes with Seven-Coordination of the UO2 Unit: the Peculiar Ligation Mode of Nitrate in [UO2(NO3)2(Rbtp)] Complexes","Inorganic Chemistry","2008","47","","6850","6862","10.1021/ic8004486","","","0.71073","MoKα","","0.0823","0.0345","","","0.0736","0.0877","","","","","","0.954","","","","has coordinates","179092","2020-10-21","18:00:00",""
"4305652","9.898","0.003","6.528","0.002","29.317","0.009","90","","104.029","0.009","90","","1837.8","1","294","2","294","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C12 H14 Cl Gd N2 O13 -","- C12 H12 Cl Gd N2 O13 -","- C48 H48 Cl4 Gd4 N8 O52 -","4","1","","Na Xu; Wei Shi; Dai-Zheng Liao; Shi-Ping Yan; Peng Cheng","Template Synthesis of Lanthanide (Pr, Nd, Gd) Coordination Polymers with 2-Hydroxynicotinic Acid Exhibiting Ferro-/Antiferromagnetic Interaction","Inorganic Chemistry","2008","47","","8748","8756","10.1021/ic800623v","","","0.71073","MoKα","","0.0988","0.0813","","","0.1984","0.2115","","","","","","1.124","","","","has coordinates","179094","2020-10-21","18:00:00",""
"4305735","16.1308","0.0012","7.9238","0.0006","17.2634","0.0017","90","","94.236","0.007","90","","2200.5","0.3","295","2","295","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C32 H38 F N2 O18 P5 V4 -","- C32 H38 F N2 O18 P5 V4 -","- C64 H76 F2 N4 O36 P10 V8 -","2","0.5","","Jabor K. Jabor; Reinhard Stösser; Michael Feist; Petra Neubauer; Manfred Meisel","New Directions in the Preparation and Redox Chemistry of Fluoride-Templated Tetranuclear Vanadium Phosphonate Cage Compounds, Mn+[(V2O3)2(RPO3)4@F]n","Inorganic Chemistry","2008","47","","9293","9302","10.1021/ic800707v","","","0.71073","MoKα","","0.0364","0.0288","","","0.0727","0.0783","","","","","","1.074","","","","has coordinates","179095","2020-10-21","18:00:00",""
"4305779","11.9836","0.0007","28.1903","0.0013","15.4321","0.0008","90","","100.348","0.003","90","","5128.5","0.5","293","2","293","2","","","","","","","","9","P 1 2/c 1","-P 2yc","13","","","","- C44 H26 Au Er F18 Fe0.5 N2 O7 P -","- C44 H24 Au Er F18 Fe0.5 N2 O7 P -","- C176 H96 Au4 Er4 F72 Fe2 N8 O28 P4 -","4","1","","Hai-Bing Xu; Li-Yi Zhang; Jun Ni; Hsiu-Yi Chao; Zhong-Ning Chen","Conformation Changes and Luminescent Properties of Au-Ln (Ln = Nd, Eu, Er, Yb) Arrays with 5-Ethynyl-2,2'-Bipyridine","Inorganic Chemistry","2008","47","","10744","10752","10.1021/ic800733x","","","0.71073","MoKα","","0.0654","0.054","","","0.1453","0.1558","","","","","","1.058","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4305984","12.1865","0.0017","11.1628","0.0015","13.9197","0.0019","90","","104.186","0.002","90","","1835.8","0.4","141","2","141","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H48 Cl7 O6 Pu2 -","- C24 H48 Cl7 O6 Pu2 -","- C48 H96 Cl14 O12 Pu4 -","2","0.5","","Andrew J. Gaunt; Sean D. Reilly; Alejandro E. Enriquez; Trevor W. Hayton; James M. Boncella; Brian L. Scott; Mary P. Neu","Low-Valent Molecular Plutonium Halide Complexes","Inorganic Chemistry","2008","47","","8412","8419","10.1021/ic8009139","","","0.71073","MoKα","","0.0749","0.0432","","","0.0782","0.0868","","","","","","1.094","","","","has coordinates","179097","2020-10-21","18:00:00",""
"4305989","7.2508","0.0015","5.7788","0.0012","10.045","0.002","90","","133.23","0.03","90","","306.67","0.19","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Br F6 O2 Sb -","- Br F6 O2 Sb -","- Br2 F12 O4 Sb2 -","2","0.5","","John F. Lehmann; Sebastian Riedel; Gary J. Schrobilgen","Behavior of BrO3F and ClO3F Toward Strong Lewis Acids and the Characterization of [XO2][SbF6] (X = Cl, Br) by Single Crystal X-ray Diffraction, Raman Spectroscopy, and Computational Methods","Inorganic Chemistry","2008","47","","8343","8356","10.1021/ic800929h","","","0.71073","MoKα","","0.0131","0.013","","","0.0323","0.0323","","","","","","1.399","","","","has coordinates","179097","2020-10-21","18:00:00",""
"4305990","7.1935","0.0014","5.6817","0.0011","10.225","0.002","90","","134.68","0.03","90","","297.15","0.18","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Cl F6 O2 Sb -","- Cl F6 O2 Sb -","- Cl2 F12 O4 Sb2 -","2","0.5","","John F. Lehmann; Sebastian Riedel; Gary J. Schrobilgen","Behavior of BrO3F and ClO3F Toward Strong Lewis Acids and the Characterization of [XO2][SbF6] (X = Cl, Br) by Single Crystal X-ray Diffraction, Raman Spectroscopy, and Computational Methods","Inorganic Chemistry","2008","47","","8343","8356","10.1021/ic800929h","","","0.71073","MoKα","","0.0793","0.0527","","","0.1068","0.1144","","","","","","1.02","","","","has coordinates","179097","2020-10-21","18:00:00",""
"4306026","9.0269","0.0008","10.7116","0.0009","16.4849","0.0018","90","","92.339","0.008","90","","1592.6","0.3","293","2","293","2","","","","","","","synthesis as described","4","P 1 2/c 1","-P 2yc","13","","[Fe(abpt)2(tcm)2] 293 K","","- C32 H20 Fe N18 -","- C32 H20 Fe N18 -","- C64 H40 Fe2 N36 -","2","0.5","","Gaelle Dupouy; Mathieu Marchivie; Smail Triki; Jean Sala-Pala; Jean-Yves Salaün; Carlos J. Gómez-García; Philippe Guionneau","The Key Role of the Intermolecular π-π Interactions in the Presence of Spin Crossover in Neutral [Fe(abpt)2A2] Complexes (A = Terminal Monoanion N Ligand)","Inorganic Chemistry","2008","47","","8921","8931","10.1021/ic800955r","","x-ray","0.71073","MoKα","","0.0596","0.0432","","","0.0977","0.1059","","","","","","1.079","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306027","9.2941","0.0007","10.8508","0.0008","16.7503","0.0011","90","","91.101","0.005","90","","1688.9","0.2","400","2","400","2","","","","","","","synthesis as described","4","P 1 2/c 1","-P 2yc","13","","[Fe(abpt)2(tcm)2] 400 K","","- C32 H20 Fe N18 -","- C32 H20 Fe N18 -","- C64 H40 Fe2 N36 -","2","0.5","","Gaelle Dupouy; Mathieu Marchivie; Smail Triki; Jean Sala-Pala; Jean-Yves Salaün; Carlos J. Gómez-García; Philippe Guionneau","The Key Role of the Intermolecular π-π Interactions in the Presence of Spin Crossover in Neutral [Fe(abpt)2A2] Complexes (A = Terminal Monoanion N Ligand)","Inorganic Chemistry","2008","47","","8921","8931","10.1021/ic800955r","","x-ray","0.71069","MoKα","","0.086","0.046","","","0.0948","0.1131","","","","","","1.054","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306044","29.61","0.006","12.576","0.003","14.106","0.003","90","","103.68","0.03","90","","5104","2","83","2","83","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C60 H44 Ag2 B2 F8 N8 -","- C60 H44 Ag2 B2 F8 N8 -","- C240 H176 Ag8 B8 F32 N32 -","4","1","","Jason R. Price; Nicholas G. White; Alejandro Perez-Velasco; Geoffrey B. Jameson; Christopher A. Hunter; Sally Brooker","Factors Influencing Tetranuclear [2 x 2] Grid vs Dinuclear Side-by-Side Structures for Silver(I) Complexes of Pyridazine-Based Bis-Bidentate Ligands","Inorganic Chemistry","2008","47","","10729","10738","10.1021/ic800959s","","","0.71073","MoKα","","0.053","0.0315","","","0.0806","0.1008","","","","","","1.076","","","","has coordinates,has disorder","179098","2020-10-21","18:00:00",""
"4306169","8.155","0.002","9.518","0.003","24.595","0.006","90","","94.168","0.01","90","","1904","0.9","120","2","120","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","catena-pentachlorobis(1,2-bis(dimethylarsino)benzene)diindium(III) tetrachloroindate(III)","","- C20 H32 As4 Cl9 In3 -","- C20 H32 As4 Cl9 In3 -","- C40 H64 As8 Cl18 In6 -","2","0.5","","Fei Cheng; Sarah I. Friend; Andrew L. Hector; William Levason; Gillian Reid; Michael Webster; Wenjian Zhang","Preparation, Characterization, and Structural Systematics of Diphosphane and Diarsane Complexes of Indium(III) Halides","Inorganic Chemistry","2008","47","","9691","9700","10.1021/ic801091n","","","0.71073","MoKα","","0.0665","0.0472","","","0.0921","0.1031","","","","","","1.15","","","","has coordinates","179099","2020-10-21","18:00:00",""
"4306277","13.755","0.003","6.6926","0.0012","13.692","0.003","90","","105.44","0.004","90","","1215","0.4","223","2","223","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C8 H26 Cl In3 N6 Te4 -","- C8 H26 Cl In3 N6 Te4 -","- C16 H52 Cl2 In6 N12 Te8 -","2","0.5","","Chun-Ying Li; Xiao-Xia Chen; Jian Zhou; Qin-Yu Zhu; Zhi-Xin Lei; Yong Zhang; Jie Dai","Cationic Main-Group Metal Chalcogenide with a 1-D Polymeric Structure, [{In(dien)}2(InTe4)].Cl","Inorganic Chemistry","2008","47","","8586","8588","10.1021/ic801121q","","","0.71073","MoKα","","0.0307","0.0271","","","0.0518","0.053","","","","","","1.177","","","","has coordinates","179100","2020-10-21","18:00:00",""
"4307002","18.7741","0.0008","19.6516","0.0008","17.3283","0.0008","90","","115.311","0.002","90","","5779.4","0.4","100","2","100","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C59 H42 Cu2 F12 N10 O2 P2 S4 -","- C57 H39 Cu2 F9 N9 O2 P1.5 S4 -","- C228 H156 Cu8 F36 N36 O8 P6 S16 -","4","1","","John C. Jeffery; Thomas Riis-Johannessen; Callum J. Anderson; Christopher J. Adams; Adam Robinson; Stephen P. Argent; Michael D. Ward; Craig R. Rice","Localization and Delocalization in a Mixed-Valence Dicopper Helicate","Inorganic Chemistry","2007","46","","2417","2426","10.1021/ic061504m","","","1.54178","CuKα","","0.0985","0.0567","","","0.1304","0.1455","","","","","","1.046","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307019","13.8","0.002","8.022","0.002","18.044","0.003","90","","102.84","0.02","90","","1947.6","0.7","273.2","","273.2","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C17 H12 Cl N6 O3 Re -","- C17 H13 Cl N6 O3 Re -","- C68 H52 Cl4 N24 O12 Re4 -","4","1","","Dik-Lung Ma; Chi-Ming Che; Fung-Ming Siu; Mengsu Yang; Kwok-Yin Wong","DNA Binding and Cytotoxicity of Ruthenium(II) and Rhenium(I) Complexes of 2-Amino-4-phenylamino-6-(2-pyridyl)-1,3,5-triazine","Inorganic Chemistry","2007","46","","740","749","10.1021/ic061518s","","","0.7107","MoKalpha","","","0.0467","","","0.0605","","","","","2.329","2.329","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307424","14.3491","0.0008","7.6628","0.0003","14.2562","0.0008","90","","112.434","0.002","90","","1448.9","0.13","150","2","150","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C12 H12 Au B Cl F4 N3 -","- C12 H12 Au B Cl F4 N3 -","- C48 H48 Au4 B4 Cl4 F16 N12 -","4","1","","Lingyun Cao; Michael C. Jennings; Richard J. Puddephatt","Amine-Amide Equilibrium in Gold(III) Complexes and a Gold(III)-Gold(I) Aurophilic Bond","Inorganic Chemistry","2007","46","","1361","1368","10.1021/ic061911y","","","0.71073","MoKα","","0.056","0.0348","","","0.0822","0.0903","","","","","","0.983","","","","has coordinates,has disorder","179112","2020-10-21","18:00:00",""
"4307569","19.7302","0.0004","10.949","0.0002","17.1696","0.0003","90","","113.856","0.0009","90","","3392.18","0.11","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C29 H24 Cl2 Fe N12 O9 -","- C29 H20 Cl2 Fe N12 O9 -","- C116 H80 Cl8 Fe4 N48 O36 -","4","1","","Wen Zhang; Fei Zhao; Tao Liu; Mei Yuan; Zhe-Ming Wang; Song Gao","Spin Crossover in a Series of Iron(II) Complexes of 2-(2-Alkyl-2H-tetrazol-5-yl)-1,10-phenanthroline: Effects of Alkyl Side Chain, Solvent, and Anion","Inorganic Chemistry","2007","46","","2541","2555","10.1021/ic062062h","","","0.71073","MoKα","","0.1395","0.0603","","","0.1539","0.1796","","","","","","1.01","","","","has coordinates,has disorder","179113","2020-10-21","18:00:00",""
"4307966","30.9619","0.0018","11.4244","0.0007","23.0118","0.0014","90","","108.746","0.001","90","","7708","0.8","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C80.5 H93 Cl Fe2 N O8 S8 -","- C80.5 H93 Cl Fe2 N O8 S8 -","- C322 H372 Cl4 Fe8 N4 O32 S32 -","4","1","","Rongmin Yu; Kuppuswamy Arumugam; Ashok Manepalli; Yvon Tran; Russell Schmehl; Heiko Jacobsen; James P. Donahue","Reversible, Electrochemically Controlled Binding of Phosphine to Iron and Cobalt Bis(dithiolene) Complexes","Inorganic Chemistry","2007","46","","5131","5133","10.1021/ic0624569","","","0.71073","MoKα","","0.053","0.0411","","","0.0972","0.1039","","","","","","1.05","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307971","30.86","0.003","11.4501","0.0007","22.8507","0.0016","90","","108.453","0.005","90","","7659.1","1.1","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C80.5 H93 Cl Co2 N O8 S8 -","- C80.5 H93 Cl Co2 N O8 S8 -","- C322 H372 Cl4 Co8 N4 O32 S32 -","4","1","","Rongmin Yu; Kuppuswamy Arumugam; Ashok Manepalli; Yvon Tran; Russell Schmehl; Heiko Jacobsen; James P. Donahue","Reversible, Electrochemically Controlled Binding of Phosphine to Iron and Cobalt Bis(dithiolene) Complexes","Inorganic Chemistry","2007","46","","5131","5133","10.1021/ic0624569","","","0.71073","MoKα","","0.0777","0.0494","","","0.1043","0.1157","","","","","","1.03","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4308124","12.56","0.006","9.927","0.005","26.238","0.007","90","","115.121","0.002","90","","2962","2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C52 H62 Cu4 N8 O15 V4 -","- C52 H62 Cu4 N8 O15 V4 -","- C104 H124 Cu8 N16 O30 V8 -","2","0.5","","Xiaoshu Qu; Lin Xu; Guanggang Gao; Fengyan Li; Yanyan Yang","Unprecedented Eight-Connected Self-catenated Network Based on Heterometallic {Cu4V4O12} Clusters as Nodes","Inorganic Chemistry","2007","46","","4775","4777","10.1021/ic070114c","","","0.71069","MoKα","","0.1057","0.0479","","","0.0963","0.121","","","","","","0.927","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308125","12.56","0.005","9.927","0.005","26.238","0.005","90","","115.121","0.012","90","","2962","2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C52 H62 Cu4 N8 O15 V4 -","- C104 H124 Cu8 N16 O30 V8 -","- C104 H124 Cu8 N16 O30 V8 -","1","0.25","","Xiaoshu Qu; Lin Xu; Guanggang Gao; Fengyan Li; Yanyan Yang","Unprecedented Eight-Connected Self-catenated Network Based on Heterometallic {Cu4V4O12} Clusters as Nodes","Inorganic Chemistry","2007","46","","4775","4777","10.1021/ic070114c","","","0.71069","MoKα","","0.1476","0.0675","","","0.1445","0.1797","","","","","","1.034","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308543","16.9602","0.0003","9.5276","0.0002","17.7105","0.0004","90","","113.429","0.001","90","","2625.89","0.1","150","2","150","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C42.5 H41 Ag2 B2 Cl5 F8 N8 O4 -","- C42.5 H41 Ag2 B2 Cl5 F8 N8 O4 -","- C85 H82 Ag4 B4 Cl10 F16 N16 O8 -","2","0.5","","Nancy L. S. Yue; Michael C. Jennings; Richard J. Puddephatt","Disilver(I) Macrocycles: Variation of Cavity Size with Anion Binding","Inorganic Chemistry","2005","44","","1125","1131","10.1021/ic048549c","","","0.71073","MoKα","","0.0678","0.0473","","","0.1271","0.1386","","","","","","1.05","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4308925","19.49","0.008","9.443","0.003","9.434","0.003","90","","110.37","0.03","90","","1627.7","1","293","2","293","2","","","","","","","synthesis as described","5","P 1 2/c 1","-P 2yc","13","","P,P'-diphenylmethylenediphosphinate copper(II) tris-aquo","","- C13 H18 Cu O7 P2 -","- C13 H12 Cu O7 P2 -","- C52 H48 Cu4 O28 P8 -","4","1","","Samuele Ciattini; Ferdinando Costantino; Pablo Lorenzo-Luis; Stefano Midollini; Annabella Orlandini; Alberto Vacca","Inorganic-Organic Hybrids Formed by P,P'-Diphenylmethylenediphosphinate, pcp2-, with the Cu2+ Ion. X-ray Crystal Structures of [Cu(pcp)(H2O)2].H2O and [Cu(pcp)(bipy)(H2O)]","Inorganic Chemistry","2005","44","","4008","4016","10.1021/ic050171a","","x-ray","1.5418","CuKα","","0.0877","0.066","","","0.1562","0.1689","","","","","","0.99","","","","has coordinates","179127","2020-10-21","18:00:00",""
"4309278","33.6633","0.0002","17.3311","0.0009","27.2564","0.0002","90","","94.209","0.0002","90","","15859.1","0.8","193","2","193","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C120.5 H30 Cl9 F80 Mn12 N O48.5 -","- C120.677 H24.854 Cl9.354 F80 Mn12 N O48.495 -","- C482.708 H99.416 Cl37.416 F320 Mn48 N4 O193.98 -","4","1","","Nicole E. Chakov; Mònica Soler; Wolfgang Wernsdorfer; Khalil A. Abboud; George Christou","Single-Molecule Magnets: Structural Characterization, Magnetic Properties, and 19F NMR Spectroscopy of a Mn12 Family Spanning Three Oxidation Levels","Inorganic Chemistry","2005","44","","5304","5321","10.1021/ic050379w","","","0.71073","MoKα","","0.1307","0.0534","","","0.1325","0.1599","","","","","","0.954","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4309335","15.941","0.007","10.92","0.005","29.012","0.013","90","","98.577","0.008","90","","4994","4","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C116 H96 B2 Cu2 F8 N6 P4 -","- C113 H68 B2 Cu2 F8 N6 P4 -","- C226 H136 B4 Cu4 F16 N12 P8 -","2","0.5","","Wen Li Jia; Theresa MCormick; Ye Tao; Jian-Ping Lu; Suning Wang","New Phosphorescent Polynuclear Cu(I) Compounds Based on Linear and Star-Shaped 2-(2'-Pyridyl)benzimidazolyl Derivatives: Syntheses, Structures, Luminescence, and Electroluminescence","Inorganic Chemistry","2005","44","","5706","5712","10.1021/ic0504893","","","0.71073","MoKα","","0.2471","0.0721","","","0.166","0.2124","","","","","","0.769","","","","has coordinates","179131","2020-10-21","18:00:00",""
"4309438","14.055","0.004","13.973","0.004","18.653","0.006","90","","110.751","0.005","90","","3425.6","1.8","223","2","223","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C23 H20 F9 N4 O9.5 S3 U -","- C23 H20 F9 N4 O9.5 S3 U -","- C92 H80 F36 N16 O38 S12 U4 -","4","1","","Louise Natrajan; Marinella Mazzanti; Jean-Philippe Bezombes; Jacques Pécaut","Practical Synthetic Routes to Solvates of U(OTf)3: X-ray Crystal Structure of [U(OTf)3(MeCN)3]n, a Unique U(III) Coordination Polymer","Inorganic Chemistry","2005","44","","6115","6121","10.1021/ic0505652","","","0.71073","MoKα","","0.0911","0.0583","","","0.1402","0.1537","","","","","","1.106","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4309537","15.9627","0.0014","11.7157","0.0012","23.502","0.002","90","","92.783","0.008","90","","4390","0.7","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","Mn(dtbp)2(44'-bpy)(H2O)2","","","- C36 H56 Mn N4 O10 P2 -","- C36 H56 Mn N4 O10 P2 -","- C144 H224 Mn4 N16 O40 P8 -","4","1","","Ramasamy Pothiraja; Malaichamy Sathiyendiran; Ray J. Butcher; Ramaswamy Murugavel","Non-Interpenetrating Transition Metal Diorganophosphate 2-Dimensional Rectangular Grids from Their 1-Dimensional Wires: Structural Transformations under Mild Conditions","Inorganic Chemistry","2005","44","","6314","6323","10.1021/ic050742z","","","0.71073","MoKα","","0.0686","0.0455","","","0.1301","0.1369","","","","","","1.098","","","","has coordinates","179133","2020-10-21","18:00:00",""
"4309538","15.846","0.003","11.452","0.002","23.008","0.005","90","","92.77","0.03","90","","4170.3","1.4","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C36 H56 Co N4 O10 P2 -","- C36 H56 Co N4 O10 P2 -","- C144 H224 Co4 N16 O40 P8 -","4","1","","Ramasamy Pothiraja; Malaichamy Sathiyendiran; Ray J. Butcher; Ramaswamy Murugavel","Non-Interpenetrating Transition Metal Diorganophosphate 2-Dimensional Rectangular Grids from Their 1-Dimensional Wires: Structural Transformations under Mild Conditions","Inorganic Chemistry","2005","44","","6314","6323","10.1021/ic050742z","","","0.71073","MoKα","","0.1512","0.0954","","","0.2337","0.2597","","","","","","1.022","","","","has coordinates","179133","2020-10-21","18:00:00",""
"4309715","16.457","0.004","9.193","0.002","21.244","0.004","90","","113.523","0.014","90","","2946.9","1.2","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C112 H108 Cd4 N28 O26 -","- C112 H108 Cd4 N28 O26 -","- C112 H108 Cd4 N28 O26 -","1","0.25","","Li-Li Wen; Dong-Bin Dang; Chun-Ying Duan; Yi-Zhi Li; Zheng-Fang Tian; Qing-Jin Meng","1D Helix, 2D Brick-Wall and Herringbone, and 3D Interpenetration d10 Metal-Organic Framework Structures Assembled from Pyridine-2,6-dicarboxylic AcidN-Oxide","Inorganic Chemistry","2005","44","","7161","7170","10.1021/ic0509985","","","0.71073","MoKα","","0.0928","0.0484","","","0.0885","0.0963","","","","","","0.986","","","","has coordinates","179135","2020-10-21","18:00:00",""
"4310124","11.462","0.002","6.8727","0.0014","24.986","0.005","90","","98.79","0.03","90","","1945.2","0.7","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Silver_1,3,5,7-Tetra(4-sulfophenyl)adamantane","","","- C34 H28 Ag4 O15.3 S4 -","- C34 H28 Ag4 O15.3 S4 -","- C68 H56 Ag8 O30.6 S8 -","2","0.5","","Dennis J. Hoffart; Sean A. Dalrymple; George K. H. Shimizu","Structural Constraints in the Design of Silver Sulfonate Coordination Networks: Three New Polysulfonate Open Frameworks","Inorganic Chemistry","2005","44","","8868","8875","10.1021/ic0513888","","","0.71073","MoKα","","0.0576","0.0505","","","0.1379","0.1444","","","","","","1.031","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4310496","10.2185","0.0007","11.217","0.0007","16.0894","0.0012","90","","106.075","0.005","90","","1772.1","0.2","298","2","298","2","","","","","","","recrystallized from hexan","6","P 1 2/c 1","-P 2yc","13","","","","- C30 H24 F8 P2 Ru S6 -","- C30 H24 F8 P2 Ru S6 -","- C60 H48 F16 P4 Ru2 S12 -","2","0.5","","Maribel Arroyo; Sylvain Bernès; Joaquín Cerón; Jordi Rius; Hugo Torrens","Insertion reactions of [M(SR)~3~(PMe~2~Ph)~2~] with CS~2~ (M = Ru, Os; R = C~6~F~4~H, C~6~F~5~). X-ray structures of [Ru(S~2~CSC~6~F~4~H-4)~2~(PMe~2~Ph)~2~], trans thiolates- M(SR)~2~(S~2~CSR)(PMe~2~Ph)~2~] (M = Ru; R = C~6~F~5~ and M = Os; R = C~6~F~4~H-4) and trans thiolate-phosphine- [Os(SC~6~F~5~)~2~(S~2~CSC~6~F~5~)(PMe~2~Ph)~2~]","Inorganic Chemistry","2004","43","","986","992","10.1021/ic034125r","","x-ray","0.71073","MoKα","","0.0797","0.0391","","","0.0756","0.0944","","","","","","1.015","","","","has coordinates","179143","2020-10-21","18:00:00",""
"4310501","18.406","0.001","9.8418","0.0005","23.444","0.002","90","","101.28","0.004","90","","4164.8","0.5","293.1","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C32 H44 N Ni O4 S12 -","- C31.98 H43.96 N Ni O4 S12 -","- C127.92 H175.84 N4 Ni4 O16 S48 -","4","1","","Emiko Fujiwara; Akiko Kobayashi; Hideki Fujiwara; Hayao Kobayashi","Syntheses, Structures, and Physical Properties of Nickel Bis(dithiolene) Complexes Containing Tetrathiafulvalene (TTF) Units","Inorganic Chemistry","2004","43","","1122","1129","10.1021/ic034670s","","","0.7107","MoKα","","","0.057","","","","0.0613","","","","","","1.777","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4310945","14.9781","0.0006","11.2624","0.0008","14.9417","0.001","90","","115.594","0.003","90","","2273.2","0.2","150","1","150","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C0.5 H Cl12 N3 P4 -","- Cl11 N3 P4 -","- Cl44 N12 P16 -","4","1","","Eric Rivard; Alan J. Lough; Ian Manners","A New, Convenient Synthesis of the Linear Phosphazene Salt [Cl3PNPCl3]Cl: Preparation of Higher Linear Homologues [Cl3PN-(PCl2N)xPCl3]Cl (x= 1-3) and the 16-Membered Macrocycle [NCCl(NPCl2)3]2","Inorganic Chemistry","2004","43","","2765","2767","10.1021/ic049955z","","","0.71073","MoKα","","0.1607","0.109","","","0.2732","0.2917","","","","","","1.062","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4311244","11.227","0.004","11.267","0.004","16.09","0.006","90","","103.75","0.004","90","","1977","1.2","110","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C21 H18 Cl2 Co N4 O -","- C21 H18 Cl2 Co N4 O -","- C84 H72 Cl8 Co4 N16 O4 -","4","1","","Shinya Hayami; Koichiro Hashiguchi; Gergely Juhász; Masaaki Ohba; Hisashi Ōkawa; Yonezo Maeda; Kenichi Kato; Keiichi Osaka; Masaki Takata; Katsuya Inoue","1-D Cobalt(II) Spin Transition Compound with Strong Interchain Interaction: [Co(pyterpy)Cl2].X","Inorganic Chemistry","2004","43","","4124","4126","10.1021/ic049509b","","","0.7107","MoKα","","","0.0308","","","","0.0898","","","","","","0.77","","","","has coordinates","193981","2020-10-21","18:00:00",""
"4311434","17.3156","0.0014","8.098","0.0006","25.702","0.003","90","","118.058","0.007","90","","3180.4","0.5","153","2","153","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C66.5 H66 Fe4 N4 O14.5 -","- C66.5 H66 Fe4 N4 O14.5 -","- C133 H132 Fe8 N8 O29 -","2","0.5","","Colette Boskovic; Andreas Sieber; Grégory Chaboussant; Hans U. Güdel; Jürgen Ensling; Wolfgang Wernsdorfer; Antonia Neels; Gael Labat; Helen Stoeckli-Evans; Stefan Janssen","Synthesis and Characterization of a New Family of Bi-, Tri-, Tetra-, and Pentanuclear Ferric Complexes","Inorganic Chemistry","2004","43","","5053","5068","10.1021/ic049600f","","","0.71073","MoKα","","0.0724","0.0398","","","0.0928","0.1013","","","","","","0.867","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4311628","9.063","0.0014","9.3867","0.0015","29.189","0.004","90","","90.148","0.003","90","","2483.1","0.6","100","2","100","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C42 H44 Cl2 Cu2 F12 N10 O P2 -","- C42 H44 Cl2 Cu2 F12 N10 O P2 -","- C84 H88 Cl4 Cu4 F24 N20 O2 P4 -","2","0.5","","Baldo Lucchese; Kristi J. Humphreys; Dong-Heon Lee; Christopher D. Incarvito; Roger D. Sommer; Arnold L. Rheingold; Kenneth D. Karlin","Mono-, Bi-, and Trinuclear CuII-Cl Containing Products Based on the Tris(2-pyridylmethyl)amine Chelate Derived from Copper(I) Complex Dechlorination Reactions of Chloroform","Inorganic Chemistry","2004","43","","5987","5998","10.1021/ic0497477","","","0.71073","MoKα","","0.0738","0.0664","","","0.1763","0.1819","","","","","","1.306","","","","has coordinates","179155","2020-10-21","18:00:00",""
"4311765","10.1763","0.0004","11.1598","0.0004","14.8557","0.0005","90","","107.035","0.001","90","","1613.07","0.1","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C32 H28 Cu3 N4 O18 -","- C32 H28 Cu3 N4 O18 -","- C64 H56 Cu6 N8 O36 -","2","0.5","","E Yang; Jian Zhang; Zhao-Ji Li; Song Gao; Yao Kang; Yu-Biao Chen; Yi-Hang Wen; Yuan-Gen Yao","Interweaving 3D Network with Double Helical Tubes Filled by 1D Coordination Polymer Chains","Inorganic Chemistry","2004","43","","6525","6527","10.1021/ic049363g","","","0.71073","MoKα","","","0.0417","","","0.1071","0.1172","","","","","","1.068","","","","has coordinates","179156","2020-10-21","18:00:00",""
"4311985","11.3723","0.0012","8.4284","0.0009","19.977","0.002","90","","93.289","0.002","90","","1911.6","0.3","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C30 H44 Cl2 N6 O2 Pd2 S6 -","- C30 H44 Cl2 N6 O2 Pd2 S6 -","- C60 H88 Cl4 N12 O4 Pd4 S12 -","2","0.5","","Md. Alamgir Hossain; Simone Lucarini; Douglas Powell; Kristin Bowman-James","Ditopic Double Pincer Palladacycle Catalyst for C-C Coupling","Inorganic Chemistry","2004","43","","7275","7277","10.1021/ic0489645","","","0.71073","MoKα","","0.0378","0.0345","","","0.1013","0.104","","","","","","1.04","","","","has coordinates","179158","2020-10-21","18:00:00",""
"4312048","15.846","0.003","11.452","0.002","23.008","0.005","90","","92.77","0.03","90","","4170.3","1.4","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C36 H56 Co N4 O10 P2 -","- C36 H56 Co N4 O10 P2 -","- C144 H224 Co4 N16 O40 P8 -","4","1","","Ramasamy Pothiraja; Malaichamy Sathiyendiran; Ray J. Butcher; Ramaswamy Murugavel","Cobalt and Manganese Nets via Their Wires: Facile Transformation in Metal-Diorganophosphates","Inorganic Chemistry","2004","43","","7585","7587","10.1021/ic048781i","","","0.71073","MoKα","","0.1512","0.0954","","","0.2337","0.2597","","","","","","1.022","","","","has coordinates","179159","2020-10-21","18:00:00",""
"4312049","15.9627","0.0014","11.7157","0.0012","23.502","0.002","90","","92.783","0.008","90","","4390","0.7","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","Mn(dtbp)2(44'-bpy)(H2O)2","","","- C36 H56 Mn N4 O10 P2 -","- C36 H56 Mn N4 O10 P2 -","- C144 H224 Mn4 N16 O40 P8 -","4","1","","Ramasamy Pothiraja; Malaichamy Sathiyendiran; Ray J. Butcher; Ramaswamy Murugavel","Cobalt and Manganese Nets via Their Wires: Facile Transformation in Metal-Diorganophosphates","Inorganic Chemistry","2004","43","","7585","7587","10.1021/ic048781i","","","0.71073","MoKα","","0.0686","0.0455","","","0.1301","0.1369","","","","","","1.098","","","","has coordinates","179159","2020-10-21","18:00:00",""
"4312077","12.278","0.001","9.287","0.001","21.823","0.002","90","","104.413","0.006","90","","2410.1","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C21 H21 Cl3 N3 P3 -","- C21 H21 Cl3 N3 P3 -","- C84 H84 Cl12 N12 P12 -","4","1","","June-Ho Jung; Srinagesh K. Potluri; Hongming Zhang; Patty Wisian-Neilson","Synthesis and Structure of Nongeminally Substituted Cyclic Phosphazenes with Haloalkyl and Thioester Functional Groups","Inorganic Chemistry","2004","43","","7784","7791","10.1021/ic049063z","","","0.71073","MoKα","","0.053","0.038","","","0.1","0.106","","","","","","1.03","","","","has coordinates,has disorder","179159","2020-10-21","18:00:00",""
"4312094","20.865","0.005","10.814","0.003","27.785","0.005","90","","126.53","0.012","90","","5038","2","90","2","90","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","[(2,6-xylylisocyanide)2Fe(OEOP)]PF6.0.15CHCl3","","","- C53.15 H61.15 Cl0.45 F6 Fe N O P -","- C53.15 H61.15 Cl0.45 F6 Fe N6 O P -","- C212.6 H244.6 Cl1.8 F24 Fe4 N24 O4 P4 -","4","1","","Sankar Prasad Rath; Marilyn M. Olmstead; Alan L. Balch","Oxidative Verdoheme Formation and Stabilization by Axial Isocyanide Ligation","Inorganic Chemistry","2004","43","","7648","7655","10.1021/ic0491433","","","0.71073","MoKα","","0.1249","0.085","","","0.2041","0.2224","","","","","","1.062","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4312171","11.32","0.02","11.41","0.005","22.795","0.018","90","","92.951","0.014","90","","2940","6","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C64 H50 Co3 N6 O24 -","- C64 H50 Co3 N6 O24 -","- C128 H100 Co6 N12 O48 -","2","0.5","","Jian Zhang; Zhao-Ji Li; Yao Kang; Jian-Kai Cheng; Yuan-Gen Yao","Hydrothermal Syntheses, Crystal Structures, and Properties of a Novel Class of 3,3',4,4'-Benzophenone-tetracarboxylate (BPTC) Polymers","Inorganic Chemistry","2004","43","","8085","8091","10.1021/ic0491074","","","0.71073","MoKα","","","0.0501","","","0.1118","0.1225","","","","","","1.05","","","","has coordinates","179160","2020-10-21","18:00:00",""
"4312536","17.603","0.002","7.4777","0.0007","17.582","0.002","90","","35.096","0.004","90","","1330.6","0.3","100","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H30 Br2 Cu N8 O4 -","- C20 H30 Br2 Cu N8 O4 -","- C40 H60 Br4 Cu2 N16 O8 -","2","0.5","","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","","","0.0673","","","","0.1913","","","","","","1.513","","","","has coordinates","193981","2020-10-21","18:00:00",""
"4312624","15.6671","0.0004","12.6092","0.0004","21.6432","0.0008","90","","108.412","0.002","90","","4056.7","0.2","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C40 H42 Ag In P2 S4 -","- C40 H42 Ag In P2 S4 -","- C160 H168 Ag4 In4 P8 S16 -","4","1","","Kulbinder K. Banger; Michael H.-C. Jin; Jerry D. Harris; Philip E. Fanwick; Aloysius F. Hepp","A New Facile Route for the Preparation of Single-Source Precursors for Bulk, Thin-Film, and Nanocrystallite I-III-VI Semiconductors","Inorganic Chemistry","2003","42","","7713","7715","10.1021/ic034802h","","","0.71073","MoKα","","0.0934","0.0389","","","0.0759","0.0887","","","","","","0.857","","","","has coordinates","179165","2020-10-21","18:00:00",""
"4312719","27.9447","0.0004","13.5745","0.0002","19.5747","0.0002","90","","108.63","0.0006","90","","7036.31","0.16","150","2","150","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C33 H34.5 Eu O18.75 -","- C33 H21 Eu O18.75 -","- C264 H168 Eu8 O150 -","8","2","","Patrice M. T. Piggot; Lincoln A. Hall; Andrew J. P. White; David J. Williams","Attempted Syntheses of Lanthanide(III) Complexes of the Anisole- and Anilinosquarate Ligands","Inorganic Chemistry","2003","42","","8344","8352","10.1021/ic034922p","","","0.71073","MoKα","","0.0789","0.0429","","0.1247","0.1034","","","","1.064","1.136","1.136","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4312720","27.9313","0.0005","13.5738","0.0003","19.5825","0.0003","90","","108.652","0.0009","90","","7034.4","0.2","150","2","150","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C33 H34.5 Gd O18.75 -","- C33 H21 Gd O18.75 -","- C264 H168 Gd8 O150 -","8","2","","Patrice M. T. Piggot; Lincoln A. Hall; Andrew J. P. White; David J. Williams","Attempted Syntheses of Lanthanide(III) Complexes of the Anisole- and Anilinosquarate Ligands","Inorganic Chemistry","2003","42","","8344","8352","10.1021/ic034922p","","","0.71073","MoKα","","0.1262","0.0649","","0.1473","0.1264","","","","1.175","1.344","1.344","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4312760","17.768","0.002","11.568","0.002","21.966","0.004","90","","98.6","0.01","90","","4464.1","1.2","290","2","290","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H52 La2 N10 O26 -","- C23.99 H52 La2 N10 O26 -","- C95.96 H208 La8 N40 O104 -","4","1","","Xiaofeng Li; Weisheng Liu; Zhijun Guo; Minyu Tan","Trinuclear to Dinuclear: A Radii Dependence Lanthanide(III) Self-Assembly Coordination Behavior of an Amide-Type Tripodal Ligand","Inorganic Chemistry","2003","42","","8735","8738","10.1021/ic034268d","","","0.71073","MoKα","","0.0487","0.0333","","","0.0796","0.0835","","","","","","1.055","","","","has coordinates,has disorder","179166","2020-10-21","18:00:00",""
"4312877","12.17","0.004","8.977","0.003","27.891","0.005","90","","99.88","0.03","90","","3001.9","1.5","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C16 H41 Dy N4 Na2 O17 -","- C16 Dy N4 Na2 O18 -","- C64 Dy4 N16 Na8 O72 -","4","1","","F. Benetollo; Gabriella Bombieri; L. Calabi; S. Aime; M. Botta","Structural Variations Across the Lanthanide Series of Macrocyclic DOTA Complexes: Insights into the Design of Contrast Agents for Magnetic Resonance Imaging","Inorganic Chemistry","2003","42","","148","157","10.1021/ic025790n","","","0.71073","MoKα","","0.066","0.0642","","","0.1647","0.1676","","","","","","1.131","","","","has coordinates","179167","2020-10-21","18:00:00",""
"4313323","7.1904","0.0004","11.4396","0.0006","20.2455","0.001","90","","90.681","0.002","90","","1665.18","0.15","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H42 I2 N8 O6 -","- C26 H42 I2 N8 O6 -","- C52 H84 I4 N16 O12 -","2","0.5","","Md. Alamgir Hossain; Sung Ok Kang; Douglas Powell; Kristin Bowman-James","Anion Receptors: A New Class of Amide/Quaternized Amine Macrocycles and the Chelate Effect","Inorganic Chemistry","2003","42","","1397","1399","10.1021/ic0263140","","","0.71073","MoKα","","0.03","0.0281","","","0.0726","0.0738","","","","","","0.973","","","","has coordinates","179191","2020-10-21","18:00:00",""
"4313439","13.7063","0.0004","12.4103","0.0004","30.2541","0.0008","90","","92.781","0.002","90","","5140.1","0.3","180","2","180","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C35 H40.5 Cl2 Gd0.5 N12 Ni O15 -","- C35 H40.5 Cl2 Gd0.5 N12 Ni O15 -","- C140 H162 Cl8 Gd2 N48 Ni4 O60 -","4","1","","Zheng He; Cheng He; En-Qing Gao; Zhe-Ming Wang; Xiao-Fan Yang; Chun-Sheng Liao; Chun-Hua Yan","Lanthanide-Transition Heterometallic Extended Structures with Novel Orthogonal Metalloligand as Building Block","Inorganic Chemistry","2003","42","","2206","2208","10.1021/ic026271n","","","0.71073","MoKα","","0.1168","0.0814","","","0.2173","0.247","","","","","","1.079","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4313440","13.7842","0.0003","12.4662","0.0004","30.2055","0.0011","90","","92.7503","0.0018","90","","5184.4","0.3","180","2","180","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C35 H41 Cl2 N12 Ni O15 Tb0.5 -","- C35 H41 Cl2 N12 Ni O15 Tb0.5 -","- C140 H164 Cl8 N48 Ni4 O60 Tb2 -","4","1","","Zheng He; Cheng He; En-Qing Gao; Zhe-Ming Wang; Xiao-Fan Yang; Chun-Sheng Liao; Chun-Hua Yan","Lanthanide-Transition Heterometallic Extended Structures with Novel Orthogonal Metalloligand as Building Block","Inorganic Chemistry","2003","42","","2206","2208","10.1021/ic026271n","","","0.71073","MoKα","","0.1013","0.0783","","","0.22","0.2376","","","","","","1.096","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4313563","9.979","0.002","9.886","0.002","15.298","0.003","90","","102.86","0.03","90","","1471.3","0.5","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C12 H9 N2 O7.5 P V2 -","- C12 H9 N2 O7.5 P V2 -","- C48 H36 N8 O30 P4 V8 -","4","1","","Chao Qin; Lin Xu; Yongge Wei; Xinlong Wang; Fengyan Li","New Vanadium Phosphate {[(phen)VIVO]2(VV2O5)(HPO4)}n with Chiral Layer Architecture","Inorganic Chemistry","2003","42","","3107","3110","10.1021/ic026256i","","","0.71073","MoKα","","0.1123","0.0611","","","0.1332","0.154","","","","","","1.012","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4313614","10.9649","0.0006","12.3442","0.0007","16.9844","0.001","90","","95.405","0.001","90","","2288.7","0.2","90","2","90","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","(i-PrNC)AuCN*0.5CH2CL2","","","- C5.5 H8 Au Cl N2 -","- C7.75 H10.5 Au1.5 Cl0.5 N3 -","- C62 H84 Au12 Cl4 N24 -","8","2","","Rochelle L. White-Morris; Matthias Stender; Dino S. Tinti; Alan L. Balch; Daniel Rios; Saeed Attar","New Structural Motifs in the Aggregation of Neutral Gold(I) Complexes: Structures and Luminescence from (Alkyl isocyanide)AuCN","Inorganic Chemistry","2003","42","","3237","3244","10.1021/ic0206948","","","0.71073","MoKα","","0.041","0.0313","","","0.0808","0.0852","","","","","","1.043","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4313766","10.9226","0.0007","13.1641","0.0008","27.1563","0.0018","90","","95.519","0.002","90","","3886.6","0.4","190","2","190","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C31 H33 Ag2 B2 F8 N13 O4 -","- C31 H33 Ag2 B2 F8 N13 O4 -","- C124 H132 Ag8 B8 F32 N52 O16 -","4","1","","Daniel L. Reger; Radu F. Semeniuc; Ioan Silaghi-Dumitrescu; Mark D. Smith","Influences of Changes in Multitopic Tris(pyrazolyl)methane Ligand Topology on Silver(I) Supramolecular Structures","Inorganic Chemistry","2003","42","","3751","3764","10.1021/ic034039r","","","0.71073","MoKα","","0.1054","0.0527","","","0.0868","0.1067","","","","","","1.013","","","","has coordinates,has disorder","179202","2020-10-21","18:00:00",""
"4314469","20.8927","0.0018","13.85","0.0012","20.9026","0.0018","90","","96.064","0.002","90","","6014.6","0.9","150","1","150","1","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C48 H52 Ag2 F6 N18 O10 S2 -","- C48 H52 Ag2 F6 N18 O10 S2 -","- C192 H208 Ag8 F24 N72 O40 S8 -","4","1","","Daniel L. Reger; Elizabeth A. Foley; Mark D. Smith","Structural Impact of Multitopic Third-Generation Bis(1-pyrazolyl)methane Ligands: Double, Mononuclear Metallacyclic Silver(I) Complexes","Inorganic Chemistry","2010","49","","234","242","10.1021/ic901899r","","","0.71073","MoKα","","0.0441","0.0398","","","0.1049","0.1074","","","","","","1.058","","","","has coordinates","179218","2020-10-21","18:00:00",""
"4314537","23.738","0.002","10.5976","0.00012","21.66","0.002","90","","105.239","0.002","90","","5257.3","0.7","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C51 H43 Cu3 N9 O17 Pr -","- C51 H43 Cu3 N9 O17 Pr -","- C204 H172 Cu12 N36 O68 Pr4 -","4","1","","Qi-Bing Bo; Guo-Xin Sun; Dong-Ling Geng","Novel Three-Dimensional Pillared-Layer Ln(III)-Cu(I) Coordination Polymers Featuring Spindle-Shaped Heterometallic Building Units","Inorganic Chemistry","2010","49","","561","571","10.1021/ic901730f","","","0.71073","MoKα","","0.0473","0.0331","","","0.0817","0.0902","","","","","","1.002","","","","has coordinates","179221","2020-10-21","18:00:00",""
"4314538","23.68","0.002","10.5601","0.00012","21.642","0.002","90","","105.406","0.002","90","","5217.4","0.7","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C51 H43 Cu3 N9 Nd O17 -","- C51 H43 Cu3 N9 Nd O17 -","- C204 H172 Cu12 N36 Nd4 O68 -","4","1","","Qi-Bing Bo; Guo-Xin Sun; Dong-Ling Geng","Novel Three-Dimensional Pillared-Layer Ln(III)-Cu(I) Coordination Polymers Featuring Spindle-Shaped Heterometallic Building Units","Inorganic Chemistry","2010","49","","561","571","10.1021/ic901730f","","","0.71073","MoKα","","0.0743","0.0426","","","0.0986","0.1181","","","","","","1.004","","","","has coordinates","179221","2020-10-21","18:00:00",""
"4314539","23.657","0.002","10.5149","0.0011","21.695","0.002","90","","105.124","0.001","90","","5209.7","0.8","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C51 H41 Cu3 N9 O16 Sm -","- C51 H41 Cu3 N9 O16 Sm -","- C204 H164 Cu12 N36 O64 Sm4 -","4","1","","Qi-Bing Bo; Guo-Xin Sun; Dong-Ling Geng","Novel Three-Dimensional Pillared-Layer Ln(III)-Cu(I) Coordination Polymers Featuring Spindle-Shaped Heterometallic Building Units","Inorganic Chemistry","2010","49","","561","571","10.1021/ic901730f","","","0.71073","MoKα","","0.1206","0.0982","","","0.2545","0.2672","","","","","","1.005","","","","has coordinates","179221","2020-10-21","18:00:00",""
"4314540","23.682","0.005","10.546","0.002","21.648","0.004","90","","105.28","0.03","90","","5215.5","1.9","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C51 H41 Cu3 Eu N9 O16 -","- C51 H41 Cu3 Eu N9 O16 -","- C204 H164 Cu12 Eu4 N36 O64 -","4","1","","Qi-Bing Bo; Guo-Xin Sun; Dong-Ling Geng","Novel Three-Dimensional Pillared-Layer Ln(III)-Cu(I) Coordination Polymers Featuring Spindle-Shaped Heterometallic Building Units","Inorganic Chemistry","2010","49","","561","571","10.1021/ic901730f","","","0.71073","MoKα","","0.0359","0.0282","","","0.0685","0.0718","","","","","","1.001","","","","has coordinates","179221","2020-10-21","18:00:00",""
"4314541","23.55","0.005","10.4","0.002","21.53","0.004","90","","105.03","0.03","90","","5092.7","1.9","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C51 H41 Cu3 Gd N9 O16 -","- C51 H41 Cu3 Gd N9 O16 -","- C204 H164 Cu12 Gd4 N36 O64 -","4","1","","Qi-Bing Bo; Guo-Xin Sun; Dong-Ling Geng","Novel Three-Dimensional Pillared-Layer Ln(III)-Cu(I) Coordination Polymers Featuring Spindle-Shaped Heterometallic Building Units","Inorganic Chemistry","2010","49","","561","571","10.1021/ic901730f","","","0.71073","MoKα","","0.0508","0.0427","","","0.1316","0.1376","","","","","","1.006","","","","has coordinates","179221","2020-10-21","18:00:00",""
"4314542","23.66","0.003","10.5129","0.0011","21.702","0.002","90","","105.241","0.002","90","","5208.2","1","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C51 H41 Cu3 N9 O16 Tb -","- C51 H41 Cu3 N9 O16 Tb -","- C204 H164 Cu12 N36 O64 Tb4 -","4","1","","Qi-Bing Bo; Guo-Xin Sun; Dong-Ling Geng","Novel Three-Dimensional Pillared-Layer Ln(III)-Cu(I) Coordination Polymers Featuring Spindle-Shaped Heterometallic Building Units","Inorganic Chemistry","2010","49","","561","571","10.1021/ic901730f","","","0.71073","MoKα","","0.0774","0.0633","","","0.1784","0.1871","","","","","","0.999","","","","has coordinates","179221","2020-10-21","18:00:00",""
"4314543","23.593","0.002","10.4448","0.0012","21.641","0.002","90","","105.175","0.002","90","","5146.9","0.9","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C51 H41 Cu3 Er N9 O16 -","- C51 H41 Cu3 Er N9 O16 -","- C204 H164 Cu12 Er4 N36 O64 -","4","1","","Qi-Bing Bo; Guo-Xin Sun; Dong-Ling Geng","Novel Three-Dimensional Pillared-Layer Ln(III)-Cu(I) Coordination Polymers Featuring Spindle-Shaped Heterometallic Building Units","Inorganic Chemistry","2010","49","","561","571","10.1021/ic901730f","","","0.71073","MoKα","","0.1164","0.0988","","","0.4074","0.4327","","","","","","1.004","","","","has coordinates","179221","2020-10-21","18:00:00",""
"4314544","23.586","0.002","10.4497","0.001","21.655","0.002","90","","105.252","0.002","90","","5149.2","0.8","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C51 H41 Cu3 N9 O16 Yb -","- C51 H41 Cu3 N9 O16 Yb -","- C204 H164 Cu12 N36 O64 Yb4 -","4","1","","Qi-Bing Bo; Guo-Xin Sun; Dong-Ling Geng","Novel Three-Dimensional Pillared-Layer Ln(III)-Cu(I) Coordination Polymers Featuring Spindle-Shaped Heterometallic Building Units","Inorganic Chemistry","2010","49","","561","571","10.1021/ic901730f","","","0.71073","MoKα","","0.0482","0.0321","","","0.0689","0.0754","","","","","","1.046","","","","has coordinates","179221","2020-10-21","18:00:00",""
"4314548","20.787","0.0004","18.319","0.0004","31.128","0.0007","90","","117.073","0.001","90","","10554.6","0.4","180","2","180","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C96 H214 F84 Mn12 N20 O49 P14 -","- C96 H214 F84 Mn12 N20 O49 P14 -","- C192 H428 F168 Mn24 N40 O98 P28 -","2","0.5","","Juan Modesto Clemente-Juan; Eugenio Coronado; Alicia Forment-Aliaga; Alejandro Gaita-Ariño; Carlos Giménez-Saiz; Francisco M. Romero; Wolfgang Wernsdorfer; R. Biagi; V. Corradini","Electronic and Magnetic Study of Polycationic Mn12 Single-Molecule Magnets with a Ground Spin State S = 11","Inorganic Chemistry","2010","49","","386","396","10.1021/ic901824d","","","0.71069","MoKα","","0.1304","0.0853","","","0.2284","0.2723","","","","","","1.05","","","","has coordinates,has disorder","192782","2020-10-21","18:00:00",""
"4314610","16.85","0.02","11.236","0.015","22.86","0.02","90","","125.46","0.07","90","","3525","8","293","2","293","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C30 H36 Ag5 N6 Na8 O45 P W10 -","- C30 H24 Ag5 N6 Na8 O42 P W10 -","- C60 H48 Ag10 N12 Na16 O84 P2 W20 -","2","0.5","","Hongxun Yang; Shuiying Gao; Jian Lü; Bo Xu; Jingxiang Lin; Rong Cao","pH-Dependent Syntheses and Crystal Structures of a Series of Organic-Inorganic Hybrids Constructed from Keggin or Wells-Dawson Polyoxometalates and Silver Coordination Compounds","Inorganic Chemistry","2010","49","","736","744","10.1021/ic902091p","","","0.71073","MoKα","","0.0756","0.0695","","","0.1258","0.1532","","","","","","1.066","","","","has coordinates","179224","2020-10-21","18:00:00",""
"4315292","16.861","0.002","13.264","0.002","16.692","0.003","90","","118.361","0.005","90","","3285","0.9","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C34 H55 F18 N7 O26 S6 U2 -","- C34 H55 F18 N7 O26 S6 U2 -","- C68 H110 F36 N14 O52 S12 U4 -","2","0.5","","Peter Nockemann; Rik Van Deun; Ben Thijs; Diederik Huys; Evert Vanecht; Kristof Van Hecke; Luc Van Meervelt; Koen Binnemans","Uranyl Complexes of Carboxyl-Functionalized Ionic Liquids","Inorganic Chemistry","2010","49","","3351","3360","10.1021/ic902406h","","","1.54178","CuKα","","0.1043","0.0714","","","0.179","0.1992","","","","","","1.035","","","","has coordinates,has disorder","179232","2020-10-21","18:00:00",""
"4315358","11.3474","0.001","13.0436","0.0011","26.76","0.002","90","","97.69","0.001","90","","3925.2","0.6","","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C75 H114 B2 Fe2 N12 O6 -","- C75 H114 B2 Fe2 N12 O6 -","- C150 H228 B4 Fe4 N24 O12 -","2","0.5","","Anusree Mukherjee; Matthew A. Cranswick; Mrinmoy Chakrabarti; Tapan K. Paine; Kiyoshi Fujisawa; Eckard Münck; Lawrence Que","Oxygen Activation at Mononuclear Nonheme Iron Centers: A Superoxo Perspective","Inorganic Chemistry","2010","49","","3618","3628","10.1021/ic901891n","","","","","","","","","","","","","","","","","","","","","has coordinates","179233","2020-10-21","18:00:00",""
"4315592","12.504","0.0013","8.6925","0.0009","16.307","0.0016","90","","99.148","0.009","90","","1749.9","0.3","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C14 H23 Au Cl N3 O2 -","- C14 H23 Au Cl N3 O2 -","- C56 H92 Au4 Cl4 N12 O8 -","4","1","","Chandrakanta Dash; Mobin M. Shaikh; Ray J. Butcher; Prasenjit Ghosh","Highly Convenient Regioselective Intermolecular Hydroamination of Alkynes Yielding Ketimines Catalyzed by Gold(I) Complexes of 1,2,4-triazole Based N-heterocyclic Carbenes","Inorganic Chemistry","2010","49","","4972","4983","10.1021/ic100087d","","","0.71073","MoKα","","0.0601","0.0508","","","0.1249","0.1298","","","","","","1.092","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4316263","27.851","0.007","9.717","0.003","17.162","0.005","90","","94.182","0.015","90","","4632","2","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C42 H72 Cl N2 O4 V -","- C42 H72 Cl N2 O4 V -","- C168 H288 Cl4 N8 O16 V4 -","4","1","","Sónia Barroso; Pedro Adão; Filipe Madeira; M. Teresa Duarte; João Costa Pessoa; Ana M. Martins","Vanadium Diaminebis(phenolate) Complexes: Syntheses, Structures, and Reactivity in Sulfoxidation Catalysis","Inorganic Chemistry","2010","49","","7452","7463","10.1021/ic1007704","","x-ray","0.71073","MoKα","","0.1693","0.0934","","","0.2368","0.2668","","","","","","1.04","","","","has coordinates","179242","2020-10-21","18:00:00",""
"4316613","20.584","0.003","9.0773","0.0013","19.137","0.003","90","","117.604","0.011","90","","3168.7","0.9","95","2","95","2","","","","","","","synthetical product","5","P 1 2/c 1","-P 2yc","13","","bis[4-[2-methyl-phenyl-imino-kappa-N]-2-pentanonato-kappa-O]bis[tert- butylaminato]-molybdenum(VI)","","- C32 H46 Mo N4 O2 -","- C32 H46 Mo N4 O2 -","- C128 H184 Mo4 N16 O8 -","4","1","","Nadia C. Mösch-Zanetti; Dietmar Wurm; Manuel Volpe; Ganna Lyashenko; Bastian Harum; Ferdinand Belaj; Judith Baumgartner","Replacement of an Oxo by an Imido Group in Oxotransferase Model Compounds: Influence on the Oxygen Atom Transfer","Inorganic Chemistry","2010","49","","8914","8921","10.1021/ic101159g","","","0.71069","MoKα","","0.0516","0.0416","","","0.0871","0.0916","","","","","","1.075","","","","has coordinates","179246","2020-10-21","18:00:00",""
"4316886","17.6307","0.0016","8.0827","0.0007","18.1802","0.0017","90","","94.918","0.002","90","","2581.2","0.4","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C22 H26 Br2 Cl Mn N4 O6 -","- C22 H26 Br2 Cl Mn N4 O6 -","- C88 H104 Br8 Cl4 Mn4 N16 O24 -","4","1","","Shi Wang; Marilena Ferbinteanu; Crina Marinescu; Alexandra Dobrinescu; Qi-Dan Ling; Wei Huang","Case Study on a Rare Effect: The Experimental and Theoretical Analysis of a Manganese(III) Spin-Crossover System","Inorganic Chemistry","2010","49","","9839","9851","10.1021/ic100364v","","","0.71073","MoKα","","0.0774","0.0347","","","0.0647","0.0922","","","","","","0.797","","","","has coordinates","179248","2020-10-21","18:00:00",""
"4316887","17.829","0.003","8.2279","0.0018","18.136","0.004","90","","94.073","0.012","90","","2653.7","0.9","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C22 H26 Br2 Cl Mn N4 O6 -","- C22 H26 Br2 Cl Mn N4 O6 -","- C88 H104 Br8 Cl4 Mn4 N16 O24 -","4","1","","Shi Wang; Marilena Ferbinteanu; Crina Marinescu; Alexandra Dobrinescu; Qi-Dan Ling; Wei Huang","Case Study on a Rare Effect: The Experimental and Theoretical Analysis of a Manganese(III) Spin-Crossover System","Inorganic Chemistry","2010","49","","9839","9851","10.1021/ic100364v","","","0.71073","MoKα","","0.0997","0.056","","","0.1066","0.1251","","","","","","1.055","","","","has coordinates","179248","2020-10-21","18:00:00",""
"4317505","14.002","0.003","4.8064","0.001","9.274","0.003","90","","90.5","0.02","90","","624.1","0.3","296","2","296","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Co[O2C(CH2)3CO2]","cobalt glutarate","","- C5 H6 Co O4 -","- C5 H6 Co O4 -","- C20 H24 Co4 O16 -","4","1","","Lee; Kim; Duk-Young Jung","A Coordination Polymer of Cobalt(II)-Glutarate: Two-Dimensional Interlocking Structure by Dicarboxylate Ligands with Two Different Conformations","Inorganic Chemistry","2002","41","","501","506","10.1021/ic010861o","","","0.71073","MoKα","","0.0566","0.048","","0.1601","0.1316","","","","1.078","1.086","1.086","","","","","has coordinates","179255","2020-10-21","18:00:00",""
"4317827","9.121","0.001","8.346","0.001","25.133","0.004","90","","96.3","0.01","90","","1901.7","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H42 Ca N8 O21 -","- C26 H42 Ca N8 O21 -","- C52 H84 Ca2 N16 O42 -","2","0.5","","Geeta Hundal; Maninder Singh Hundal; Sangeeta Obrai; N. S. Poonia; Subodh Kumar","Metal Complexes of Tetrapodal Ligands: Synthesis, Spectroscopic and Thermal Studies, and X-ray Crystal Structure Studies of Na(I), Ca(II), Sr(II), and Ba(II) Complexes of Tetrapodal Ligands N,N,N',N'-Tetrakis(2-hydroxypropyl)ethylenediamine and N,N,N',N'-Tetrakis(2-hydroxyethyl)ethylenediamine","Inorganic Chemistry","2002","41","","2077","2086","10.1021/ic0100727","","","0.71073","MoKα","","0.0698","0.0555","","0.1924","0.1413","","","","0.895","0.923","0.923","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4317961","10.8441","0.0008","9.2669","0.0006","20.9735","0.0013","90","","117.528","0.001","90","","1869","0.2","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C32 H55 N O3 Re2 S4 -","- C32 H55 N O3 Re2 S4 -","- C64 H110 N2 O6 Re4 S8 -","2","0.5","","James H. Espenson; Xiaopeng Shan; Ying Wang; Ruili Huang; David W. Lahti; JaNeille Dixon; Gábor Lente; Arkady Ellern; Ilia A. Guzei","Synthesis and Characterization of Dimetallic Oxorhenium(V) and Dioxorhenium(VII) Compounds, and a Study of Stoichiometric and Catalytic Reactions","Inorganic Chemistry","2002","41","","2583","2591","10.1021/ic011287j","","","0.71073","MoKα","","0.0354","0.0293","","","0.0855","0.0887","","","","","","1.005","","","","has coordinates","179259","2020-10-21","18:00:00",""
"4318113","16.725","0.002","11.7601","0.0017","40.348","0.006","90","","93.105","0.002","90","","7924.3","1.9","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","none","Tris(tetrabutylammonium) bis(ethanedithiolato)-(mu-4-sulfido) -bis(mu-3-dulfido)-hexakis(mu-2-sulfido)-tetra-iron-di-molybdenum","","- C55 H123 Fe4 Mo2 N4 O S13 -","- C55 H123 Fe4 Mo2 N4 O S13 -","- C220 H492 Fe16 Mo8 N16 O4 S52 -","4","1","","Hong-Cai Zhou; Weiping Su; Catalina Achim; P. Venkateswara Rao; R. H. Holm","High-Nuclearity Sulfide-Rich Molybdenum-Iron-Sulfur Clusters: Reevaluation and Extension","Inorganic Chemistry","2002","41","","3191","3201","10.1021/ic0201250","","","0.71073","MoKα","","0.0921","0.0654","","","0.132","0.1438","","","","","","1.134","","","","has coordinates","179261","2020-10-21","18:00:00",""
"4318529","12.2495","0.0002","10.5022","0.0001","24.4441","0.0005","90","","90.8997","0.0008","90","","3144.27","0.09","200","1","200","1","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C18 H38 Cl2 N2 O11 S5 Zn -","- C18 H38 Cl2 N2 O11 S5 Zn -","- C72 H152 Cl8 N8 O44 S20 Zn4 -","4","1","","Magdalena M. Makowska-Grzyska; Peter C. Jeppson; Russell A. Allred; Atta M. Arif; Lisa M. Berreau","Modeling Substrate- and Inhibitor-Bound Forms of Liver Alcohol Dehydrogenase: Chemistry of Mononuclear Nitrogen/Sulfur-Ligated Zinc Alcohol, Formamide, and Sulfoxide Complexes","Inorganic Chemistry","2002","41","","4872","4887","10.1021/ic0255609","","","0.71073","MoKα","","0.0511","0.0394","","","0.0897","0.0956","","","","","","1.026","","","","has coordinates,has disorder","179265","2020-10-21","18:00:00",""
"4319271","27.744","0.005","12.806","0.003","34.244","0.008","90","","92.445","0.013","90","","12155","5","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C16 H31 N O2 Si2 -","- C16 H31 N O2 Si2 -","- C384 H744 N24 O48 Si48 -","24","6","","Vadapalli Chandrasekhar; Selvarajan Nagendran; Ramamoorthy Boomishankar; Raymond J. Butcher","Effect of Sterically Hindered Ligands on the Solid-State Structures of Organosilanediols Containing Si-N Bonds","Inorganic Chemistry","2001","40","","940","945","10.1021/ic000487c","","","0.71073","MoKα","","0.1888","0.0866","","","0.1953","0.2486","","","","","","0.991","","","","has coordinates","179272","2020-10-21","18:00:00",""
"4319946","8.9575","0.0019","3.6596","0.0007","16.2","0.003","90","","96.834","0.003","90","","527.28","0.18","193","2","193","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C2 H12 N14 O -","- C2 H12 N14 O -","- C4 H24 N28 O2 -","2","0.5","","Anton Hammerl; Thomas M. Klapötke; Heinrich Nöth; Marcus Warchhold; Gerhard Holl; Manfred Kaiser; Uldis Ticmanis","[N2H5]+2[N4C-NN-CN4]2-: A New High-Nitrogen High-Energetic Material","Inorganic Chemistry","2001","40","","3570","3575","10.1021/ic010063y","","","0.71073","MoKα","","0.065","0.0499","","","0.1286","0.1383","","","","","","1.05","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4320085","51.982","0.01","7.2749","0.0015","14.098","0.003","90","","105.67","0.03","90","","5133","2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","[bis(4,4'-dimethyl-2,2'-bipyridine)copper(II)bromide] hydroxide hydrate","","- C24 H36 Br Cu N4 O6.5 -","- C24 H24 Br Cu N4 O6.29 -","- C192 H192 Br8 Cu8 N32 O50.32 -","8","2","","Roger D. Willett; George Pon; Callie Nagy","Crystal Chemistry of the 4,4'-Dimethyl-2,2'bipyridine/Copper Bromide System","Inorganic Chemistry","2001","40","","4342","4352","10.1021/ic010229v","","","0.71073","MoKα","","0.1795","0.1235","","","0.316","0.3594","","","","","","0.965","","","","has coordinates","179303","2020-10-21","18:00:00",""
"4320086","13.39","0.003","7.4869","0.0015","14.449","0.003","90","","105.85","0.03","90","","1393.4","0.5","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","[bis(4,4'-dimethyl-2,2'-bipyridine)copper(II)bromide] bromide/hydroxide hydrate","","- C24 H35.06 Br1.94 Cu N4 O5.56 -","- C24 H24 Br1.88 Cu N4 O5.64 -","- C48 H48 Br3.76 Cu2 N8 O11.28 -","2","0.5","","Roger D. Willett; George Pon; Callie Nagy","Crystal Chemistry of the 4,4'-Dimethyl-2,2'bipyridine/Copper Bromide System","Inorganic Chemistry","2001","40","","4342","4352","10.1021/ic010229v","","","0.71073","MoKα","","0.0745","0.0588","","","0.1375","0.1484","","","","","","1.163","","","","has coordinates","179303","2020-10-21","18:00:00",""
"4320449","12.0087","0.0002","15.715","0.0003","21.8718","0.0002","90","","101.338","0.001","90","","4047.02","0.11","173","2","173","2","","","","","","","Changcheng Zhu","6","P 1 2/c 1","-P 2yc","13","","","","- C28 H36 As4 Mo12 Na3 O62 -","- C28 H36 As4 Mo12 Na3 O62 -","- C56 H72 As8 Mo24 Na6 O124 -","2","0.5","","Bret J. S. Johnson; Rick C. Schroden; Changcheng Zhu; Andreas Stein","Synthesis and Characterization of 2D and 3D Structures from Organic Derivatives of Polyoxometalate Clusters: Role of Organic Moiety, Counterion, and Solvent","Inorganic Chemistry","2001","40","","5972","5978","10.1021/ic010045g","","","0.71073","MoKα","","0.1066","0.0609","","","0.1385","0.1554","","","","","","1.008","","","","has coordinates","183806","2020-10-21","18:00:00",""
"4320691","12.433","0.003","16.348","0.003","24.774","0.005","90","","99.15","0.03","90","","4971.4","1.9","203","2","203","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C52 H73 Mo O7.5 -","- C52 H73 Mo O7.5 -","- C208 H292 Mo4 O30 -","4","1","","Udo Radius","Shaping the Cavity of the Macrocyclic Ligand in Metallocalix[4]arenes: The Role of the Ligand Sphere","Inorganic Chemistry","2001","40","","6637","6642","10.1021/ic010482v","","","0.71073","MoKα","","0.0773","0.0622","","","0.1681","0.1855","","","","","","1.063","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4320749","21.744","0.003","9.2435","0.0015","16.259","0.002","90","","93.58","0.009","90","","3261.5","0.8","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C24 H40 Cl2 N8 O7 Pd2 -","- C24 H40 Cl2 N8 O7 Pd2 -","- C96 H160 Cl8 N32 O28 Pd8 -","4","1","","Weijiang He; Fang Liu; Chunying Duan; Zijian Guo; Shaozhen Zhou; Yongjiang Liu; Longgen Zhu","Construction of a Square-Planar Molecular Box: Self-Assembly of Palladium(II) Complexes of 3,6,9,16,19,22-Hexaazatricyclo[22.2.2.211,14]triacon -11,13,24,26(1),27,29-hexaene through Hydrogen-Bonding Interactions","Inorganic Chemistry","2001","40","","7065","7071","10.1021/ic010101d","","","0.71073","MoKα","","0.1268","0.0722","","","0.1679","0.2042","","","","","","1.014","","","","has coordinates","179310","2020-10-21","18:00:00",""
"4321012","15.016","0.003","9.848","0.003","20.528","0.004","90","","104.854","0.016","90","","2934.2","1.2","298","","298","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C64 H56 P4 Pd2 S4 -","- C64 H56 P4 Pd2 S4 -","- C128 H112 P8 Pd4 S8 -","2","0.5","","Kuang-Hway Yih; Gene-Hsiang Lee; Yu Wang","Synthesis and Structural Characterization of Configurational Isomers of Tungsten-Palladium Complexes with Bridging Diphenyl(dithioalkoxycarbonyl)phosphine as a Ligand and Phosphine Transfer from Tungsten to Palladium","Inorganic Chemistry","2000","39","","2445","2451","10.1021/ic9904438","","","0.71073","MolybdenumKα","","0.054","0.034","","0.039","0.037","","","","","1.57","1.57","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321672","8.534","0.002","8.427","0.002","22.693","0.005","90","","96.92","0.03","90","","1620.1","0.7","90","2","90","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C27 H14 F12 N4 O8 Rh2 -","- C27 H11 F12 N4 O8 Rh2 -","- C54 H22 F24 N8 O16 Rh4 -","2","0.5","","Hitoshi Miyasaka; Cristian S. Campos-Fernández; José Ramón Galán-Mascarós; Kim R. Dunbar","One-Dimensional Assemblies of Dirhodium Units Bridged by N,N'-Dicyanoquinonediimine Ligands","Inorganic Chemistry","2000","39","","5870","5873","10.1021/ic0007097","","","0.71069","MoKα","","0.0345","0.0288","","","0.0711","0.0742","","","","","","1.015","","","","has coordinates,has disorder","179319","2020-10-21","18:00:00",""
"4321712","7.3318","0.0001","10.158","0.0001","14.8414","0.0003","90","","94.972","0.001","90","","1101.18","0.03","193","2","193","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","98277","","","- C28 H24 I P -","- C28 H24 I P -","- C56 H48 I2 P2 -","2","0.5","","Erik D. Brady; Timothy P. Hanusa; Maren Pink; Victor G. Young","The First Noncoordinated Phosphonium Diylide, [Me2P(C13H8)2]-, and Its Ylidic and Cationic Counterparts: Synthesis, Structural Characterization, and Interaction with the Heavy Group 2 Metals","Inorganic Chemistry","2000","39","","6028","6037","10.1021/ic000838n","","","0.71073","MoKα","","0.0256","0.0207","","","0.0539","0.0556","","","","","","1.013","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4322550","21.182","0.002","9.035","0.002","16.431","0.002","90","","121.637","0.01","90","","2677.2","0.8","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C10 H21 N3 Ni0.5 O5 -","- C10 H21 N3 Ni0.5 O5 -","- C80 H168 N24 Ni4 O40 -","8","2","","Hye Jin Choi; Myunghyun Paik Suh","Synthesis, Crystal Structure, and Properties of a 3-D Network Assembled by Nickel(II) Macrocyclic Complex and Terephthalato Bridge","Inorganic Chemistry","1999","38","","6309","6312","10.1021/ic990664d","","","0.71073","MoKα","","0.1819","0.0486","","0.1599","0.1045","","","","0.883","1.227","1.227","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322724","9.6","0.004","5.904","0.004","18.97","0.01","90","","101.09","0.03","90","","1055.1","1","193","2","193","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C16 H38 N4 P2 -","- C16 H38 N4 P2 -","- C32 H76 N8 P4 -","2","0.5","","Ingo Schranz; Lothar Stahl; Richard J. Staples","Polycyclic Bis(tert-butylamido)cyclodiphosph(III)azane Complexes of Lithium and Magnesium: Their Syntheses, Molecular Structures, and Relationships to Isoelectronic Cyclodisilazane Derivatives","Inorganic Chemistry","1998","37","","1493","1498","10.1021/ic971201f","","","0.71073","MoKα","","0.1027","0.0657","","0.1631","0.1452","","","","1.028","1.108","1.108","","","","","has coordinates","179330","2020-10-21","18:00:00",""
"4322844","12.958","0.003","8.437","0.003","17.25","0.002","90","","99.96","0.01","90","","1857.5","0.8","20","","20","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C36 H42 Fe N10 Ni O P -","- C72 H84 Fe2 N20 Ni2 O4 P2 -","- C72 H84 Fe2 N20 Ni2 O4 P2 -","","","","Masaaki Ohba; Naoki Usuki; Nobuo Fukita; Hisashi Ōkawa","Structure and Magnetic Properties of One-Dimensional PPh4[Ni(pn)2][M(CN)6].H2O (M = Fe, Cr, Co) Bimetallic Assemblies","Inorganic Chemistry","1998","37","","3349","3354","10.1021/ic9704748","","","0.7107","MoKalpha","","","0.075","","","0.064","","","","","4.4","4.4","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322845","12.927","0.002","8.454","0.002","17.564","0.002","90","","100.15","0.01","90","","1889.4","0.6","20","","20","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C36 H42 Cr N10 Ni O P -","- C72 H80 Cr2 N20 Ni2 O4 P2 -","- C72 H80 Cr2 N20 Ni2 O4 P2 -","","","","Masaaki Ohba; Naoki Usuki; Nobuo Fukita; Hisashi Ōkawa","Structure and Magnetic Properties of One-Dimensional PPh4[Ni(pn)2][M(CN)6].H2O (M = Fe, Cr, Co) Bimetallic Assemblies","Inorganic Chemistry","1998","37","","3349","3354","10.1021/ic9704748","","","0.7107","MoKalpha","","","0.034","","","0.026","","","","","3.21","3.21","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322846","12.971","0.001","8.437","0.001","17.118","0.001","90","","99.84","0.007","90","","1845.8","0.3","20","","20","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C36 H42 Co N10 Ni O P -","- C72 H80 Co2 N20 Ni2 O4 P2 -","- C72 H80 Co2 N20 Ni2 O4 P2 -","","","","Masaaki Ohba; Naoki Usuki; Nobuo Fukita; Hisashi Ōkawa","Structure and Magnetic Properties of One-Dimensional PPh4[Ni(pn)2][M(CN)6].H2O (M = Fe, Cr, Co) Bimetallic Assemblies","Inorganic Chemistry","1998","37","","3349","3354","10.1021/ic9704748","","","0.7107","MoKalpha","","","0.073","","","0.073","","","","","7.09","7.09","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4323102","16.9236","0.0001","13.5721","0.0002","22.3189","0.0001","90","","92.046","0.001","90","","5123.13","0.08","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- Cl Cs6 H14 Nb3 O49.5 P W9 -","- Cl Cs6 Nb3 O49.5 P W9 -","- Cl4 Cs24 Nb12 O198 P4 W36 -","4","1","","Mason K. Harrup; Gyu-Shik Kim; Huadong Zeng; Rhoma P. Johnson; Don VanDerveer; Craig L. Hill","Triniobium Polytungstophosphates. Syntheses, Structures, Clarification of Isomerism and Reactivity in the Presence of H2O2","Inorganic Chemistry","1998","37","","5550","5556","10.1021/ic980467z","","","0.71073","MoKα","","0.1054","0.0538","","0.1474","0.1313","","","","0.981","1.171","1.171","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4323429","13.372","0.002","9.198","0.003","16.872","0.002","90","","93.93","0.01","90","","2070.3","0.8","296","","296","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C33 H29 Cl3 N8 S4 Zn2 -","- C33 Cl8 N8 S4 Zn2 -","- C66 Cl16 N16 S8 Zn4 -","2","0.5","","Ren-Gen Xiong; Jing-Lin Zuo; Xiao-Zeng You","A Novel Dimeric Zinc Complex: Bis{μ-[(dimercaptomethylene)propanedinitrilato -S,S']}tetrakis(4-methylpyridine)dizinc(II)-Chloroform","Inorganic Chemistry","1997","36","","2472","2474","10.1021/ic951029k","","","0.71069","MoKalpha","","","0.045","","","0.06","","","","","1.56","1.56","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4323674","11.6059","0.0004","13.8415","0.0005","36.163","0.001","90","","95.03","","90","","5787","0.3","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C107.13 H88 Cl6 Cu2 P8 Ru2 -","- C107.12 H88 Cl6 Cu2 P8 Ru2 -","- C214.24 H176 Cl12 Cu4 P16 Ru4 -","2","0.5","","Yongbao Zhu; Michael O. Wolf; Glenn P. A. Yap","Copper(I) Halide Catalyzed Trans-Cis Isomerization of RuCl2(dppm)2 (dppm = Ph2PCH2PPh2)","Inorganic Chemistry","1997","36","","5483","5487","10.1021/ic9704187","","","0.71073","MoKα","","0.0689","0.0538","","0.174","0.1647","","","","1.066","1.177","1.177","","","","","has coordinates","179339","2020-10-21","18:00:00",""
"4323751","24.936","0.005","12.633","0.003","25.801","0.005","90","","102.86","0.03","90","","7924","3","298","2","183","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C79 H123 B Cl6 P4 Ru -","- C79 H122 B Cl6 P4 Ru -","- C316 H488 B4 Cl24 P16 Ru4 -","4","1","","Rainer F. Winter; Fridmann M. Hornung","The Square Pyramidal Hydride Cation [RuH(dcpe)2]+, dcpe = Bis(dicyclohexylphosphino)ethane. Structures of [RuH(dcpe)2]+[BPh4]-and of the Zwitterionic {(η6-C6H5)BPh3}RuH(dcpe)","Inorganic Chemistry","1997","36","","6197","6204","10.1021/ic970583m","","","0.71073","MoKα","","0.0981","0.062","","0.1694","0.142","","","","1.043","1.13","1.13","","","","","has coordinates,has disorder","179340","2020-10-21","18:00:00",""
"4324243","20.799","0.007","11.637","0.004","22.864","0.006","90","","122.99","0.02","90","","4642","3","296","2","296","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","polyaluminum sulphate","polyaluminum sulphate","","- Al13 H55 O56 S3 -","- Al13 H55 O56 S3 -","- Al52 H220 O224 S12 -","4","1","","Zhong Sun; Hui Wang; Hong-Ge-Er Tong; Shao-Fan Sun","A Giant Polyaluminum Species S-Al32 and Two Aluminum Polyoxocations Involving Coordination by Sulfate Ions S-Al32 and S-K-Al13","Inorganic Chemistry","2011","50","","559","564","10.1021/ic101875r","","","0.71073","MoKα","","0.221","0.0904","","","0.1378","0.1649","","","","","","1.059","","","","has coordinates,has disorder","200438","2020-10-21","18:00:00",""
"4324255","9.86","0.005","13.9285","0.0015","17.35","0.007","90","","116.33","0.002","90","","2135.6","1.4","123.15","","123.15","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","TMeOPP","TMeOPP","","- C48 H38 N4 O4 -","- C48 H38 N4 O4 -","- C96 H76 N8 O8 -","2","0.5","","Wentong Chen; Mohamed E. El-Khouly; Shunichi Fukuzumi","Saddle Distortion of a Sterically Unhindered Porphyrin Ring in a Copper Porphyrin with Electron-Donating Substituents","Inorganic Chemistry","2011","50","","671","678","10.1021/ic102208y","","","0.71073","MoKα","","0.1132","0.0726","","","0.1782","0.1976","","","","","","1.006","","","","has coordinates","179345","2020-10-21","18:00:00",""
"4324428","12.0948","0.0008","13.6017","0.0007","15.2096","0.0008","90","","100.467","0.002","90","","2460.5","0.2","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C50 H44 Cl2 I3 N4 P2 Rh -","- C50 H44 Cl2 I3 N4 P2 Rh -","- C100 H88 Cl4 I6 N8 P4 Rh2 -","2","0.5","","Sarat Chandra Patra; Manas Kumar Biswas; Amarendra Nath Maity; Prasanta Ghosh","Osazone Anion Radical Complex of Rhodium(III)","Inorganic Chemistry","2011","50","","1331","1338","10.1021/ic101945d","","","0.71073","MoKα","","0.0935","0.0663","","","0.1743","0.2048","","","","","","1.137","","","","has coordinates","179347","2020-10-21","18:00:00",""
"4324445","17.4021","0.0014","8.3403","0.0007","14.7111","0.0013","90","","111.581","0.009","90","","1985.5","0.3","173","2","173","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","diaminoguanidinium 2-methyl-5-nitriminotetrazolate","diaminoguanidinium 2-methyl-5-nitriminotetrazolate","","- C3 H11 N11 O2 -","- C3 H11 N11 O2 -","- C12 H44 N44 O8 -","4","1","","Tobias Fendt; Niko Fischer; Thomas M. Klapötke; Jörg Stierstorfer","N-Rich Salts of 2-Methyl-5-nitraminotetrazole: Secondary Explosives with Low Sensitivities","Inorganic Chemistry","2011","50","","1447","1458","10.1021/ic1019923","","","0.71073","MoKα","","0.0495","0.0328","","","0.0722","0.0759","","","","","","0.902","","","","has coordinates","179347","2020-10-21","18:00:00",""
"4324583","16.8182","0.0009","15.6847","0.0009","27.1407","0.0009","90","","127.083","0.002","90","","5711.5","0.5","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C139 H146 Cu2 N4 O P2 -","- C139 H146 Cu2 N4 O P2 -","- C278 H292 Cu4 N8 O2 P4 -","2","0.5","","Peter Haack; Christian Limberg; Kallol Ray; Beatrice Braun; Uwe Kuhlmann; Peter Hildebrandt; Christian Herwig","Dinuclear Copper Complexes Based on Parallel β-Diiminato Binding Sites and their Reactions with O2: Evidence for a Cu-O-Cu Entity","Inorganic Chemistry","2011","50","","2133","2142","10.1021/ic101249k","","","0.71073","MoKα","","0.0428","0.0362","","","0.0907","0.0937","","","","","","1.018","","","","has coordinates","179348","2020-10-21","18:00:00",""
"4324980","10.3246","0.0004","14.1253","0.0006","15.5657","0.0007","90","","105.16","0.001","90","","2191.07","0.16","93","2","93","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C50 H62 B O2 Y -","- C50 H62 B O2 Y -","- C100 H124 B2 O4 Y2 -","2","0.5","","Matthew R. MacDonald; Joseph W. Ziller; William J. Evans","Coordination and Reductive Chemistry of Tetraphenylborate Complexes of Trivalent Rare Earth Metallocene Cations, [(C5Me5)2Ln][(μ-Ph)2BPh2]","Inorganic Chemistry","2011","50","","4092","4106","10.1021/ic2000409","","","0.71073","MoKα","","0.0428","0.0321","","","0.0734","0.0782","","","","","","1.036","","","","has coordinates,has disorder","179352","2020-10-21","18:00:00",""
"4324981","10.3283","0.0003","14.1678","0.0005","15.6546","0.0005","90","","105.314","0.0004","90","","2209.39","0.12","98","2","98","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C50 H62 B O2 Sm -","- C50 H62 B O2 Sm -","- C100 H124 B2 O4 Sm2 -","2","0.5","","Matthew R. MacDonald; Joseph W. Ziller; William J. Evans","Coordination and Reductive Chemistry of Tetraphenylborate Complexes of Trivalent Rare Earth Metallocene Cations, [(C5Me5)2Ln][(μ-Ph)2BPh2]","Inorganic Chemistry","2011","50","","4092","4106","10.1021/ic2000409","","","0.71073","MoKα","","0.0161","0.0155","","","0.0386","0.0389","","","","","","1.061","","","","has coordinates,has disorder","179352","2020-10-21","18:00:00",""
"4324984","10.3569","0.0004","14.1863","0.0005","16.1998","0.0006","90","","106.857","0.0004","90","","2277.9","0.15","93","2","93","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C54 H60 B N2 Sm -","- C54 H60 B N2 Sm -","- C108 H120 B2 N4 Sm2 -","2","0.5","","Matthew R. MacDonald; Joseph W. Ziller; William J. Evans","Coordination and Reductive Chemistry of Tetraphenylborate Complexes of Trivalent Rare Earth Metallocene Cations, [(C5Me5)2Ln][(μ-Ph)2BPh2]","Inorganic Chemistry","2011","50","","4092","4106","10.1021/ic2000409","","","0.71073","MoKα","","0.0194","0.0182","","","0.0457","0.0464","","","","","","1.046","","","","has coordinates,has disorder","179352","2020-10-21","18:00:00",""
"4325276","11.876","0.002","11.599","0.002","18.24","0.004","90","","102.09","0.03","90","","2456.8","0.8","200","2","200","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C40 H66 Cl Cu2 N12 O13 -","- C40 H66 Cl Cu2 N12 O13 -","- C80 H132 Cl2 Cu4 N24 O26 -","2","0.5","","Peter Comba; Nina Dovalil; Graeme R. Hanson; Gerald Linti","Synthesis and CuII Coordination Chemistry of a Patellamide Derivative: Consequences of the Change from the Natural Thiazole/Oxazoline to the Artificial Imidazole Heterocycles","Inorganic Chemistry","2011","50","","5165","5174","10.1021/ic2004694","","x-ray","0.71073","MoKα","","0.1206","0.0503","","","0.1015","0.1262","","","","","","0.847","","","","has coordinates","179355","2020-10-21","18:00:00",""
"4325920","10.606","0.003","10.127","0.003","22.487","0.006","90","","108.854","0.012","90","","2285.7","1.1","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C21 H36 Ba0.5 N O2 Si0.5 -","- C21 H36 Ba0.5 N O2 Si0.5 -","- C84 H144 Ba2 N4 O8 Si2 -","4","1","","Dongming Yang; Yuqiang Ding; Haishun Wu; Wenjun Zheng","Synthesis and Structural Characterization of Alkaline-Earth-Metal Bis(amido)silane and Lithium Oxobis(aminolato)silane Complexes","Inorganic Chemistry","2011","50","","7698","7706","10.1021/ic200748z","","","0.71073","MoKα","","0.053","0.0434","","","0.1026","0.1068","","","","","","0.975","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4326339","12.2481","0.001","11.949","0.001","20.7932","0.0017","90","","100.013","0.002","90","","2996.8","0.4","100","0.1","100","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","jonsk06","(tBuNC)3NiPONOPNi(CNtBu)3","","- C51 H93 N7 Ni2 O2 P2 -","- C51 H93 N7 Ni2 O2 P2 -","- C102 H186 N14 Ni4 O4 P4 -","2","0.5","","Sabuj Kundu; William W. Brennessel; William D. Jones","Synthesis and Reactivity of New Ni, Pd, and Pt 2,6-Bis(di-tert-butylphosphinito)pyridine Pincer Complexes","Inorganic Chemistry","2011","50","","9443","9453","10.1021/ic201102v","","","0.71073","MoKα","","0.1113","0.0542","","","0.1135","0.1369","","","","","","1.015","","","","has coordinates","179366","2020-10-21","18:00:00",""
"4326546","18.926","0.012","9.408","0.006","7.272","0.005","90","","90.087","0.011","90","","1294.8","1.5","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C12 H13 Cs O -","- C12 H13 Cs O -","- C48 H52 Cs4 O4 -","4","1","","Timothy J. Boyle; Leigh Anna M. Steele; Alia M. Saad; Mark A. Rodriguez; Todd M. Alam; Sarah K. McIntyre","Structural Diversity in a Series of Alkyl-Substituted Cesium Aryloxides","Inorganic Chemistry","2011","50","","10363","10370","10.1021/ic201438s","","","0.71073","MoKα","","0.0939","0.0764","","","0.202","0.2235","","","","","","1.077","","","","has coordinates","179368","2020-10-21","18:00:00",""
"4326592","11.499","0.005","11.505","0.004","17.854","0.005","90","","117.939","0.019","90","","2086.7","1.4","200","2","200","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C26 H20 Cl12 Fe N6 Se2 -","- C26 H20 Cl12 Fe N6 Se2 -","- C52 H40 Cl24 Fe2 N12 Se4 -","2","0.5","","Christopher J. Adams; M. Carmen Muñoz; Rachel E. Waddington; José Antonio Real","Cooperative Spin Transition in the Two-Dimensional Coordination Polymer [Fe(4,4'-bipyridine)2(NCX)2].4CHCl3 (X = S, Se)","Inorganic Chemistry","2011","50","","10633","10642","10.1021/ic200932w","","","0.71073","MoKα","","0.0614","0.053","","","0.1353","0.1408","","","","","","1.048","","","","has coordinates","179368","2020-10-21","18:00:00",""
"4327534","15.686","0.002","12.6103","0.0016","38.999","0.005","90","","98.397","0.002","90","","7631.5","1.7","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C88 H75 N4 O14 Zn2.5 -","- C88 H64 N4 O13.5 Zn2.5 -","- C352 H256 N16 O54 Zn10 -","4","1","","Ponnaiyan Ayyappan; Owen R. Evans; Wenbin Lin","A Novel Coordination Polymer Containing Both Interdigitated 1D Chains and Interpenetrated 2D Grids","Inorganic Chemistry","2002","41","","3328","3330","10.1021/ic025524+","","","0.71073","MoKα","","0.2552","0.103","","","0.2525","0.3435","","","","","","1.02","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4327579","22.285","0.003","5.032","0.002","21.405","0.008","90","","93.703","0.005","90","","2395.3","1.3","200.2","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C42 H30 Ag4 F12 O12 S4 -","- C42 H30 Ag4 F12 O12 S4 -","- C84 H60 Ag8 F24 O24 S8 -","2","0.5","","Jian Chu Zhong; Megumu Munakata; Takayoshi Kuroda-Sowa; Masahiko Maekawa; Yusaku Suenaga; Hisashi Konaka","Spiral, Herringbone, and Triple-Decker Silver(I) Complexes of Benzopyrene Derivatives Assembled through η2-Coordination","Inorganic Chemistry","2001","40","","3191","3199","10.1021/ic001352+","","","0.7107","MoKα","","","0.0607","","","","0.1205","","","","","","1.136","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4327730","11.623","0.003","5.4942","0.0004","19.495","0.006","90","","103.1","0.04","90","","1212.5","0.5","120","","120","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C6 H20 Mo7 N2 O23 -","- C6 H20 Mo7 N2 O23 -","- C12 H40 Mo14 N4 O46 -","2","0.5","","Martine Bujoli-Doeuff; Rémi Dessapt; Philippe Deniard; Stéphane Jobic","New Hybrid Layered Molybdates Based on 2/\ιnfty[MonO3n+1]2- Units (n= 7, 9) with Systematic Organic-Inorganic Interfaces","Inorganic Chemistry","2012","51","","142","149","10.1021/ic201298d","","","0.71069","MoKα","","0.0402","0.0402","","","0.0783","0.0783","","","","1.1","1.1","1.1","","","","has coordinates,has Fobs","179380","2020-10-21","18:00:00",""
"4327858","17.3413","0.0005","11.6871","0.0003","27.8924","0.001","90","","115.104","0.003","90","","5119","0.3","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C39 H48 Cl0 N14 Nd2 O19 S3 -","- C39 H48 N14 Nd2 O19 S3 -","- C156 H192 N56 Nd8 O76 S12 -","4","1","","Cai-Hong Zhan; Fei Wang; Yao Kang; Jian Zhang","Lanthanide-Thiophene-2,5-dicarboxylate Frameworks: Ionothermal Synthesis, Helical Structures, Photoluminescent Properties, and Single-Crystal-to-Single-Crystal Guest Exchange","Inorganic Chemistry","2012","51","","523","530","10.1021/ic201986m","","","0.71073","MoKα","","0.0466","0.0369","","","0.1064","0.1097","","","","","","1.083","","","","has coordinates","179381","2020-10-21","18:00:00",""
"4327859","16.9836","0.0006","12.1799","0.0004","27.7375","0.0011","90","","114.666","0.003","90","","5214.2","0.3","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C38 H42 N12 Nd2 O19 S3 -","- C38 H42 N12 Nd2 O19 S3 -","- C152 H168 N48 Nd8 O76 S12 -","4","1","","Cai-Hong Zhan; Fei Wang; Yao Kang; Jian Zhang","Lanthanide-Thiophene-2,5-dicarboxylate Frameworks: Ionothermal Synthesis, Helical Structures, Photoluminescent Properties, and Single-Crystal-to-Single-Crystal Guest Exchange","Inorganic Chemistry","2012","51","","523","530","10.1021/ic201986m","","","0.71073","MoKα","","0.0978","0.0647","","","0.1746","0.1904","","","","","","1.081","","","","has coordinates","179381","2020-10-21","18:00:00",""
"4327860","17.0072","0.0019","12.1455","0.0007","27.524","0.003","90","","114.738","0.007","90","","5163.6","0.9","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C37 H48 N10 Nd2 O19 S3 -","- C37 H48 N10 Nd2 O19 S3 -","- C148 H192 N40 Nd8 O76 S12 -","4","1","","Cai-Hong Zhan; Fei Wang; Yao Kang; Jian Zhang","Lanthanide-Thiophene-2,5-dicarboxylate Frameworks: Ionothermal Synthesis, Helical Structures, Photoluminescent Properties, and Single-Crystal-to-Single-Crystal Guest Exchange","Inorganic Chemistry","2012","51","","523","530","10.1021/ic201986m","","","0.71073","MoKα","","0.0575","0.0501","","","0.1447","0.1565","","","","","","1.127","","","","has coordinates","179381","2020-10-21","18:00:00",""
"4327909","16.0439","0.0008","11.9799","0.0005","27.4399","0.0013","90","","103.2","0.002","90","","5134.7","0.4","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C60 H76 Cr2 N4 O2 -","- C60 H76 Cr2 N4 O2 -","- C240 H304 Cr8 N16 O8 -","4","1","","K. Cory MacLeod; Brian O. Patrick; Kevin M. Smith","Reactivity of Cr(III) μ-Oxo Compounds: Catalyst Regeneration and Atom Transfer Processes","Inorganic Chemistry","2012","51","","688","700","10.1021/ic202233f","","","0.71073","MoKα","","0.0761","0.0456","","","0.108","0.1225","","","","","","1.021","","","","has coordinates","179382","2020-10-21","18:00:00",""
"4328222","14.539","0.004","10.546","0.003","23.378","0.006","90","","107.231","0.005","90","","3423.6","1.6","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C43 H25 N0 O16 P2 Y2 -","- C43 H25 O16 P2 Y2 -","- C86 H50 O32 P4 Y4 -","2","0.5","","Zu-Jin Lin; Zhen Yang; Tian-Fu Liu; Yuan-Biao Huang; Rong Cao","Microwave-Assisted Synthesis of a Series of Lanthanide Metal-Organic Frameworks and Gas Sorption Properties","Inorganic Chemistry","2012","51","","1813","1820","10.1021/ic202082w","","","0.71073","MoKα","","0.0799","0.0566","","","0.1582","0.1749","","","","","","0.995","","","","has coordinates","179385","2020-10-21","18:00:00",""
"4328223","14.664","0.003","10.603","0.002","23.698","0.004","90","","108.058","0.01","90","","3503.1","1.2","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C43 H25 O16 P2 Sm2 -","- C43 H25 O16 P2 Sm2 -","- C86 H50 O32 P4 Sm4 -","2","0.5","","Zu-Jin Lin; Zhen Yang; Tian-Fu Liu; Yuan-Biao Huang; Rong Cao","Microwave-Assisted Synthesis of a Series of Lanthanide Metal-Organic Frameworks and Gas Sorption Properties","Inorganic Chemistry","2012","51","","1813","1820","10.1021/ic202082w","","","0.71073","MoKα","","0.0724","0.0674","","","0.207","0.2142","","","","","","1.139","","","","has coordinates","179385","2020-10-21","18:00:00",""
"4328224","14.617","0.003","10.572","0.002","23.548","0.005","90","","107.79","0.03","90","","3464.9","1.3","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C43 H25 Eu2 N0 O16 P2 -","- C43 H25 Eu2 O16 P2 -","- C86 H50 Eu4 O32 P4 -","2","0.5","","Zu-Jin Lin; Zhen Yang; Tian-Fu Liu; Yuan-Biao Huang; Rong Cao","Microwave-Assisted Synthesis of a Series of Lanthanide Metal-Organic Frameworks and Gas Sorption Properties","Inorganic Chemistry","2012","51","","1813","1820","10.1021/ic202082w","","","0.71073","MoKα","","0.0421","0.034","","","0.0968","0.0997","","","","","","1.018","","","","has coordinates","179385","2020-10-21","18:00:00",""
"4328225","14.528","0.003","10.497","0.002","23.674","0.008","90","","107.97","0.03","90","","3434.2","1.6","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C43 H25 Gd2 O16 P2 -","- C43 H25 Gd2 O16 P2 -","- C86 H50 Gd4 O32 P4 -","2","0.5","","Zu-Jin Lin; Zhen Yang; Tian-Fu Liu; Yuan-Biao Huang; Rong Cao","Microwave-Assisted Synthesis of a Series of Lanthanide Metal-Organic Frameworks and Gas Sorption Properties","Inorganic Chemistry","2012","51","","1813","1820","10.1021/ic202082w","","","0.71073","MoKα","","0.0403","0.0355","","","0.0884","0.0908","","","","","","1.086","","","","has coordinates","179385","2020-10-21","18:00:00",""
"4328226","14.617","0.004","10.572","0.003","23.548","0.007","90","","107.787","0.004","90","","3465","1.7","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C43 H25 O16 P2 Tb2 -","- C43 H25 O16 P2 Tb2 -","- C86 H50 O32 P4 Tb4 -","2","0.5","","Zu-Jin Lin; Zhen Yang; Tian-Fu Liu; Yuan-Biao Huang; Rong Cao","Microwave-Assisted Synthesis of a Series of Lanthanide Metal-Organic Frameworks and Gas Sorption Properties","Inorganic Chemistry","2012","51","","1813","1820","10.1021/ic202082w","","","0.71073","MoKα","","0.0451","0.0399","","","0.1115","0.1182","","","","","","1.079","","","","has coordinates","179385","2020-10-21","18:00:00",""
"4328227","14.617","0.004","10.572","0.003","23.548","0.007","90","","107.787","0.004","90","","3465","1.7","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C43 H25 Dy2 O16 P2 -","- C43 H25 Dy2 O16 P2 -","- C86 H50 Dy4 O32 P4 -","2","0.5","","Zu-Jin Lin; Zhen Yang; Tian-Fu Liu; Yuan-Biao Huang; Rong Cao","Microwave-Assisted Synthesis of a Series of Lanthanide Metal-Organic Frameworks and Gas Sorption Properties","Inorganic Chemistry","2012","51","","1813","1820","10.1021/ic202082w","","","0.71073","MoKα","","0.0417","0.0378","","","0.1091","0.1119","","","","","","1.083","","","","has coordinates","179385","2020-10-21","18:00:00",""
"4328228","14.4523","0.0011","10.4767","0.0005","23.4337","0.0018","90","","107.577","0.004","90","","3382.5","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C43 H25 Ho2 O16 P2 -","- C43 H25 Ho2 O16 P2 -","- C86 H50 Ho4 O32 P4 -","2","0.5","","Zu-Jin Lin; Zhen Yang; Tian-Fu Liu; Yuan-Biao Huang; Rong Cao","Microwave-Assisted Synthesis of a Series of Lanthanide Metal-Organic Frameworks and Gas Sorption Properties","Inorganic Chemistry","2012","51","","1813","1820","10.1021/ic202082w","","","0.71073","MoKα","","0.0349","0.0315","","","0.0949","0.0968","","","","","","1.084","","","","has coordinates","179385","2020-10-21","18:00:00",""
"4328229","14.4248","0.0011","10.4553","0.0005","23.4323","0.0018","90","","107.501","0.004","90","","3370.4","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C43 H25 Er2 O16 P2 -","- C43 H25 Er2 O16 P2 -","- C86 H50 Er4 O32 P4 -","2","0.5","","Zu-Jin Lin; Zhen Yang; Tian-Fu Liu; Yuan-Biao Huang; Rong Cao","Microwave-Assisted Synthesis of a Series of Lanthanide Metal-Organic Frameworks and Gas Sorption Properties","Inorganic Chemistry","2012","51","","1813","1820","10.1021/ic202082w","","","0.71073","MoKα","","0.0707","0.059","","","0.185","0.1941","","","","","","1.081","","","","has coordinates","179385","2020-10-21","18:00:00",""
"4328230","14.4014","0.0011","10.4577","0.0005","23.3524","0.0018","90","","107.371","0.004","90","","3356.6","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C43 H25 O16 P2 Tm2 -","- C43 H25 O16 P2 Tm2 -","- C86 H50 O32 P4 Tm4 -","2","0.5","","Zu-Jin Lin; Zhen Yang; Tian-Fu Liu; Yuan-Biao Huang; Rong Cao","Microwave-Assisted Synthesis of a Series of Lanthanide Metal-Organic Frameworks and Gas Sorption Properties","Inorganic Chemistry","2012","51","","1813","1820","10.1021/ic202082w","","","0.71073","MoKα","","0.0609","0.0509","","","0.1719","0.1788","","","","","","1.13","","","","has coordinates","179385","2020-10-21","18:00:00",""
"4328231","14.3832","0.0011","10.4548","0.0005","23.3057","0.0018","90","","107.348","0.004","90","","3345.1","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C43 H25 O16 P2 Yb2 -","- C43 H25 O16 P2 Yb2 -","- C86 H50 O32 P4 Yb4 -","2","0.5","","Zu-Jin Lin; Zhen Yang; Tian-Fu Liu; Yuan-Biao Huang; Rong Cao","Microwave-Assisted Synthesis of a Series of Lanthanide Metal-Organic Frameworks and Gas Sorption Properties","Inorganic Chemistry","2012","51","","1813","1820","10.1021/ic202082w","","","0.71073","MoKα","","0.0537","0.0469","","","0.1716","0.1771","","","","","","1.118","","","","has coordinates","179385","2020-10-21","18:00:00",""
"4328232","14.4262","0.0011","10.4932","0.0005","23.2269","0.0018","90","","107.052","0.004","90","","3361.5","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C43 H25 Lu2 O16 P2 -","- C43 H25 Lu2 O16 P2 -","- C86 H50 Lu4 O32 P4 -","2","0.5","","Zu-Jin Lin; Zhen Yang; Tian-Fu Liu; Yuan-Biao Huang; Rong Cao","Microwave-Assisted Synthesis of a Series of Lanthanide Metal-Organic Frameworks and Gas Sorption Properties","Inorganic Chemistry","2012","51","","1813","1820","10.1021/ic202082w","","","0.71073","MoKα","","0.0443","0.0384","","","0.1115","0.1153","","","","","","1.048","","","","has coordinates","179385","2020-10-21","18:00:00",""
"4328655","15.197","0.008","13.107","0.007","18.862","0.01","90","","112.255","0.006","90","","3477","3","100","","100","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C48 H112 Ce2 N4 O12 P8 -","- C48 H112 Ce2 N4 O12 P8 -","- C96 H224 Ce4 N8 O24 P16 -","2","0.5","","Guo-Cang Wang; Herman H. Y. Sung; Ian D. Williams; Wa-Hung Leung","Tetravalent Titanium, Zirconium, and Cerium Oxo and Peroxo Complexes Containing an Imidodiphosphinate Ligand","Inorganic Chemistry","2012","51","","3640","3647","10.1021/ic202564h","","","0.71073","MoKα","","0.0535","0.0441","","","0.1146","0.1192","","","","","","1.034","","","","has coordinates,has disorder","179389","2020-10-21","18:00:00",""
"4328896","12.9652","0.0008","12.1867","0.0008","24.3433","0.0015","90","","102.276","0.001","90","","3758.4","0.4","173","2","173","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C30.5 H38.75 Cl F12 N4.25 O0.5 P2 Pt -","- C30.5 H38.75 Cl F12 N4.25 O0.5 P2 Pt -","- C122 H155 Cl4 F48 N17 O2 P8 Pt4 -","4","1","","Sayandev Chatterjee; Jeanette A. Krause; Kumudu Madduma-Liyanage; William B. Connick","Platinum(II) Diimine Complexes with Halide/Pseudohalide Ligands and Dangling Trialkylamine or Ammonium Groups","Inorganic Chemistry","2012","51","","4572","4587","10.1021/ic202462a","","","0.7749","synchrotron","","0.0401","0.0346","","","0.0926","0.0959","","","","","","1.06","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4328898","12.9207","0.0004","12.2183","0.0004","24.2249","0.0008","90","","102.173","0.002","90","","3738.4","0.2","150","2","150","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C31.75 H38.5 Cl0.25 F12 N5.25 O0.75 P2 Pt -","- C31.75 H38.5 Cl0.25 F12 N5.25 O0.75 P2 Pt -","- C127 H154 Cl F48 N21 O3 P8 Pt4 -","4","1","","Sayandev Chatterjee; Jeanette A. Krause; Kumudu Madduma-Liyanage; William B. Connick","Platinum(II) Diimine Complexes with Halide/Pseudohalide Ligands and Dangling Trialkylamine or Ammonium Groups","Inorganic Chemistry","2012","51","","4572","4587","10.1021/ic202462a","","","1.54178","CuKα","","0.0353","0.0343","","","0.0937","0.0946","","","","","","1.042","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4328990","7.1904","0.0004","11.4396","0.0006","20.2455","0.001","90","","90.681","0.002","90","","1665.18","0.15","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H42 I2 N8 O6 -","- C26 H42 I2 N8 O6 -","- C52 H84 I4 N16 O12 -","2","0.5","","Md. Alamgir Hossain; Sung Ok Kang; Jerry Alan Kut; Victor W. Day; Kristin Bowman-James","Influence of Charge on Anion Receptivity in Amide-Based Macrocycles","Inorganic Chemistry","2012","51","","4833","4840","10.1021/ic300260g","","","0.71073","MoKα","","0.03","0.0281","","","0.0726","0.0738","","","","","","0.973","","","","has coordinates","179392","2020-10-21","18:00:00",""
"4329060","18.5258","0.0015","11.3342","0.0009","24.5896","0.0019","90","","108.065","0.001","90","","4908.7","0.7","100","2","100","2","","","","","","","","9","P 1 2/c 1","-P 2yc","13","trans PtRh(tfepma)2(tBuNC)Cl5","","","- C23.5 H31 Cl6 F24 N3 O8 P4 Pt Rh -","- C23.5 H31 Cl6 F24 N3 O8 P4 Pt Rh -","- C94 H124 Cl24 F96 N12 O32 P16 Pt4 Rh4 -","4","1","","Timothy R. Cook; Brian D. McCarthy; Daniel A. Lutterman; Daniel G. Nocera","Halogen Oxidation and Halogen Photoelimination Chemistry of a Platinum-Rhodium Heterobimetallic Core","Inorganic Chemistry","2012","51","","5152","5163","10.1021/ic300004x","","","0.71073","MoKα","","0.0378","0.03","","","0.0683","0.0726","","","","","","1.062","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4329122","21.362","0.0005","10.8747","0.0002","32.7921","0.0007","90","","116.201","0.0013","90","","6835.1","0.3","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C79 H88 Cl2 N2 Pt -","- C79 H88 Cl2 N2 Pt -","- C316 H352 Cl8 N8 Pt4 -","4","1","","Tracy L. Lohr; Warren E. Piers; Masood Parvez","Monomeric Platinum(II) Hydroxides Supported by Sterically Dominant α-Diimine Ligands","Inorganic Chemistry","2012","51","","4900","4902","10.1021/ic300337a","","","0.71073","MoKα","","0.1204","0.088","","","0.1584","0.1755","","","","","","1.251","","","","has coordinates,has disorder","179394","2020-10-21","18:00:00",""
"4329174","19.4185","0.0003","18.8442","0.0003","17.3971","0.0002","90","","101.445","0.001","90","","6239.47","0.16","120","2","120","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C75 H51 Cl3 Fe2 Lu N12 O -","- C75 H45 Cl3 Fe2 Lu N12 O -","- C300 H180 Cl12 Fe8 Lu4 N48 O4 -","4","1","","Peihua Zhu; Xiuwen Zhang; Hailong Wang; Yuexing Zhang; Yongzhong Bian; Jianzhuang Jiang","Ferrocene-Decorated (Phthalocyaninato)(Porphyrinato) Double- and Triple-Decker Rare Earth Complexes: Synthesis, Structure, and Electrochemical Properties","Inorganic Chemistry","2012","51","","5651","5659","10.1021/ic202613r","","","1.54184","CuKα","","0.0711","0.0585","","","0.1664","0.1781","","","","","","1.056","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4329183","10.9425","0.0013","21.354","0.002","18.84","0.002","90","","105.218","0.002","90","","4247.9","0.8","93","2","93","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C54 H42 N12 O12 Zn3 -","- C54 H42 N12 O12 Zn3 -","- C108 H84 N24 O24 Zn6 -","2","0.5","","Xiao-Min Liu; Rui-Biao Lin; Jie-Peng Zhang; Xiao-Ming Chen","Low-Dimensional Porous Coordination Polymers Based on 1,2-Bis(4-pyridyl)hydrazine: From Structure Diversity to Ultrahigh CO2/CH4 Selectivity","Inorganic Chemistry","2012","51","","5686","5692","10.1021/ic300097y","","","0.71073","MoKα","","0.0779","0.048","","","0.1212","0.1387","","","","","","1.003","","","","has coordinates","179394","2020-10-21","18:00:00",""
"4329213","11.4463","0.0003","9.6919","0.0002","15.9712","0.0005","90","","125.864","0.002","90","","1435.87","0.08","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C26 H40 Cl3 N P2 Sn -","- C26 H40 Cl3 N P2 Sn -","- C52 H80 Cl6 N2 P4 Sn2 -","2","0.5","","Jens Henning; Hartmut Schubert; Klaus Eichele; Florian Winter; Rainer Pöttgen; Hermann August Mayer; Lars Wesemann","Synthesis and Characterization of N-[2-P(i-Pr)2-4-methylphenyl]2- (PNP) Pincer Tin(IV) and Tin(II) Complexes","Inorganic Chemistry","2012","51","","5787","5794","10.1021/ic300324s","","","0.71073","MoKα","","0.0321","0.0309","","","0.0633","0.0638","","","","","","1.224","","","","has coordinates","179395","2020-10-21","18:00:00",""
"4329250","13.5095","0.0015","10.6328","0.0012","32.878","0.003","90","","113.048","0.003","90","","4345.7","0.8","150","2","150","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C84 H132 Cl4 Li2 N4 O6 Zn2 -","- C84 H132 Cl4 Li2 N4 O6 Zn2 -","- C168 H264 Cl8 Li4 N8 O12 Zn4 -","2","0.5","","Yuanting Su; Yanxia Zhao; Jing Gao; Qingsong Dong; Biao Wu; Xiao-Juan Yang","Alkali Metal and Zinc Complexes of a Bridging 2,5-Diamino-1,4-Benzoquinonediimine Ligand","Inorganic Chemistry","2012","51","","5889","5896","10.1021/ic3004867","","","0.71073","MoKα","","0.0973","0.0694","","","0.1559","0.1692","","","","","","1.06","","","","has coordinates","179395","2020-10-21","18:00:00",""
"4329319","16.232","0.007","9.622","0.004","27.2","0.009","90","","97.354","0.007","90","","4213","3","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H16 Br Mn2 N11 O6 -","- C20 H16 Br Mn2 N11 O6 -","- C120 H96 Br6 Mn12 N66 O36 -","6","1.5","","Marta Arroyo; Patricia Gómez-Iglesias; Jose Miguel Martín-Alvarez; Celedonio M. Alvarez; Daniel Miguel; Fernando Villafañe","Coordination versus Coupling of Dicyanamide in Molybdenum and Manganese Pyrazole Complexes","Inorganic Chemistry","2012","51","","6070","6080","10.1021/ic202631c","","","0.71073","MoKα","","0.1024","0.076","","","0.1656","0.1763","","","","","","1.113","","","","has coordinates","179396","2020-10-21","18:00:00",""
"4329321","4.830251","0.000016","5.775132","0.000017","5.15715","0.000014","90","","91.4251","0.0003","90","","143.816","0.0007","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- In O4 Ta -","- In O4 Ta -","- In2 O8 Ta2 -","2","0.5","","Andrew C. Malingowski; Peter W. Stephens; Ashfia Huq; Qingzhen Huang; Syed Khalid; Peter G. Khalifah","Substitutional Mechanism of Ni into the Wide-Band-Gap Semiconductor InTaO4 and Its Implications for Water Splitting Activity in the Wolframite Structure Type","Inorganic Chemistry","2012","51","","6096","6103","10.1021/ic202715c","powder diffraction","x-ray","0.697255","","","","","","","","","0.01898","","0.96","","","","","","","has coordinates,has Fobs","179396","2020-10-21","18:00:00",""
"4329322","4.824528","0.000027","5.773787","0.00003","5.155303","0.000025","90","","91.3764","0.0003","90","","143.564","0.0013","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- In0.94 Ni0.04 O4 Ta1.02 -","- In0.94451 Ni0.03699 O4 Ta1.01849 -","- In1.88902 Ni0.07398 O8 Ta2.03698 -","2","0.5","","Andrew C. Malingowski; Peter W. Stephens; Ashfia Huq; Qingzhen Huang; Syed Khalid; Peter G. Khalifah","Substitutional Mechanism of Ni into the Wide-Band-Gap Semiconductor InTaO4 and Its Implications for Water Splitting Activity in the Wolframite Structure Type","Inorganic Chemistry","2012","51","","6096","6103","10.1021/ic202715c","powder diffraction","x-ray","0.697255","","","","","","","","","0.03132","","0.91","","","","","","","has coordinates,has Fobs","179396","2020-10-21","18:00:00",""
"4329324","4.81863","0.000023","5.77023","0.000026","5.152369","0.000023","90","","91.3467","0.0004","90","","143.22","0.0011","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- In0.91 Ni0.06 O4 Ta1.03 -","- In0.9146 Ni0.05693 O4 Ta1.02847 -","- In1.8292 Ni0.11386 O8 Ta2.05694 -","2","0.5","","Andrew C. Malingowski; Peter W. Stephens; Ashfia Huq; Qingzhen Huang; Syed Khalid; Peter G. Khalifah","Substitutional Mechanism of Ni into the Wide-Band-Gap Semiconductor InTaO4 and Its Implications for Water Splitting Activity in the Wolframite Structure Type","Inorganic Chemistry","2012","51","","6096","6103","10.1021/ic202715c","powder diffraction","neutron","","","","","","","","","","0.08053","","0.99","","","","","","","has coordinates","179396","2020-10-21","18:00:00",""
"4329553","18.225","0.003","9.2487","0.0014","29.294","0.004","90","","105.212","0.01","90","","4764.7","1.3","120","2","120","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","3,12-(NO2)2TTCorrCoPPh3","","","- C117 H86 Cl2 Co2 N12 O8 P2 -","- C117 H86 Cl2 Co2 N12 O8 P2 -","- C234 H172 Cl4 Co4 N24 O16 P4 -","2","0.5","","Manuela Stefanelli; Giuseppe Pomarico; Luca Tortora; Sara Nardis; Frank R. Fronczek; Gregory T. McCandless; Kevin M. Smith; Machima Manowong; Yuanyuan Fang; Ping Chen; Karl M. Kadish; Angela Rosa; Giampaolo Ricciardi; Roberto Paolesse","β-Nitro-5,10,15-tritolylcorroles","Inorganic Chemistry","2012","51","","6928","6942","10.1021/ic3007926","","","1.54184","CuKα","","0.0754","0.0587","","","0.1562","0.1687","","","","","","1.025","","","","has coordinates,has disorder","179398","2020-10-21","18:00:00",""
"4329747","10.544","0.005","6.451","0.003","23.485","0.011","90","","97.754","0.005","90","","1582.8","1.3","127","2","127","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Neodymium(III) Borate Bromide","","","- B18 Br3 Nd4 O38 -","- B18 Br3 Nd4 O38 -","- B36 Br6 Nd8 O76 -","2","0.5","","Matthew J. Polinski; Shuao Wang; Justin N. Cross; Evgeny V. Alekseev; Wulf Depmeier; Thomas E. Albrecht-Schmitt","Effects of Large Halides on the Structures of Lanthanide(III) and Plutonium(III) Borates","Inorganic Chemistry","2012","51","","7859","7866","10.1021/ic3009317","","","0.71073","MoKα","","0.0438","0.0288","","","0.0566","0.0617","","","","","","1.042","","","","has coordinates","179400","2020-10-21","18:00:00",""
"4329816","9.2598","0.0003","11.9585","0.0002","26.1511","0.0007","90","","90.022","0.002","90","","2895.8","0.13","133","2","133","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C56 H72 N8 Ni4 O16 -","- C56 H72 N8 Ni4 O16 -","- C112 H144 N16 Ni8 O32 -","2","0.5","","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","","0.0217","0.0212","","","0.0553","0.0555","","","","","","1.095","","","","has coordinates","179401","2020-10-21","18:00:00",""
"4330478","14.977","0.003","10.515","0.002","27.182","0.005","90","","103.19","0.03","90","","4167.8","1.5","223","2","223","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C66 H79 F24 N9 P4 S4 Zn2 -","- C66 H76 F24 N9 P4 S4 Zn2 -","- C132 H152 F48 N18 P8 S8 Zn4 -","2","0.5","","Ai-Xia Zheng; Jing Si; Xiao-Yan Tang; Li-Li Miao; Miao Yu; Kai-Peng Hou; Fan Wang; Hong-Xi Li; Jian-Ping Lang","Reactions of the Cationic Zinc Thiolate Model Complex [Zn(Tab)4](PF6)2 with N-Donor Ligands and Cobalt Dichloride","Inorganic Chemistry","2012","51","","10262","10273","10.1021/ic301191n","","","0.71073","MoKα","","0.1368","0.0995","","","0.2183","0.2415","","","","","","1.166","","","","has coordinates,has disorder","179407","2020-10-21","18:00:00",""
"4330934","13.5676","0.0008","17.0986","0.001","19.0882","0.0014","90","","119.289","0.005","90","","3862.1","0.5","90","2","90","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C82 H72 B F24 Ga N4 -","- C82 H72 B F24 Ga N4 -","- C164 H144 B2 F48 Ga2 N8 -","2","0.5","","Chelsea D. Cates; Thomas W. Myers; Louise A. Berben","(IP)2GaIII Complexes Facilitate Net Two-Electron Redox Transformations (IP = α-Iminopyridine)","Inorganic Chemistry","2012","51","","11891","11897","10.1021/ic301792w","","","1.54178","CuKα","","0.0862","0.0477","","","0.0925","0.1004","","","","","","1.339","","","","has coordinates","179412","2020-10-21","18:00:00",""
"4331024","14.537","0.003","10.492","0.002","23.403","0.005","90","","107.32","0.03","90","","3407.6","1.3","120","2","120","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C21.5 H12.5 Dy O8 P -","- C21.5 H12.5 Dy O8 P -","- C86 H50 Dy4 O32 P4 -","4","1","","Ilich A. Ibarra; Ji Woong Yoon; Jong-San Chang; Su Kyoung Lee; Vincent M. Lynch; Simon M. Humphrey","Organic Vapor Sorption in a High Surface Area Dysprosium(III)-Phosphine Oxide Coordination Material","Inorganic Chemistry","2012","51","","12242","12247","10.1021/ic301415p","","","0.71073","MoKα","","0.0827","0.0569","","","0.1367","0.1462","","","","","","1.03","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4331099","9.111","0.007","13.899","0.011","9.708","0.008","90","","97.904","0.014","90","","1217.7","1.7","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C13 H19 Bi N10 O9 S2 -","- C13 H19 Bi N10 O9 S2 -","- C26 H38 Bi2 N20 O18 S4 -","2","0.5","","Ming-Xue Li; Min Yang; Jing-Yang Niu; Li-Zhi Zhang; Song-Qiang Xie","A Nine-Coordinated Bismuth(III) Complex Derived from Pentadentate 2,6-Diacetylpyridine Bis(4N-methylthiosemicarbazone): Crystal Structure and Both in Vitro and in Vivo Biological Evaluation","Inorganic Chemistry","2012","51","","12521","12526","10.1021/ic301959z","","","0.71073","MoKα","","0.0799","0.0608","","","0.1458","0.1532","","","","","","1.118","","","","has coordinates","179413","2020-10-21","18:00:00",""
"4331409","5.6045","","5.2567","","7.8061","","90","","96.594","","90","","228.456","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","(Ag F)2 (Ag F4) (As F6)","","- Ag3 As F12 -","- Ag3 As F12 -","- Ag3 As F12 -","1","0.25","","Bartlett, N.; Graudejus, O.; Shen, C.-P.; Lucier, G.M.; Allman, J.A.; Zemva, B.","Disproportionation of Ag(II) to Ag(I) and Ag(III) in fluoride systems and syntheses and structures of (Ag F)(+)2 (Ag F4)(-) (M F6)(-) salts (M = As, Sb, Pt, Au, Ru)","Inorganic Chemistry","1999","38","","4570","4577","10.1021/ic9905603","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4331436","6.849","","5","","12.718","","90","","92.53","","90","","435.103","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Rb Zn4 (B O3)3","","- B3 O9 Rb Zn4 -","- B3 O9 Rb Zn4 -","- B6 O18 Rb2 Zn8 -","2","0.5","","Keszler, D.A.; Luce, J.L.; Smith, R.W.","Framework alkali metal zinc orthoborates: A Zn4 (B O3)3 (A = K, Rb, Cs)","Inorganic Chemistry","1992","31","","4679","4682","10.1021/ic00048a042","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4331539","18.398","0.016","20.61","0.02","31.038","0.016","90","","117.59","0.03","90","","10431","15","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C136 H138 F48 N32 O13 P8 Pd8 -","- C136 H138 F48 N32 O13 P8 Pd8 -","- C272 H276 F96 N64 O26 P16 Pd16 -","2","0.5","","Yu, Shu-Yan; Huang, Hai-Ping; Li, Sheng-Hui; Jiao, Qing; Li, Yi-Zhi; Wu, Biao; Sei, Yoshihisa; Yamaguchi, Kentaro; Pan, Yuan-Jiang; Ma, Hong-Wei","Solution self-assembly, spontaneous deprotonation, and crystal structures of bipyrazolate-bridged metallomacrocycles with dimetal centers.","Inorganic chemistry","2005","44","25","9471","9488","10.1021/ic0509332","","","0.71073","MoKα","","0.0794","0.0528","","","0.1069","0.1121","","","","","","0.98","","","","has coordinates,has disorder","179418","2020-10-21","18:00:00",""
"4331851","22.545","0.006","11.275","0.003","19.763","0.005","90","","106.55","0.007","90","","4816","2","295","2","295","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C44 H76 O8 Zr -","- C44.5 O8 Zr -","- C178 O32 Zr4 -","4","1","","Spijksma, Gerald I.; Bouwmeester, Henny J. M.; Blank, Dave H. A.; Fischer, Andreas; Henry, Marc; Kessler, Vadim G.","Chemistry of 2,2,6,6,-Tetramethyl-3,5-heptanedione (Hthd) Modification of Zirconium and Hafnium Propoxide Precursors","Inorganic Chemistry","2006","45","13","4938","4950","10.1021/ic051674j","","","0.71073","MoKα","","0.1177","0.0826","","","0.2063","0.2261","","","","","","1.03","","","","has coordinates","179421","2020-10-21","18:00:00",""
"4331852","22.545","0.006","11.275","0.003","19.763","0.005","90","","106.55","0.007","90","","4816","2","295","2","295","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C44 H76 Hf O8 -","- C44.5 Hf O8 -","- C178 Hf4 O32 -","4","1","","Spijksma, Gerald I.; Bouwmeester, Henny J. M.; Blank, Dave H. A.; Fischer, Andreas; Henry, Marc; Kessler, Vadim G.","Chemistry of 2,2,6,6,-Tetramethyl-3,5-heptanedione (Hthd) Modification of Zirconium and Hafnium Propoxide Precursors","Inorganic Chemistry","2006","45","13","4938","4950","10.1021/ic051674j","","","0.71073","MoKα","","0.1254","0.0763","","","0.183","0.2037","","","","","","1.097","","","","has coordinates","179421","2020-10-21","18:00:00",""
"4332118","27.594","0.008","16.176","0.005","29.832","0.009","90","","114.979","0.006","90","","12070","6","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C83 H156 N8 Ni7 O33 -","- C83 H136 N8 Ni7 O33 -","- C332 H544 N32 Ni28 O132 -","4","1","","Ovcharenko, Victor; Fursova, Elena; Romanenko, Galina; Eremenko, Igor; Tretyakov, Evgeny; Ikorskii, Vladimir","Synthesis, Structure, and Magnetic Properties of (6−9)-Nuclear Ni(II) Trimethylacetates and Their Heterospin Complexes with Nitroxides","Inorganic Chemistry","2006","45","14","5338","5350","10.1021/ic0522028","","","0.71073","MoKα","","0.1765","0.0826","","","0.1725","0.2088","","","","","","0.907","","","","has coordinates","179424","2020-10-21","18:00:00",""
"4332332","11.2905","0.0002","17.7414","0.0004","10.8096","0.0002","90","","93.294","0.003","90","","2161.69","0.07","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C10.5 H23 F12 N6 O P2 Ru -","- C10.5 H20 F12 N6 O P2 Ru -","- C42 H80 F48 N24 O4 P8 Ru4 -","4","1","","Chen, Yuan-Jang; Xie, Puhui; Heeg, Mary Jane; Endicott, John F.","Influence of the “Innocent” Ligands on the MLCT Excited-State Behavior of Mono(bipyridine)ruthenium(II) Complexes: A Comparison of X-ray Structures and 77 K Luminescence Properties","Inorganic Chemistry","2006","45","16","6282","6297","10.1021/ic0602547","","","0.71073","MoKα","","0.0517","0.043","","","0.1237","0.1284","","","","","","1.058","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4332534","7.9029","0.0007","9.8007","0.0009","20.506","0.0019","90","","99.297","0.002","90","","1567.4","0.2","98","2","98","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C12 H12 Ag F6 N4 P -","- C12 H12 Ag F6 N4 P -","- C48 H48 Ag4 F24 N16 P4 -","4","1","","Cordes, David B.; Hanton, Lyall R.; Spicer, Mark D.","Helices versus Zigzag Chains: One-Dimensional Coordination Polymers of AgIand Bis(4-pyridyl)amine","Inorganic Chemistry","2006","45","19","7651","7664","10.1021/ic060487y","","","0.71073","MoKα","","0.0334","0.0268","","","0.0603","0.063","","","","","","1.066","","","","has coordinates","179428","2020-10-21","18:00:00",""
"4332540","35.122","0.013","7.767","0.003","16.511","0.007","90","","98.55","0.03","90","","4454","3","200","","200","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","[MnCl2(L3)2]-1/2(EtOH)-1/2(H2O)","","- C49 H46 Cl2 Mn N6 O7 -","- C49 H44.5 Cl2 Mn N6 O7 -","- C196 H178 Cl8 Mn4 N24 O28 -","4","1","","Wu, Gang; Wang, Xiao-Feng; Okamura, Taka-aki; Sun, Wei-Yin; Ueyama, Norikazu","Syntheses, Structures, and Photoluminescence Properties of Metal(II) Halide Complexes with Pyridine-Containing Flexible Tripodal Ligands","Inorganic Chemistry","2006","45","21","8523","8532","10.1021/ic060493u","","","0.71075","MoKα","","0.1482","0.0431","","","0.043","0.0476","","","","","","0.719","","","","has coordinates","179428","2020-10-21","18:00:00",""
"4332723","22.0245","0.0005","11.5535","0.0002","20.0968","0.0004","90","","107.483","0.001","90","","4877.61","0.17","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C44 H76 Cr2 N8 -","- C44 H76 Cr2 N8 -","- C176 H304 Cr8 N32 -","4","1","","El-Kadri, Oussama M.; Heeg, Mary Jane; Winter, Charles H.","Synthesis, Structure, and Properties of a Dimeric Chromium(II) Pyrazolato Complex with a Long Chromium−Chromium Distance. Maintenance of a Dimeric Structure in Solution and Interconversion between Dimeric and Monomeric Structures","Inorganic Chemistry","2006","45","14","5278","5280","10.1021/ic060749w","","","0.71073","MoKα","","0.083","0.0492","","","0.1216","0.1334","","","","","","1.087","","","","has coordinates","179430","2020-10-21","18:00:00",""
"4332836","11.2924","0.0005","9.1456","0.0002","22.5267","0.0008","90","","103.691","0.0008","90","","2260.36","0.14","103","","","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C36 H52 Cu F12 N4 O8 P2 -","- C36 H48 Cu F12 N4 O8 P2 -","- C72 H96 Cu2 F24 N8 O16 P4 -","2","0.5","","Noro, Shin-ichiro; Horike, Satoshi; Tanaka, Daisuke; Kitagawa, Susumu; Akutagawa, Tomoyuki; Nakamura, Takayoshi","Flexible and Shape-Selective Guest Binding at CuIIAxial Sites in 1-Dimensional CuII−1,2-Bis(4-pyridyl)ethane Coordination Polymers","Inorganic Chemistry","2006","45","23","9290","9300","10.1021/ic0609249","","","0.7107","MoKα","","","0.0583","","","","0.1828","","","","","","2.036","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333002","4.006","0.005","11.815","0.015","21.03","0.03","90","","93.53","0.02","90","","993","2","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C16 H13 Ag2 N7 O S2 -","- C16 H13 Ag2 N7 O S2 -","- C32 H26 Ag4 N14 O2 S4 -","2","0.5","","Chi, Ying-Nan; Huang, Kun-Lin; Cui, Feng-Yun; Xu, Yan-Qing; Hu, Chang-Wen","Structural Diversity of Silver(I) 4,6-Dipyridyl-2-Aminopyrimidine Complexes: Effect of Counteranions and Ligand Isomerism","Inorganic Chemistry","2006","45","26","10605","10612","10.1021/ic061231v","","","0.71073","MoKα","","0.1472","0.0743","","","0.1685","0.2044","","","","","","0.974","","","","has coordinates","179433","2020-10-21","18:00:00",""
"4333025","11.162","0.003","7.3381","0.0016","15.441","0.003","90","","107.754","0.005","90","","1204.5","0.5","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C22 H32 Cl Cu N4 O2 -","- C22 H32 Cl Cu N4 O2 -","- C44 H64 Cl2 Cu2 N8 O4 -","2","0.5","","Yang, Lei; Houser, Robert P.","Copper(I) Coordination Chemistry of (Pyridylmethyl)amide Ligands","Inorganic Chemistry","2006","45","23","9416","9422","10.1021/ic0612810","","","0.71073","MoKα","","0.031","0.03","","","0.0791","0.0799","","","","","","1.001","","","","has coordinates","179433","2020-10-21","18:00:00",""
"4333180","17.3615","0.0019","9.5894","0.001","19.127","0.002","90","","95.152","0.003","90","","3171.5","0.6","120","2","120","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C29 H43 Cl4 N Nb P2 -","- C29 H43 Cl4 N Nb P2 -","- C116 H172 Cl16 N4 Nb4 P8 -","4","1","","Kilgore, Uriah J.; Yang, Xiaofan; Tomaszewski, John; Huffman, John C.; Mindiola, Daniel J.","Activation of Atmospheric Nitrogen and Azobenzene NN Bond Cleavage by a Transient Nb(III) Complex","Inorganic Chemistry","2006","45","26","10712","10721","10.1021/ic061642b","","","0.71073","MoKα","","0.084","0.0395","","","0.0735","0.0836","","","","","","0.836","","","","has coordinates","179434","2020-10-21","18:00:00",""
"4333293","15.742","0.0016","12.0853","0.0012","15.7064","0.0015","90","","116.208","0.002","90","","2680.9","0.5","298","2","298","2","","","","","","","","9","P 1 2/c 1","-P 2yc","13","","","","- C84 H88 Cl4 Cu6 F24 N12 O6 P4 S4 -","- C84 H88 Cl4 Cu6 F24 N12 O6 P4 S4 -","- C84 H88 Cl4 Cu6 F24 N12 O6 P4 S4 -","1","0.25","","Manzur, Jorge; Mora, Hector; Vega, Andrés; Spodine, Evgenia; Venegas-Yazigi, Diego; Garland, María Teresa; El Fallah, M. Salah; Escuer, Albert","Copper(II) Complexes with New Polypodal Ligands Presenting Axial−Equatorial Phenoxo Bridges {2-[(Bis(2-pyridylmethyl)amino)methyl]-4-methylphenol, 2-[(Bis(2-pyridylmethyl)amino)methyl]-4-methyl-6-(methylthio)phenol}: Examples of Ferromagnetically Coupled Bi- and Trinuclear Copper(II) Complexes","Inorganic Chemistry","2007","46","17","6924","6932","10.1021/ic700544b","","","0.71073","MoKα","","0.1051","0.0617","","","0.1655","0.1894","","","","","","0.991","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333761","14.256","0.003","13.064","0.003","24.449","0.005","90","","95.777","0.004","90","","4530.3","1.7","200","2","200","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C40 H52 Fe K N4 O9 -","- C36 H44 Fe K N4 O8 -","- C144 H176 Fe4 K4 N16 O32 -","4","1","","Chih-Chin Tsou; Fu-Te Tsai; Huang-Yeh Chen; I-Jui Hsu; Wen-Feng Liaw","Insight into One-Electron Oxidation of the {Fe(NO)2}9 Dinitrosyl Iron Complex (DNIC): Aminyl Radical Stabilized by [Fe(NO)2] Motif","Inorganic Chemistry","2013","52","","1631","1639","10.1021/ic302537d","","","0.71073","MoKα","","0.1161","0.0619","","","0.154","0.1722","","","","","","0.966","","","","has coordinates","179440","2020-10-21","18:00:00",""
"4333873","10.508","0.007","6.427","0.004","23.408","0.014","90","","97.585","0.007","90","","1567","1.7","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Samarium(III) Borate Bromide","","","- B18 Br3 O38 Sm4 -","- B18 Br3 O38 Sm4 -","- B36 Br6 O76 Sm8 -","2","0.5","","Matthew J. Polinski; Evgeny V. Alekseev; Victoria R. Darling; Justin N. Cross; Wulf Depmeier; Thomas E. Albrecht-Schmitt","A New Family of Lanthanide Borate Halides with Unusual Coordination and a New Neodymium-Containing Cationic Framework","Inorganic Chemistry","2013","52","","1965","1975","10.1021/ic302309z","","","0.71073","MoKα","","0.0503","0.0319","","","0.063","0.0684","","","","","","1.029","","","","has coordinates","179441","2020-10-21","18:00:00",""
"4334483","17.1205","0.0002","16.9183","0.0002","21.4057","0.0003","90","","109.292","0.001","90","","5852","0.13","150","2","150","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C116 H158 B Cl F26 P4 Rh2 -","- C116 H157.99 B Cl F26.01 P4 Rh2 -","- C232 H315.98 B2 Cl2 F52.02 P8 Rh4 -","2","0.5","","Laura J. Sewell; Miguel A. Huertos; Molly E. Dickinson; Andrew S. Weller; Guy C. Lloyd-Jones","Dehydrocoupling of Dimethylamine Borane Catalyzed by Rh(PCy3)2H2Cl","Inorganic Chemistry","2013","52","","4509","4516","10.1021/ic302804d","","","0.71073","MoKα","","0.0866","0.0468","","","0.1045","0.1199","","","","","","1.025","","","","has coordinates,has disorder","179447","2020-10-21","18:00:00",""
"4334718","11.572","0.003","5.149","0.002","16.697","0.005","90","","101.295","0.008","90","","975.6","0.5","173","","173","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C19 H26 Cu N4 O5 -","- C19 H22 Cu N4 O5 -","- C38 H44 Cu2 N8 O10 -","2","0.5","","Tatsunari Inoue; Katsunori Yamanishi; Mitsuru Kondo","Solvent-Soluble Coordination Polymer That Reconstructs Cyclic Frameworks That Trap a Kinetically Labile [Cu(CO3)2]2- Unit","Inorganic Chemistry","2013","52","","4765","4767","10.1021/ic400315g","","","0.7107","MoKa/","","","0.0841","","","","0.1873","","","","","","1.01","","","","has coordinates","179450","2020-10-21","18:00:00",""
"4335134","11.2026","0.0005","6.7162","0.0003","13.0527","0.0006","90","","107.457","0.002","90","","936.84","0.07","298","0.2","298","0.2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- In Na1.4 O9.4 Te3.6 -","- In Na1.44 O9.404 Te3.5595 -","- In4 Na5.76 O37.616 Te14.238 -","4","1","","Dong Woo Lee; Kang Min Ok","Na1.4InTe3.6O9.4: New Variant of a Hexagonal Tungsten Oxide (HTO)-Like Layered Framework Containing Both a Main-Group Cation, In3+, and a Lone-Pair Cation, Te4+","Inorganic Chemistry","2013","52","","6236","6238","10.1021/ic4009152","","","0.71073","MoKα","","0.039","0.0299","","","0.0675","0.0705","","","","","","1.064","","","","has coordinates","179454","2020-10-21","18:00:00",""
"4335505","20.418","0.004","7.9129","0.0016","39.212","0.011","90","","121.27","0.02","90","","5415","2","223","2","223","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C33 H25 N4 O10 Y -","- C33 H25 N4 O10 Y -","- C132 H100 N16 O40 Y4 -","4","1","","Jingui Duan; Masakazu Higuchi; Maw Lin Foo; Satoshi Horike; Koya Prabhakara Rao; Susumu Kitagawa","A Family of Rare Earth Porous Coordination Polymers with Different Flexibility for CO2/C2H4 and CO2/C2H6 Separation","Inorganic Chemistry","2013","52","","8244","8249","10.1021/ic401157n","","","0.71073","MoKα","","0.1613","0.1358","","","0.3663","0.3821","","","","","","1.28","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4335554","19.1588","0.0013","11.6924","0.0008","15.8248","0.0009","90","","90","","90","","3545","0.4","180","2","180","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C16 H10 Cd N2 O4 S -","- C16 H10 Cd N2 O4 S -","- C128 H80 Cd8 N16 O32 S8 -","8","2","","Florian Kettner; Christian Worch; Jens Moellmer; Roger Gläser; Reiner Staudt; Harald Krautscheid","Synthesis, Crystal Structure and Catalytic Behavior of Homo- and Heteronuclear Coordination Polymers [M(tdc)(bpy)] (M2+= Fe2+, Co2+, Zn2+, Cd2+; tdc2-= 2,5-thiophenedicarboxylate)","Inorganic Chemistry","2013","52","","8738","8742","10.1021/ic400857s","","x-ray","0.71073","MoKα","","0.151","0.14","","","0.321","0.327","","","","","","1.226","","","","has coordinates","179458","2020-10-21","18:00:00",""
"4335677","25.509","0.002","6.5166","0.0007","10.4197","0.0011","90","","94.253","0.004","90","","1727.3","0.3","143","1","143","1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C14 H56 B20 Si2 -","- C14 H56 B20 Si2 -","- C28 H112 B40 Si4 -","2","0.5","","Shahana Chatterjee; Patrick J. Carroll; Larry G. Sneddon","Iridium and Ruthenium Catalyzed Syntheses, Hydroborations, and Metathesis Reactions of Alkenyl-Decaboranes","Inorganic Chemistry","2013","52","","9119","9130","10.1021/ic401356u","","","0.71073","MoKα","","0.0939","0.0902","","","0.219","0.2211","","","","","","1.159","","","","has coordinates","179459","2020-10-21","18:00:00",""
"4335741","35.585","0.004","16.471","0.002","26.387","0.003","90","","107.758","0.006","90","","14729","3","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C72 H118 Cl2 N4 O6 Ti2 -","- C72 H118 Cl2 N4 O6 Ti2 -","- C576 H944 Cl16 N32 O48 Ti16 -","8","2","","Sónia Barroso; Filipe Madeira; Maria José Calhorda; M. João Ferreira; M. Teresa Duarte; Ana M. Martins","Toward the Understanding of Radical Reactions: Experimental and Computational Studies of Titanium(III) Diamine Bis(phenolate) Complexes","Inorganic Chemistry","2013","52","","9427","9439","10.1021/ic401008y","","x-ray","0.71073","MoKα","","0.1353","0.075","","","0.1904","0.2152","","","","","","1.077","","","","has coordinates,has disorder","179460","2020-10-21","18:00:00",""
"4336209","10.884","","15.726","","14.071","","90","","124","","90","","1996.67","","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C24 H4 Cl8 K4 O23 Zr -","- C24 H4 Cl8 K4 O23 Zr -","- C48 H8 Cl16 K8 O46 Zr2 -","2","0.5","","Inhar Imaz; Georges Mouchaham; Nans Roques; Stéphane Brandès","Tetradihydrobenzoquinonate and Tetrachloranilate Zr(IV) Complexes: Single-Crystal-to-Single-Crystal Phase Transition and Open-Framework Behavior for K4Zr(DBQ)4","Inorganic Chemistry","2013","52","","11237","11243","10.1021/ic401474f","","","0.71073","MoKα","","0.0638","0.0455","","","0.1346","0.1452","","","","","","1.093","","","","has coordinates","179465","2020-10-21","18:00:00",""
"4336434","20.282","0.0009","8.425","0.0004","40.1465","0.0018","90","","91.21","0.003","90","","6858.5","0.5","113","1","113","1","","","","","","","see text","7","P 1 2/c 1","-P 2yc","13","LaineSuperU06_2013","[(ttpy)Ru(tpy-Q-ph)]3(PF6)","","- C73.75 H47 F18 N8 O2.5 P3 Ru -","- C73.54 H47 F18 N8 O2.5 P3 Ru -","- C294.16 H188 F72 N32 O10 P12 Ru4 -","4","1","","Jérôme Fortage; Grégory Dupeyre; Fabien Tuyèras; Valérie Marvaud; Philippe Ochsenbein; Ilaria Ciofini; Magdaléna Hromadová; Lubomír Pospísil; Antonino Arrigo; Emanuela Trovato; Fausto Puntoriero; Philippe P. Lainé; Sebastiano Campagna","Molecular Dyads of Ruthenium(II)- or Osmium(II)-Bis(terpyridine) Chromophores and Expanded Pyridinium Acceptors: Equilibration between MLCT and Charge-Separated Excited States","Inorganic Chemistry","2013","52","","11944","11955","10.1021/ic401639g","","x-ray","1.54178","CuKα","","0.1233","0.0988","","","0.2224","0.2293","","","","","","2.09","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4336636","4.714","0.005","5.459","0.006","4.903","0.005","90","","93.8","0.3","90","","125.9","0.2","300","","300","","","","","","","","HP-DAC","3","P 1 2/c 1","-P 2yc","13","Indium Vanadate","InVO4-V","","- In O4 V -","- In O4 V -","- In2 O8 V2 -","2","0.5","","Daniel Errandonea; Oscar Gomis; Braulio García-Domene; Julio Pellicer-Porres; Vasundhara Katari; S. Nagabhusan Achary; Avesh K. Tyagi; Catalin Popescu","New Polymorph of InVO4: A High-Pressure Structure with Six-Coordinated Vanadium","Inorganic Chemistry","2013","52","","12790","12798","10.1021/ic402043x","powder diffraction","x-ray","0.4246","monochromatic-beam","","","","","","","","","","0.59","","","","","","","has coordinates,has Fobs","179469","2020-10-21","18:00:00",""
"4336638","15.777","0.002","10.6187","0.0015","18.958","0.003","90","","97.359","0.002","90","","3149.9","0.8","200","2","200","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C54 H38 Cd3 O20 -","- C54 H30 Cd3 O20 -","- C108 H60 Cd6 O40 -","2","0.5","","Abhijeet K. Chaudhari; Sanjog S. Nagarkar; Biplab Joarder; Soumya Mukherjee; Sujit K. Ghosh","Structural Dynamism and Controlled Chemical Blocking/Unblocking of Active Coordination Space of a Soft Porous Crystal","Inorganic Chemistry","2013","52","","12784","12789","10.1021/ic402058f","","","0.71073","MoKα","","0.1072","0.0565","","","0.1532","0.1803","","","","","","0.694","","","","has coordinates","179469","2020-10-21","18:00:00",""
"4336639","15.438","0.005","11.075","0.003","19.18","0.005","90","","95.796","0.008","90","","3262.6","1.6","200","2","200","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C70 H64 Cd3 O20 -","- C70 H64 Cd3 O22 -","- C140 H128 Cd6 O44 -","2","0.5","","Abhijeet K. Chaudhari; Sanjog S. Nagarkar; Biplab Joarder; Soumya Mukherjee; Sujit K. Ghosh","Structural Dynamism and Controlled Chemical Blocking/Unblocking of Active Coordination Space of a Soft Porous Crystal","Inorganic Chemistry","2013","52","","12784","12789","10.1021/ic402058f","","","0.71073","MoKα","","0.1224","0.0897","","","0.1874","0.1993","","","","","","1.201","","","","has coordinates","179469","2020-10-21","18:00:00",""
"4336640","15.4481","0.001","11.4391","0.0007","19.1156","0.0013","90","","94.625","0.001","90","","3367","0.4","200","2","200","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C70 H70 Cd3 O24 -","- C70 H62 Cd3 O24 -","- C140 H124 Cd6 O48 -","2","0.5","","Abhijeet K. Chaudhari; Sanjog S. Nagarkar; Biplab Joarder; Soumya Mukherjee; Sujit K. Ghosh","Structural Dynamism and Controlled Chemical Blocking/Unblocking of Active Coordination Space of a Soft Porous Crystal","Inorganic Chemistry","2013","52","","12784","12789","10.1021/ic402058f","","","0.71073","MoKα","","0.0386","0.0342","","","0.094","0.0985","","","","","","0.993","","","","has coordinates","179469","2020-10-21","18:00:00",""
"4336642","16.394","0.005","8.887","0.003","19.103","0.006","90","","98.259","0.007","90","","2754.3","1.5","200","2","200","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C62 H36 Cd3 O20 -","- C62 H30 Cd3 O20 -","- C124 H60 Cd6 O40 -","2","0.5","","Abhijeet K. Chaudhari; Sanjog S. Nagarkar; Biplab Joarder; Soumya Mukherjee; Sujit K. Ghosh","Structural Dynamism and Controlled Chemical Blocking/Unblocking of Active Coordination Space of a Soft Porous Crystal","Inorganic Chemistry","2013","52","","12784","12789","10.1021/ic402058f","","","0.71073","MoKα","","0.1235","0.0855","","","0.2576","0.3059","","","","","","1.164","","","","has coordinates","179469","2020-10-21","18:00:00",""
"4336684","11.7203","0.0007","16.0018","0.0009","22.9976","0.0011","90","","117.61","0.003","90","","3821.9","0.4","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C32 H40 Cl Fe N4 Ni O11.7 -","- C32 H40 Cl Fe N4 Ni O11.7 -","- C128 H160 Cl4 Fe4 N16 Ni4 O46.8 -","4","1","","Susanta Hazra; Sagarika Bhattacharya; Mukesh Kumar Singh; Luca Carrella; Eva Rentschler; Thomas Weyhermueller; Gopalan Rajaraman; Sasankasekhar Mohanta","Syntheses, Structures, Magnetic Properties, and Density Functional Theory Magneto-Structural Correlations of Bis(μ-phenoxo) and Bis(μ-phenoxo)-μ-acetate/Bis(μ-phenoxo)-bis(μ-acetate) Dinuclear FeIIINiII Compounds","Inorganic Chemistry","2013","52","","12881","12892","10.1021/ic400345w","","","0.71073","MoKα","","0.0743","0.0453","","","0.1168","0.136","","","","","","1.027","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4336983","21.2586","0.0013","8.2481","0.0006","18.8198","0.0012","90","","115.402","0.002","90","","2980.9","0.3","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H24 Co F24 N2 O4 -","- C20 H24 Co F24 N2 O4 -","- C80 H96 Co4 F96 N8 O16 -","4","1","","Laleh Tahsini; Sarah E. Specht; June S. Lum; Joshua J. M. Nelson; Alexandra F. Long; James A. Golen; Arnold L. Rheingold; Linda H. Doerrer","Structural and Electronic Properties of Old and New A2[M(pinF)2] Complexes","Inorganic Chemistry","2013","52","","14050","14063","10.1021/ic401837y","","","0.71073","MoKα","","0.0675","0.053","","","0.1304","0.1371","","","","","","1.102","","","","has coordinates","179472","2020-10-21","18:00:00",""
"4337457","19.9611","0.0009","17.2003","0.0009","21.6034","0.0012","90","","102.324","0.003","90","","7246.3","0.6","173","2","173","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C50 H77 Ag3 F18 N3 O8 P3 S8 -","- C46 H71 Ag3 F18 N O8 P3 S8 -","- C184 H284 Ag12 F72 N4 O32 P12 S32 -","4","1","","Siewe, Arlette Deukam; Kim, Ja-Yeon; Kim, Seulgi; Park, In-Hyeok; Lee, Shim Sung","Regioisomer-dependent endo- and exocyclic coordination of bis-dithiamacrocycles.","Inorganic chemistry","2014","53","1","393","398","10.1021/ic402346z","","","0.71073","MoKα","","0.1041","0.071","","","0.2027","0.224","","","","","","1.061","","","","has coordinates","179477","2020-10-21","18:00:00",""
"4337473","11.2556","0.0008","11.2128","0.0008","19.2242","0.0014","90","","93.579","0.001","90","","2421.5","0.3","298","2","298","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C34 H52 Cl2 Cu4 Ge2 I4 N6 -","- C34 H52 Cl2 Cu4 Ge2 I4 N6 -","- C68 H104 Cl4 Cu8 Ge4 I8 N12 -","2","0.5","","Yadav, Dhirendra; Siwatch, Rahul Kumar; Sinhababu, Soumen; Nagendran, Selvarajan","Aminotroponiminato(chloro)germylene stabilized copper(I) iodide complexes: synthesis and structure.","Inorganic chemistry","2014","53","1","600","606","10.1021/ic402742f","","","0.71073","MoKα","","0.0368","0.0284","","","0.0686","0.0717","","","","","","1.044","","","","has coordinates","179477","2020-10-21","18:00:00",""
"4337722","17.31","0.004","9.1759","0.0019","29.294","0.006","90","","95.267","0.007","90","","4633.3","1.7","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C51 H47 B Fe N6 O4 -","- C51 H47 B Fe N6 O4 -","- C204 H188 B4 Fe4 N24 O16 -","4","1","","Paria, Sayantan; Chatterjee, Sayanti; Paine, Tapan Kanti","Reactivity of an Iron-Oxygen Oxidant Generated upon Oxidative Decarboxylation of Biomimetic Iron(II) α-Hydroxy Acid Complexes.","Inorganic chemistry","2014","53","6","2810","2821","10.1021/ic402443r","","","0.71073","MoKα","","0.0877","0.0809","","","0.216","0.2195","","","","","","1.212","","","","has coordinates","179480","2020-10-21","18:00:00",""
"4338055","17.8945","0.0012","12.0688","0.0009","19.1758","0.0014","90","","94.295","0.002","90","","4129.7","0.5","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C36 H42 Cu F6 N7 P2 -","- C36 H42 Cu F6 N7 P2 -","- C144 H168 Cu4 F24 N28 P8 -","4","1","","Haldón, Estela; Delgado-Rebollo, Manuela; Prieto, Auxiliadora; Alvarez, Eleuterio; Maya, Celia; Nicasio, M. Carmen; Pérez, Pedro J","Synthesis, Structural Characterization, Reactivity, and Catalytic Properties of Copper(I) Complexes with a Series of Tetradentate Tripodal Tris(pyrazolylmethyl)amine Ligands.","Inorganic chemistry","2014","53","8","4192","4201","10.1021/ic500311y","","","0.71073","MoKα","","0.0857","0.0679","","","0.1836","0.195","","","","","","1.063","","","","has coordinates","179483","2020-10-21","18:00:00",""
"4338472","24.43","0.005","12.77","0.002","23.873","0.005","90","","101.738","0.004","90","","7292","2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","C67 H62 Bi3 Cl14 N5 O0.50","5(C24 H22 N2), 2(Bi3 Cl14), 2(C6H6CH2O)","","- C134 H124 Bi6 Cl28 N10 O -","- C134 H124 Bi6 Cl28 N10 O -","- C268 H248 Bi12 Cl56 N20 O2 -","2","0.5","","Lin, Rong-Guang; Xu, Gang; Lu, Gang; Wang, Ming-Sheng; Li, Pei-Xin; Guo, Guo-Cong","Photochromic Hybrid Containing In Situ-Generated Benzyl Viologen and Novel Trinuclear [Bi3Cl14](5-): Improved Photoresponsive Behavior by the π···π Interactions and Size Effect of Inorganic Oligomer.","Inorganic chemistry","2014","53","11","5538","5545","10.1021/ic5002144","","","0.71073","MoKα","","0.0619","0.0518","","","0.1109","0.118","","","","","","1.043","","","","has coordinates","179487","2020-10-21","18:00:00",""
"4339095","17.165","0.002","6.732","0.0009","14.886","0.002","90","","109.339","0.002","90","","1623.1","0.4","110","2","110","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H24 Mn N2 O5.5 -","- C14 H24 Mn N2 O5.5 -","- C56 H96 Mn4 N8 O22 -","4","1","","Darensbourg, Donald J.; Frantz, Eric B.","Manganese(III) Schiff base complexes: chemistry relevant to the copolymerization of epoxides and carbon dioxide.","Inorganic chemistry","2007","46","15","5967","5978","10.1021/ic7003968","","","0.71073","MoKα","","0.0728","0.0557","","","0.1361","0.1511","","","","","","1.057","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339109","12.1149","0.0011","8.8183","0.0008","17.3298","0.0016","90","","107.997","0.002","90","","1760.8","0.3","273","2","273","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C4 H23 Co0.5 N3 O15 P0.5 Si2 Zr2 -","- C4 H8 Co0.5 N3 O15 P0.5 Si2 Zr2 -","- C16 H32 Co2 N12 O60 P2 Si8 Zr8 -","4","1","","Du, Yu; Pan, Qinhe; Li, Jiyang; Yu, Jihong; Xu, Ruren","Synthesis, structure, and photoluminescence property of a new layered zirconium phosphate |Co(dien)(2)|[Zr(4)H(8)P(5)O(26)] x 3H(2)O.","Inorganic chemistry","2007","46","15","5847","5851","10.1021/ic061873i","","","0.71073","MoKα","","0.0875","0.0556","","","0.1138","0.1253","","","","","","1.034","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339110","12.1149","0.0011","8.8183","0.0008","17.3298","0.0016","90","","107.997","0.002","90","","1760.8","0.3","273","2","273","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C4 H20 Co0.5 N3 O14.5 P2.5 Zr2 -","- C4 H12.5 Co0.5 N3 O14.5 P2.5 Zr2 -","- C16 H50 Co2 N12 O58 P10 Zr8 -","4","1","","Du, Yu; Pan, Qinhe; Li, Jiyang; Yu, Jihong; Xu, Ruren","Synthesis, structure, and photoluminescence property of a new layered zirconium phosphate |Co(dien)(2)|[Zr(4)H(8)P(5)O(26)] x 3H(2)O.","Inorganic chemistry","2007","46","15","5847","5851","10.1021/ic061873i","","","0.71073","MoKα","","0.0838","0.0514","","","0.0991","0.1097","","","","","","0.992","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339666","23.923","0.005","19.69","0.005","47.387","0.005","90","","97.776","0.005","90","","22116","8","180","","180","","","","","","","","synthesis","6","P 1 2/c 1","-P 2yc","13","","tetra(bis(2,2'-bipyridyl)Manganese(II))di(octacyano Niobium(IV)) cluster","","- C96 H87.25 Mn4 N32 Nb2 O11.62 -","- C96 H64 Mn4 N32 Nb2 O11.625 -","- C768 H512 Mn32 N256 Nb16 O93 -","8","2","","Venkatakrishnan, Thengarai S.; Rajamani, Raghunathan; Ramasesha, S.; Sutter, Jean-Pascal","Synthesis, crystal structure, and magnetic properties of hexanuclear [{MnL2}4{Nb(CN)8}2] and Nonanuclear [{MnL2}6{Nb(CN)8}3] heterometallic clusters (L=bpy, phen).","Inorganic chemistry","2007","46","23","9569","9574","10.1021/ic062383t","","","0.71073","MoKα","","0.2909","0.0944","","0.1324","0.0946","0.0946","","","","","","1.1138","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339671","18.4824","0.001","15.44","0.0008","18.8592","0.001","90","","104.376","0.001","90","","5213.3","0.5","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C31 H46.5 Ce3 Mn2 N6.5 O34.5 -","- C36 H43.5 Ce3 Mn2 N3.5 O34.5 -","- C144 H174 Ce12 Mn8 N14 O138 -","4","1","","Tasiopoulos, Anastasios J.; Milligan, Jr, Paul L; Abboud, Khalil A.; O'Brien, Ted A; Christou, George","Mixed transition metal-lanthanide complexes at high oxidation states: heteronuclear CeIVMnIV clusters.","Inorganic chemistry","2007","46","23","9678","9691","10.1021/ic700994p","","","0.71073","MoKα","","0.0857","0.0571","","","0.1256","0.1361","","","","","","1.117","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4340075","11.8111","0.0012","15.7865","0.0016","14.7769","0.0015","90","","110.309","0.0017","90","","2584","0.5","120","2","120","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H38 Cl P2 Rh -","- C26 H38 Cl P2 Rh -","- C104 H152 Cl4 P8 Rh4 -","4","1","","Barrett, Brittany J.; Iluc, Vlad M.","Coordination of a Hemilabile Pincer Ligand with an Olefinic Backbone to Mid-to-Late Transition Metals.","Inorganic chemistry","2014","53","14","7248","7259","10.1021/ic500549z","","","0.71073","MoKα","","0.0893","0.0627","","","0.0906","0.0958","","","","","","1.146","","","","has coordinates","179503","2020-10-21","18:00:00",""
"4340388","12.9081","0.0006","13.5164","0.0008","13.9807","0.0007","90","","106.833","0.004","90","","2334.7","0.2","173","2","173","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C41 H64 B2 Cl2 Mn2 N8 O3 -","- C41 H64 B2 Cl2 Mn2 N8 O3 -","- C82 H128 B4 Cl4 Mn4 N16 O6 -","2","0.5","","Bieller, Susanne; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","A chloro-bridged dimanganese complex and an oxo-bridged dititanium complex of a ditopic bis(pyrazol-1-yl)borate ligand.","Inorganic chemistry","2005","44","25","9489","9496","10.1021/ic051689h","","","0.71073","MoKα","","0.0805","0.0595","","","0.1204","0.1285","","","","","","1.116","","","","has coordinates","179506","2020-10-21","18:00:00",""
"4340633","9.6911","0.0003","9.0833","0.0003","14.3017","0.0006","90","","103.76","0.004","90","","1222.81","0.08","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C22 H12 Ag2 Fe N16 -","- C22 H12 Ag2 Fe N16 -","- C44 H24 Ag4 Fe2 N32 -","2","0.5","","Yan, Zheng; Li, Jin-Yan; Liu, Tao; Ni, Zhao-Ping; Chen, Yan-Cong; Guo, Fu-Sheng; Tong, Ming-Liang","Enhanced Spin-Crossover Behavior Mediated by Supramolecular Cooperative Interactions.","Inorganic chemistry","2014","53","15","8129","","10.1021/ic5011902","","","1.54178","CuKα","","0.0302","0.0274","","","0.0709","0.0728","","","","","","1.065","","","","has coordinates","179509","2020-10-21","18:00:00",""
"4340634","9.8571","0.0003","9.4122","0.0002","14.2352","0.0005","90","","103.61","0.003","90","","1283.61","0.07","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C22 H12 Ag2 Fe N16 -","- C22 H12 Ag2 Fe N16 -","- C44 H24 Ag4 Fe2 N32 -","2","0.5","","Yan, Zheng; Li, Jin-Yan; Liu, Tao; Ni, Zhao-Ping; Chen, Yan-Cong; Guo, Fu-Sheng; Tong, Ming-Liang","Enhanced Spin-Crossover Behavior Mediated by Supramolecular Cooperative Interactions.","Inorganic chemistry","2014","53","15","8129","","10.1021/ic5011902","","","1.54178","CuKα","","0.048","0.0378","","","0.0941","0.0999","","","","","","1.047","","","","has coordinates","179509","2020-10-21","18:00:00",""
"4340954","16.9326","0.0007","10.5828","0.0004","18.5416","0.0007","90","","97.046","0.002","90","","3297.5","0.2","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C58 H103 Cl3 In2 N8 O3 -","- C50 H87 Cl3 In2 N4 O3 -","- C100 H174 Cl6 In4 N8 O6 -","2","0.5","","Osten, Kimberly M.; Aluthge, Dinesh C.; Patrick, Brian O.; Mehrkhodavandi, Parisa","Probing the role of secondary versus tertiary amine donor ligands for indium catalysts in lactide polymerization.","Inorganic chemistry","2014","53","18","9897","9906","10.1021/ic501529f","","","0.71073","MoKα","","0.0423","0.0287","","","0.0559","0.0591","","","","","","0.983","","","","has coordinates,has disorder","179512","2020-10-21","18:00:00",""
"4341335","11.8066","0.0009","17.9402","0.0015","17.4153","0.0014","90","","107.923","0.005","90","","3509.8","0.5","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C76 H92 N2 P2 S2 -","- C64 H64 N2 P2 S2 -","- C128 H128 N4 P4 S4 -","2","0.5","","Hinz, Alexander; Schulz, Axel; Seidel, Wolfram W.; Villinger, Alexander","A new class of azadipnictiridines generated by an unusual rearrangement reaction.","Inorganic chemistry","2014","53","21","11682","11690","10.1021/ic501905v","","","0.71073","MoKα","","0.15","0.0768","","","0.187","0.2082","","","","","","0.922","","","","has coordinates","179516","2020-10-21","18:00:00",""
"4341743","7.6288","0.0015","5.3699","0.0011","18.995","0.004","90","","100.92","0.03","90","","764.1","0.3","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- Cl Cs K2 Mn3 O14 P4 -","- Cl Cs K2 Mn3 O14 P4 -","- Cl2 Cs2 K4 Mn6 O28 P8 -","2","0.5","","Gao, Jianhua; Li, Jian; Sulejmanovic, Dino; Hwu, Shiou-Jyh","M3(P2O7)2(2-)-Type Open Frameworks Featuring [M2O8] and [M3O12] Multinuclear Transition-Metal Oxide Units. Serendipitous Synthesis of Six Polymorphic Salt-Inclusion Magnetic Solids: Na2M3(P2O7)2·ACl (M = Mn, Fe; A = Rb, Cs) and K2M3(P2O7)2·CsCl (M = Fe, Mn).","Inorganic chemistry","2015","54","3","1136","1144","10.1021/ic5024696","","","0.71073","MoKα","","0.0313","0.0304","","","0.0787","0.0796","","","","","","1.115","","","","has coordinates","179520","2020-10-21","18:00:00",""
"4342265","14.8638","0.0003","10.3919","0.0002","15.4982","0.0003","90","","115.884","0.001","90","","2153.74","0.08","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C52 H44 N10 Ni O -","- C52 H44 N10 Ni O -","- C104 H88 N20 Ni2 O2 -","2","0.5","","Béziau, Antoine; Baudron, Stéphane A; Rogez, Guillaume; Hosseini, Mir Wais","Assembly, disassembly, and reassembly: conversion of homometallic coordination networks into mixed metal-organic frameworks.","Inorganic chemistry","2015","54","4","2032","2039","10.1021/ic502950k","","","0.71073","MoKα","","0.059","0.0435","","","0.1127","0.1272","","","","","","1.093","","","","has coordinates","179525","2020-10-21","18:00:00",""
"4342357","12.613","0.003","7.306","0.0017","13.188","0.003","90","","115.411","0.002","90","","1097.7","0.4","153","2","153","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C3 H11 N15 O0.5 Zn0.5 -","- C3 H11 N15 O0.5 Zn0.5 -","- C12 H44 N60 O2 Zn2 -","4","1","","Li, Fugang; Bi, Yangang; Zhao, Wenyuan; Zhang, Tonglai; Zhou, Zunning; Yang, Li","Nitrogen-Rich Salts Based on the Energetic [Monoaquabis(N,N-bis(1H-tetrazol-5-yl)amine)-zinc(II)] Anion: A Promising Design in the Development of New Energetic Materials.","Inorganic chemistry","2015","54","4","2050","2057","10.1021/ic503021c","","","0.71073","MoKα","","0.0428","0.0365","","","0.0919","0.0968","","","","","","1.002","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4342417","13.6824","0.001","5.2692","0.0005","19.3476","0.0013","90","","129.524","0.004","90","","1075.95","0.16","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- H2 Ni2 O12 Pb Se4 -","- H2 Ni2 O12 Pb Se4 -","- H8 Ni8 O48 Pb4 Se16 -","4","1","","Kovrugin, Vadim M.; Colmont, Marie; Terryn, Christine; Colis, Silviu; Siidra, Oleg I.; Krivovichev, Sergey V.; Mentré, Olivier","pH Controlled Pathway and Systematic Hydrothermal Phase Diagram for Elaboration of Synthetic Lead Nickel Selenites.","Inorganic chemistry","2015","54","5","2425","","10.1021/ic503055v","","","0.71073","MoKα","","0.0783","0.0496","","","0.0992","0.1104","","","","","","1.187","","","","has coordinates","179527","2020-10-21","18:00:00",""
"4342432","12.1171","0.0013","13.884","0.0015","15.8702","0.0018","90","","100.467","0.002","90","","2625.5","0.5","93","","93","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C29 H31 Cl2 P Te -","- C29 H31 Cl2 P Te -","- C116 H124 Cl8 P4 Te4 -","4","1","","Nordheider, Andreas; Hupf, Emanuel; Chalmers, Brian A.; Knight, Fergus R.; Bühl, Michael; Mebs, Stefan; Chęcińska, Lilianna; Lork, Enno; Camacho, Paula Sanz; Ashbrook, Sharon E.; Athukorala Arachchige, Kasun S.; Cordes, David B.; Slawin, Alexandra M. Z.; Beckmann, Jens; Woollins, J. Derek","Peri-Substituted Phosphorus-Tellurium Systems-An Experimental and Theoretical Investigation of the P···Te through-Space Interaction.","Inorganic chemistry","2015","54","5","2435","","10.1021/ic503056z","","","0.71075","MoKα","","","0.0687","","","","0.1971","","","","","","1.206","","","","has coordinates","179527","2020-10-21","18:00:00",""
"4342707","20.2592","0.0014","11.2886","0.0008","12.782","0.0008","90","","93.968","0.003","90","","2916.2","0.3","100","0.5","100","0.5","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C21 H25 B N2 O2 -","- C21 H25 B N2 O2 -","- C126 H150 B6 N12 O12 -","6","1.5","","Nguyen, Alex L.; Bobadova-Parvanova, Petia; Hopfinger, Melissa; Fronczek, Frank R.; Smith, Kevin M.; Vicente, M Graça H","Synthesis and Reactivity of 4,4-Dialkoxy-BODIPYs: An Experimental and Computational Study.","Inorganic chemistry","2015","54","7","3228","3236","10.1021/ic502821m","","","1.54184","CuKα","","0.052","0.0401","","","0.0986","0.1053","","","","","","1.034","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4342892","27.1109","0.001","11.8497","0.0004","27.5348","0.001","90","","115.721","0.002","90","","7969.3","0.5","100","","100","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Na2[Fe(CNArMes2)4]","","","- C100 H100 Fe N4 Na2 -","- C100 H100 Fe N4 Na2 -","- C400 H400 Fe4 N16 Na8 -","4","1","","Mokhtarzadeh, Charles C.; Margulieux, Grant W.; Carpenter, Alex E.; Weidemann, Nils; Moore, Curtis E.; Rheingold, Arnold L.; Figueroa, Joshua S.","Synthesis and protonation of an encumbered iron tetraisocyanide dianion.","Inorganic chemistry","2015","54","11","5579","5587","10.1021/acs.inorgchem.5b00730","","x-ray","1.54178","CuKα","","0.0773","0.0629","","","0.1637","0.1714","","","","","","1.072","","","","has coordinates","138140","2020-10-21","18:00:00",""
"4343031","25.6014","0.0003","14.8269","0.0002","27.3104","0.0004","90","","94.322","0.001","90","","10337.3","0.2","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C72 H46 Cu6 N24 O18 -","- C72 H46 Cu6 N24 O18 -","- C288 H184 Cu24 N96 O72 -","4","1","","Chen, Di-Ming; Zhang, Xiao-Ping; Shi, Wei; Cheng, Peng","Microporous Metal-Organic Framework Based on a Bifunctional Linker for Selective Sorption of CO2 over N2 and CH4.","Inorganic chemistry","2015","54","11","5512","5518","10.1021/acs.inorgchem.5b00561","","","0.71073","MoKα","","0.0665","0.0546","","","0.1601","0.1676","","","","","","1.103","","","","has coordinates,has disorder","138149","2020-10-21","18:00:00",""
"4343032","25.5831","0.0005","14.8084","0.0003","27.2527","0.0011","90","","94.656","0.003","90","","10290.5","0.5","150.05","0.1","150.05","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C72 H48 Cu6 N24 O18 -","- C72 H48 Cu6 N24 O18 -","- C288 H192 Cu24 N96 O72 -","4","1","","Chen, Di-Ming; Zhang, Xiao-Ping; Shi, Wei; Cheng, Peng","Microporous Metal-Organic Framework Based on a Bifunctional Linker for Selective Sorption of CO2 over N2 and CH4.","Inorganic chemistry","2015","54","11","5512","5518","10.1021/acs.inorgchem.5b00561","","","0.71073","MoKα","","0.0919","0.0683","","","0.1936","0.2072","","","","","","1.094","","","","has coordinates,has disorder","138149","2020-10-21","18:00:00",""
"4343216","20.833","0.004","11.573","0.002","15.8","0.003","90","","98.452","0.002","90","","3768","1.2","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","dimer2","","","- C26 N4 O18 U2 -","- C26 N4 O18 U2 -","- C104 N16 O72 U8 -","4","1","","Qiu, Jie; Vlaisavljevich, Bess; Jouffret, Laurent; Nguyen, Kevin; Szymanowski, Jennifer E. S.; Gagliardi, Laura; Burns, Peter C.","Cation templating and electronic structure effects in uranyl cage clusters probed by the isolation of peroxide-bridged uranyl dimers.","Inorganic chemistry","2015","54","9","4445","4455","10.1021/acs.inorgchem.5b00248","","","0.71073","MoKα","","0.0435","0.0358","","","0.093","0.098","","","","","","1.002","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4343806","14.23","","20.26","","5.62","","90","","90","","90","","1620.24","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","","","- B10 D14 -","- B5 D7 -","- B40 D56 -","8","2","","Tippe, A.; Hamilton, W.C.","Neutron diffraction study of decaborane","Inorganic Chemistry","1969","8","","464","470","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4345243","11.2931","0.001","12.9574","0.0011","23.1231","0.0014","90","","99.713","0.003","90","","3335.1","0.5","150","2","150","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C62 H76 Br3 Cl4 N6 P3 Pt3 -","- C62 H76 Br3 Cl4 N6 P3 Pt3 -","- C124 H152 Br6 Cl8 N12 P6 Pt6 -","2","0.5","","Nickolaus, Jan; Imbrich, Dominik A.; Schlindwein, Simon H.; Geyer, Adrian H.; Nieger, Martin; Gudat, Dietrich","Phosphenium Hydride Reduction of [(cod)MX2] (M = Pd, Pt; X = Cl, Br): Snapshots on the Way to Phosphenium Metal(0) Halides and Synthesis of Metal Nanoparticles.","Inorganic chemistry","2017","56","5","3071","3080","10.1021/acs.inorgchem.7b00022","","","0.71073","MoKα","","0.0791","0.0417","","","0.0615","0.0697","","","","","","0.994","","","","has coordinates,has disorder","194798","2020-10-21","18:00:00",""
"4345319","18.006","0.004","5.9554","0.0011","22.538","0.004","90","","99.837","0.006","90","","2381.3","0.8","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H32 N4 O5 S Si -","- C20 H32 N4 O5 S Si -","- C80 H128 N16 O20 S4 Si4 -","4","1","","Zaltariov, Mirela F.; Hammerstad, Marta; Arabshahi, Homayon J.; Jovanović, Katarina; Richter, Klaus W.; Cazacu, Maria; Shova, Sergiu; Balan, Mihaela; Andersen, Niels H.; Radulović, Siniša; Reynisson, Jóhannes; Andersson, K. Kristoffer; Arion, Vladimir B.","New Iminodiacetate-Thiosemicarbazone Hybrids and Their Copper(II) Complexes Are Potential Ribonucleotide Reductase R2 Inhibitors with High Antiproliferative Activity.","Inorganic chemistry","2017","56","6","3532","3549","10.1021/acs.inorgchem.6b03178","","","0.71073","MoKα","","0.0938","0.0535","","","0.1127","0.1281","","","","","","1.026","","","","has coordinates","194815","2020-10-21","18:00:00",""
"4345365","31.882","0.004","17.584","0.002","31.647","0.004","90","","111.001","0.0015","90","","16563","4","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","LiNaU20P6","U-P cluster","","- Li Na18 O162 P6 S U20 -","- Li Na18 O162 P6 S U20 -","- Li4 Na72 O648 P24 S4 U80 -","4","1","","Qiu, Jie; Spano, Tyler L.; Dembowski, Mateusz; Kokot, Alex M.; Szymanowski, Jennifer E. S.; Burns, Peter C.","Sulfate-Centered Sodium-Icosahedron-Templated Uranyl Peroxide Phosphate Cages with Uranyl Bridged by μ-η(1):η(2) Peroxide.","Inorganic chemistry","2017","56","4","1874","1880","10.1021/acs.inorgchem.6b02429","","","0.71073","MoKα","","0.0941","0.0637","","","0.1576","0.1797","","","","","","0.938","","","","has coordinates","192933","2020-10-21","18:00:00",""
"4345711","4.2472","0.0014","6.89","0.004","11.065","0.004","90","","98.104","0.009","90","","320.6","0.2","130","2","130","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C4 H4 Cu I N2 -","- C4 H4 Cu I N2 -","- C8 H8 Cu2 I2 N4 -","2","0.5","","Malaestean, Iurie L.; Kravtsov, Victor Ch; Lipkowski, Janusz; Cariati, Elena; Righetto, Stefania; Marinotto, Daniele; Forni, Alessandra; Fonari, Marina S.","Partial in Situ Reduction of Copper(II) Resulting in One-Pot Formation of 2D Neutral and 3D Cationic Copper(I) Iodide-Pyrazine Coordination Polymers: Structure and Emissive Properties.","Inorganic chemistry","2017","","","","","10.1021/acs.inorgchem.7b00290","","","0.71073","MoKα","","0.0081","0.0081","","","0.0225","0.0225","","","","","","1.002","","","","has coordinates","195564","2020-10-21","18:00:00",""
"4345983","25.3679","0.0003","13.5811","0.0002","26.1203","0.0003","90","","117.98","0.0006","90","","7947.2","0.18","243","2","243","2","","","","","","","","9","P 1 2/c 1","-P 2yc","13","","[Os(bpy)2(dppcb)PtCl2](SbF6)2","","- C72 H60 Cl2 F12 N4 Os P4 Pt Sb2 -","- C72 H60 Cl2 F12 N4 Os P4 Pt Sb2 -","- C288 H240 Cl8 F48 N16 Os4 P16 Pt4 Sb8 -","4","1","","Sylvia Eller; Barbara Trettenbrein; Dennis Oberhuber; Christof Strabler; Rene Gutmann; Wytze E. van der Veer; Markus Ruetz; Holger Kopacka; Dagmar Obendorf; Peter Bruggeller","Oxidative quenching within photosensitizer-acceptor dyads based on bis(bidentate) phosphine-connected osmium(II) bipyridyl light absorbers and reactive metal sites","Inorganic Chemistry Communications","2012","23","","41","45","10.1016/j.inoche.2012.06.001","","","0.71073","MoKα","","0.0924","0.0469","","","0.116","0.1933","","","","","","1.03","","","","has coordinates","205244","2020-10-21","18:00:00",""
"4346328","31.221","0.004","15.0144","0.0018","20.073","0.002","90","","95.027","0.003","90","","9373.3","1.9","150","2","150","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C64 H112 Br4 O24 P4 S8 Zn4 -","- C64 H112 Br4 O24 P4 S8 Zn4 -","- C256 H448 Br16 O96 P16 S32 Zn16 -","4","1","","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","","0.0781","0.072","","","0.1298","0.1326","","","","","","1.152","","","","has coordinates","231728","2020-10-21","18:00:00",""
"4346891","19.024","0.0011","14.9753","0.0008","20.8994","0.0012","90","","95.574","0.002","90","","5925.9","0.6","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C54 H39 Cl2 N11 O8 Os -","- C54 H39 Cl2 N11 O8 Os -","- C216 H156 Cl8 N44 O32 Os4 -","4","1","","Karmakar, Srikanta; Mardanya, Sourav; Pal, Poulami; Baitalik, Sujoy","Design of Multichannel Osmium-Based Metalloreceptor for Anions and Cations by Taking Profit from Metal-Ligand Interaction and Construction of Molecular Keypad Lock and Memory Device.","Inorganic chemistry","2015","54","24","11813","11825","10.1021/acs.inorgchem.5b02300","","","0.71073","MoKα","","0.0865","0.0603","","","0.1676","0.1792","","","","","","1.131","","","","has coordinates","232048","2020-10-21","18:00:00",""
"4347292","24.54658","0.00018","11.25766","0.00008","22.79169","0.00015","90","","98.946","0.0007","90","","6221.57","0.08","124","1","124","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C74 H86 Ga N2 Ni -","- C74 H86 Ga N2 Ni -","- C296 H344 Ga4 N8 Ni4 -","4","1","","Chakraborty, Uttam; Mühldorf, Bernd; van Velzen, Niels J. C.; de Bruin, Bas; Harder, Sjoerd; Wolf, Robert","[Cp(Ar)Ni{Ga(nacnac)}]: An Open-Shell Nickel(I) Complex Supported by a Gallium(I) Carbenoid (Cp(Ar) = C5(C6H4-4-Et)5, nacnac = HC[C(Me)N-(C6H3)-2,6-iPr2]2).","Inorganic chemistry","2016","55","6","3075","3078","10.1021/acs.inorgchem.5b02979","","x-ray","1.54184","CuKα","","0.0382","0.033","","","0.0818","0.086","","","","","","1.029","","","","has coordinates,has disorder","232248","2020-10-21","18:00:00",""
"4347311","16.29","0.03","11.09","0.02","16.96","0.03","90","","109.86","0.03","90","","2882","9","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C32 H44 Cu4 I4 N4 O4 Si4 -","- C32 H44 Cu4 I4 N4 O4 Si4 -","- C64 H88 Cu8 I8 N8 O8 Si8 -","2","0.5","","Deshmukh, Mahesh S.; Vijayakanth, Thangavel; Boomishankar, Ramamoorthy","Stereochemically Distinct Cyclotetrasiloxanes Containing 3-Pyridyl Moieties and Their Functional Coordination Polymers.","Inorganic chemistry","2016","55","6","3098","3104","10.1021/acs.inorgchem.6b00001","","","0.71073","MoKα","","0.5163","0.1796","","","0.4207","0.5447","","","","","","1.028","","","","has coordinates","232259","2020-10-21","18:00:00",""
"4347313","14.588","0.003","11.141","0.002","20.125","0.004","90","","108.21","0.03","90","","3107","1.2","113","2","113","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C47 H35 Cu Dy F30 N8 O14 -","- C47 H35 Cu Dy F30 N8 O14 -","- C94 H70 Cu2 Dy2 F60 N16 O28 -","2","0.5","","Zhu, Mei; Li, Cun; Wang, Xiufeng; Li, Licun; Sutter, Jean-Pascal","Thermal Magnetic Hysteresis in a Copper-Gadolinium-Radical Chain Compound.","Inorganic chemistry","2016","55","6","2676","2678","10.1021/acs.inorgchem.6b00004","","","0.71073","MoKα","","0.0892","0.0815","","","0.2022","0.2106","","","","","","1.068","","","","has coordinates","232261","2020-10-21","18:00:00",""
"4347314","15.109","0.003","11.113","0.002","20.228","0.004","90","","107.22","0.03","90","","3244.2","1.2","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C47 H35 Cu F30 Gd N8 O14 -","- C47 H35 Cu F30 Gd N8 O14 -","- C94 H70 Cu2 F60 Gd2 N16 O28 -","2","0.5","","Zhu, Mei; Li, Cun; Wang, Xiufeng; Li, Licun; Sutter, Jean-Pascal","Thermal Magnetic Hysteresis in a Copper-Gadolinium-Radical Chain Compound.","Inorganic chemistry","2016","55","6","2676","2678","10.1021/acs.inorgchem.6b00004","","","0.71073","MoKα","","0.1454","0.0956","","","0.2078","0.2369","","","","","","1.024","","","","has coordinates,has disorder","232262","2020-10-21","18:00:00",""
"4347315","14.58","0.003","11.217","0.002","20.13","0.004","90","","108.29","0.03","90","","3125.8","1.2","113","2","113","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C47 H35 Cu F30 Gd N8 O14 -","- C47 H35 Cu F30 Gd N8 O14 -","- C94 H70 Cu2 F60 Gd2 N16 O28 -","2","0.5","","Zhu, Mei; Li, Cun; Wang, Xiufeng; Li, Licun; Sutter, Jean-Pascal","Thermal Magnetic Hysteresis in a Copper-Gadolinium-Radical Chain Compound.","Inorganic chemistry","2016","55","6","2676","2678","10.1021/acs.inorgchem.6b00004","","","0.71073","MoKα","","0.0843","0.0789","","","0.2009","0.2057","","","","","","1.031","","","","has coordinates","232263","2020-10-21","18:00:00",""
"4347316","15.071","0.003","11.095","0.002","20.235","0.004","90","","107.42","0.03","90","","3228.4","1.2","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C47 H35 Cu Dy F30 N8 O14 -","- C47 H35 Cu Dy F30 N8 O14 -","- C94 H70 Cu2 Dy2 F60 N16 O28 -","2","0.5","","Zhu, Mei; Li, Cun; Wang, Xiufeng; Li, Licun; Sutter, Jean-Pascal","Thermal Magnetic Hysteresis in a Copper-Gadolinium-Radical Chain Compound.","Inorganic chemistry","2016","55","6","2676","2678","10.1021/acs.inorgchem.6b00004","","","0.71073","MoKα","","0.1317","0.099","","","0.2206","0.2428","","","","","","1.014","","","","has coordinates,has disorder","232264","2020-10-21","18:00:00",""
"4347334","14.0939","0.0004","16.1868","0.0004","19.7136","0.0005","90","","93.6396","0.0018","90","","4488.3","0.2","103","2","103","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C38 H54 Ge2 N4 Se2 Si4 -","- C38 H54 Ge2 N4 Se2 Si4 -","- C152 H216 Ge8 N16 Se8 Si16 -","4","1","","Leung, Wing-Por; Chan, Yuk-Chi; So, Cheuk-Wai; Mak, Thomas C. W.","Reactivity Study of a Pyridyl-1-azaallylgermanium(I) Dimer: Synthesis of Heavier Ether and Ester Analogues of Germanium.","Inorganic chemistry","2016","55","7","3553","3557","10.1021/acs.inorgchem.6b00026","","","0.71073","","","0.1288","0.0648","","","0.1243","0.143","","","","","","1.177","","","","has coordinates,has disorder","232271","2020-10-21","18:00:00",""
"4347588","11.4745","0.0004","8.357","0.0003","13.5663","0.0006","90","","114.23","0.003","90","","1186.3","0.08","133","2","133","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H40 Cl Co N P2 -","- C20 H40 Cl Co N P2 -","- C40 H80 Cl2 Co2 N2 P4 -","2","0.5","","Lagaditis, Paraskevi O.; Schluschaß, Bastian; Demeshko, Serhiy; Würtele, Christian; Schneider, Sven","Square-Planar Cobalt(III) Pincer Complex.","Inorganic chemistry","2016","55","9","4529","4536","10.1021/acs.inorgchem.6b00369","","","0.71073","MoKα","","0.0448","0.0328","","","0.072","0.0756","","","","","","1.008","","","","has coordinates","232393","2020-10-21","18:00:00",""
"4348903","20.896","0.004","7.3872","0.0015","31.834","0.004","90","","124.636","0.009","90","","4043.1","1.3","296","2","296.15","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C72 H40 F24 N6 O19 Zn5 -","- C72 H40 F24 N6 O18 Zn5 -","- C144 H80 F48 N12 O36 Zn10 -","2","0.5","","Hou, Bing-Lei; Tian, Dan; Liu, Jiang; Dong, Long-Zhang; Li, Shun-Li; Li, Dong-Sheng; Lan, Ya-Qian","A Water-Stable Metal-Organic Framework for Highly Sensitive and Selective Sensing of Fe<sup>3+</sup> Ion.","Inorganic chemistry","2016","55","20","10580","10586","10.1021/acs.inorgchem.6b01809","","","0.71073","MoKα","","0.1108","0.0801","","","0.1932","0.2086","","","","","","1.065","","","","has coordinates","233479","2020-10-21","18:00:00",""
"4349079","15.7367","0.0008","15.1562","0.0007","15.297","0.0008","90","","113.649","0.002","90","","3342.1","0.3","100","2","100","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","JA-MA-130","","","- C52 H104 F12 Ir2 N4 O3 P4 Sb2 -","- C52 H104 F12 Ir2 N4 O3 P4 Sb2 -","- C104 H208 F24 Ir4 N8 O6 P8 Sb4 -","2","0.5","","Abbenseth, Josh; Finger, Markus; Würtele, Christian; Kasanmascheff, Müge; Schneider, Sven","Coupling of terminal iridium nitrido complexes","Inorganic Chemistry Frontiers","2016","3","4","469","","10.1039/C5QI00267B","","","0.71073","MoKα","","0.0369","0.0266","","","0.0544","0.06","","","","","","1.229","","","","has coordinates,has disorder","233570","2020-10-21","18:00:00",""
"4349095","12.7711","0.0017","21.197","0.003","15.366","0.002","90","","97.636","0.002","90","","4122.8","1","153","2","153","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C80 H93 Cl N6 Ni6 O22 S3 -","- C80 H93 Cl N6 Ni6 O22 S3 -","- C160 H186 Cl2 N12 Ni12 O44 S6 -","2","0.5","","Schmitz, Sebastian; van Leusen, Jan; Ellern, Arkady; Kögerler, Paul; Monakhov, Kirill Yu.","Thioether-terminated nickel(ii) coordination clusters with {Ni6} horseshoe- and {Ni8} rollercoaster-shaped cores","Inorganic Chemistry Frontiers","2016","3","4","523","","10.1039/C5QI00278H","","","0.71073","MoKα","","0.0578","0.0381","","","0.0844","0.0944","","","","","","1.012","","","","has coordinates","233576","2020-10-21","18:00:00",""
"4349189","13.024","0.003","9.1413","0.0018","13.691","0.003","90","","103.89","0.03","90","","1582.3","0.6","133","2","133","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C21 H41 Cl Fe2 N12 O8 -","- C21 H41 Cl Fe2 N12 O8 -","- C42 H82 Cl2 Fe4 N24 O16 -","2","0.5","","Kindermann, Nicole; Schober, Anne; Demeshko, Serhiy; Lehnert, Nicolai; Meyer, Franc","Reductive Transformations of a Pyrazolate-Based Bioinspired Diiron-Dinitrosyl Complex.","Inorganic chemistry","2016","55","21","11538","11550","10.1021/acs.inorgchem.6b02080","","","0.71073","MoKα","","0.1172","0.0894","","","0.2399","0.2542","","","","","","1.064","","","","has coordinates","233683","2020-10-21","18:00:00",""
"4349290","10.5785","0.0005","14.4939","0.0006","20.5","0.0009","90","","97.355","0.002","90","","3117.3","0.2","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C28.5 H23 Cd N2 O6 -","- C28.5 H19 Cd N2 O6 -","- C114 H76 Cd4 N8 O24 -","4","1","","An, Litao; Wang, Hao; Xu, Feng; Wang, Xin-Long; Wang, Fangming; Li, Jing; Teat, Simon","Selective Carbon Dioxide Adsorption by Two Robust Microporous Coordination Polymers.","Inorganic chemistry","2016","55","24","12923","12929","10.1021/acs.inorgchem.6b02332","","","0.7749","synchrotron","","0.0591","0.0466","","","0.117","0.1282","","","","","","1.024","","","","has coordinates","233820","2020-10-21","18:00:00",""
"4349291","10.4985","0.0004","14.5262","0.0005","20.636","0.0008","90","","97.611","0.002","90","","3119.3","0.2","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C59 H42 Cd2 N4 O8 -","- C59 H42 Cd2 N4 O8 -","- C118 H84 Cd4 N8 O16 -","2","0.5","","An, Litao; Wang, Hao; Xu, Feng; Wang, Xin-Long; Wang, Fangming; Li, Jing; Teat, Simon","Selective Carbon Dioxide Adsorption by Two Robust Microporous Coordination Polymers.","Inorganic chemistry","2016","55","24","12923","12929","10.1021/acs.inorgchem.6b02332","","","0.7749","synchrotron","","0.0534","0.0356","","","0.0846","0.0905","","","","","","1.033","","","","has coordinates","233823","2020-10-21","18:00:00",""
"4349568","23.3002","0.0004","13.24618","0.00016","24.306","0.0004","90","","114.454","0.002","90","","6828.8","0.2","179.99","0.1","179.99","0.1","","","","","","","no","6","P 1 2/c 1","-P 2yc","13","4-1","4-1","","- C78 H78 B2 Fe N6 O4 -","- C78 H78 B2 Fe N6 O4 -","- C312 H312 B8 Fe4 N24 O16 -","4","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","","0.0475","0.0379","","","0.0948","0.1002","","","","","","1.055","","","","has coordinates","234891","2020-10-21","18:00:00",""
"4349569","23.401","0.002","13.517","0.0013","24.582","0.002","90","","113.656","0.001","90","","7122.2","1.1","296","2","296.15","","","","","","","","no","6","P 1 2/c 1","-P 2yc","13","4-2","4-2","","- C78 H78 B2 Fe N6 O4 -","- C78 H78 B2 Fe N6 O4 -","- C312 H312 B8 Fe4 N24 O16 -","4","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","","0.0892","0.048","","","0.1146","0.1274","","","","","","1.009","","","","has coordinates","234891","2020-10-21","18:00:00",""
"4349890","24.2809","0.0013","10.2995","0.0007","16.5074","0.0008","90","","94.05","0.006","90","","4117.9","0.4","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C38 H22 F9 Gd N4 O6 S3 -","- C37.977 H22 F9 Gd N4 O6 S3 -","- C151.908 H88 F36 Gd4 N16 O24 S12 -","4","1","","Khistiaeva, Viktoria V.; Melnikov, Alexey S.; Slavova, Sofia O.; Sizov, Vladimir V.; Starova, Galina L.; Koshevoy, Igor O.; Grachova, Elena V.","Heteroleptic β-diketonate Ln(iii) complexes decorated with pyridyl substituted pyridazine ligands: synthesis, structure and luminescence properties","Inorganic Chemistry Frontiers","2018","5","12","3015","","10.1039/C8QI00712H","","","0.7107","MoKα","","0.0767","0.0565","","","0.118","0.1287","","","","","","1.063","","","","has coordinates,has disorder","236925","2020-10-21","18:00:00",""
"4349893","24.2613","0.0011","10.2407","0.0005","16.5383","0.0006","90","","93.893","0.004","90","","4099.5","0.3","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C38 H23 Eu F9 N4 O6 S3 -","- C38 H23 Eu F9 N4 O6 S3 -","- C152 H92 Eu4 F36 N16 O24 S12 -","4","1","","Khistiaeva, Viktoria V.; Melnikov, Alexey S.; Slavova, Sofia O.; Sizov, Vladimir V.; Starova, Galina L.; Koshevoy, Igor O.; Grachova, Elena V.","Heteroleptic β-diketonate Ln(iii) complexes decorated with pyridyl substituted pyridazine ligands: synthesis, structure and luminescence properties","Inorganic Chemistry Frontiers","2018","5","12","3015","","10.1039/C8QI00712H","","x-ray","0.71073","MoKα","","0.1165","0.0988","","","0.2146","0.2257","","","","","","1.166","","","","has coordinates,has disorder","236925","2020-10-21","18:00:00",""
"4349999","10.082","0.005","13.637","0.005","20.12","0.005","90","0.005","97.575","0.005","90","0.005","2742.1","1.8","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C27 H15 N3 O9 Zn -","- C27 H15 N3 O9 Zn -","- C108 H60 N12 O36 Zn4 -","4","1","","Dhankhar, Sandeep Singh; Sharma, Nayuesh; Nagaraja, C. M.","Construction of bifunctional 2-fold interpenetrated Zn(ii) MOFs exhibiting selective CO2 adsorption and aqueous-phase sensing of 2,4,6-trinitrophenol","Inorganic Chemistry Frontiers","2019","6","4","1058","","10.1039/C9QI00044E","","","0.71073","MoKα","","0.0923","0.0717","","","0.2297","0.2462","","","","","","1.079","","","","has coordinates","237928","2020-10-21","18:00:00",""
"4350157","13.624","0.002","16.235","0.003","30.292","0.005","90","","100.617","0.002","90","","6585.5","1.9","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C60 H44 Cu6 I6 N12 -","- C60 H44 Cu6 I6 N12 -","- C240 H176 Cu24 I24 N48 -","4","1","","Thébault, Frédéric; Barnett, Sarah A.; Blake, Alexander J.; Wilson, Claire; Champness, Neil R.; Schröder, Martin","Control of copper(I) iodide architectures by ligand design: angular versus linear bridging ligands.","Inorganic chemistry","2006","45","16","6179","6187","10.1021/ic052130k","","","0.71073","MoKα","","0.13","0.0858","","","0.247","0.264","","","","","","1.049","","","","has coordinates","239767","2020-10-21","18:00:00",""
"4350385","24.576","0.004","14.463","0.002","22.823","0.004","90","","100.554","0.003","90","","7975","2","203","2","203","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","Complex 9 (Tekeste), [(Tp(Ph,Me)Zn)2]-OH-tetraphenylborat","Bis[Hydrotris(3-phenyl-5-methyl-pyrazol-1-yl)borato-zink]-Hydroxid-ph4B","","- C90 H88 B3 N12 O3 Zn2 -","- C90 H88 B3 N12 O3 Zn2 -","- C360 H352 B12 N48 O12 Zn8 -","4","1","","Ibrahim, Mohamed M.; Olmo, Cristina Pérez; Tekeste, Teame; Seebacher, Jan; He, Guosen; Maldonado Calvo, José A; Böhmerle, Karin; Steinfeld, Gunther; Brombacher, Horst; Vahrenkamp, Heinrich","Zn-OH2 and Zn-OH complexes with hydroborate-derived tripod ligands: a comprehensive study.","Inorganic chemistry","2006","45","18","7493","7502","10.1021/ic060752f","","","0.71073","MoKα","","0.0933","0.0466","","","0.1105","0.136","","","","","","1.012","","","","has coordinates","239866","2020-10-21","18:00:00",""
"4350444","11.335","0.002","9.463","0.001","13.116","0.002","90","","113.13","0.01","90","","1293.8","0.3","200","2","200","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","(TcCl3(DMSO)2)O","mu2-oxo-bis{trichlorobis(dimethylsulfoxide)technetium(IV)}","","- C8 H24 Cl6 O5 S4 Tc2 -","- C8 H24 Cl6 O5 S4 Tc2 -","- C16 H48 Cl12 O10 S8 Tc4 -","2","0.5","","Hagenbach, Adelheid; Yegen, Eda; Abram, Ulrich","Technetium tetrachloride as a precursor for small technetium(IV) complexes.","Inorganic chemistry","2006","45","18","7331","7338","10.1021/ic060896u","","","0.71069","MoKα","","0.1514","0.0966","","","0.2425","0.2701","","","","","","0.953","","","","has coordinates","239897","2020-10-21","18:00:00",""
"4350641","20.1256","0.0013","7.1107","0.0005","22.3628","0.0014","90","","111.708","0.004","90","","2973.3","0.3","90","","90","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C34 H33 N7 -","- C34 H33 N7 -","- C136 H132 N28 -","4","1","","Karasawa, Satoru; Nakano, Kimihiro; Yoshihara, Daisuke; Yamamoto, Noriko; Tanokashira, Jun-ichi; Yoshizaki, Takahito; Inagaki, Yuji; Koga, Noboru","Magnetic properties of 1:2 mixed cobalt(II) salicylaldehyde Schiff-base complexes with pyridine ligands carrying high-spin carbenes (Scar = 2/2, 4/2, 6/2, and 8/2) in dilute frozen solutions: role of organic spin in heterospin single-molecule magnets.","Inorganic chemistry","2014","53","11","5447","5457","10.1021/ic403074d","","","1.54187","CuKα","","","0.0841","","","","0.2714","","","","","","1.116","","","","has coordinates","239976","2020-10-21","18:00:00",""
"4350668","9.7137","0.0011","14.5743","0.0016","14.5114","0.0016","90","","105.012","0.0013","90","","1984.3","0.4","196","2","196.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C30 Cu N5 O21 U3 -","- C30 Cu N5 O21 U3 -","- C60 Cu2 N10 O42 U6 -","2","0.5","","Weng, Zhehui; Zhang, Zhi-hui; Olds, Travis; Sterniczuk, Marcin; Burns, Peter C.","Copper(I) and copper(II) uranyl heterometallic hybrid materials.","Inorganic chemistry","2014","53","15","7993","7998","10.1021/ic5007814","","","0.71073","MoKα","","0.0437","0.0296","","","0.0624","0.0681","","","","","","1.027","","","","has coordinates","239980","2020-10-21","18:00:00",""
"4350790","24.189","0.004","11.77","0.002","24.316","0.004","90","","101.937","0.003","90","","6773","2","","","200","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","(μ3-Hydroxo)-(μ2-hydroxo)-tris(μ2-biphenyl-4-ylboronato) -bis(μ2-oxo)-tris(η5-pentamethyl-cyclopentadienyl)-tri-tantalum acetone solvate","","- C70.5 H83 B3 O11.5 Ta3 -","- C74.5 H83 B3 O13 Ta3 -","- C298 H332 B12 O52 Ta12 -","4","1","","Christian N. Garon; Maxime Daigle; Isabelle Levesque; Philippe Dufour; Hassan Iden; Christian Tessier; Thierry Maris; Jean-François Morin; Frédéric-Georges Fontaine","On the Interaction of Acetone with Electrophilic Metallocavitands Having Extended Cavities","Inorganic Chemistry","2012","51","","10384","10393","10.1021/ic3015755","","","","","","","0.0514","","","0.0514","","","","","","","","","","","has coordinates","260386","2021-01-03","16:05:01",""
"4350809","13.0893","0.0011","8.9978","0.0007","31.5216","0.0019","90","","102.96","0.003","90","","3617.9","0.5","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C41 H32 N3 O9 Zn -","- C41 H32 N3 O9 Zn -","- C164 H128 N12 O36 Zn4 -","4","1","","Zhang, Chuan-Lei; Xu, Heng; Song, Xiao-Wei; Meng, Yan; Chen, Jing-Juan","Three d10 coordination polymers based on rigid ligands with flexible functional groups: Syntheses, structures and luminescence","Inorganic Chemistry Communications","2017","84","","229","233","10.1016/j.inoche.2017.09.003","","","0.71073","MoKα","","0.1013","0.0764","","","0.2268","0.2437","","","","","","1.059","","","","has coordinates","272315","2022-01-28","08:13:18",""
"4500024","10.5537","0.0008","7.544","0.0006","18.6318","0.0014","90","","115.3","0.004","90","","1341.13","0.18","150","","150","","","","","","","","Synthesized by the authors. See text","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H22 Ag Cl N14 O4 -","- C20 H22 Ag Cl N14 O4 -","- C40 H44 Ag2 Cl2 N28 O8 -","2","0.5","","Duong, Adam; Valérie Métivaud; Maris, Thierry; Wuest,James D","Surrogates of 2,2'-Bipyridine Designed to Chelate Ag(I) and Create Metallotectons for Engineering Hydrogen-Bonded Crystals","Cryst. Growth & Design","2011","11","","2026","2034","10.1021/cg2003194","","","1.54178","CuKα","","0.0658","0.0652","","","0.1555","0.1558","","","","","","1.099","","","","has coordinates,has disorder","179531","2020-10-21","18:00:00",""
"4500607","10.2135","0.0005","13.8853","0.0006","18.1964","0.0008","90","","103.173","0.001","90","","2512.7","0.2","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C80 H52 I4 Mn4 N8 O21 -","- C80 H52 I4 Mn4 N8 O21 -","- C80 H52 I4 Mn4 N8 O21 -","1","0.25","","Zang, Shuang-Quan; Fan, Ya-Juan; Li, Jia-Bin; Hou, Hong-Wei; Mak, Thomas C. W.","Halogen Bonding in the Assembly of Coordination Polymers Based on 5-Iodo-Isophthalic Acid","Crystal Growth & Design","2011","11","8","3395","","10.1021/cg200022j","","","0.71073","MoKα","","0.0696","0.0561","","","0.1982","0.2077","","","","","","1.095","","","","has coordinates,has disorder","179537","2020-10-21","18:00:00",""
"4500715","13.909","0.002","6.3867","0.0009","35.945","0.005","90","","100.628","0.003","90","","3138.3","0.8","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C27 H53 F6 N2 Sb -","- C27 H53 F6 N2 Sb -","- C108 H212 F24 N8 Sb4 -","4","1","","Wang, Xinjiao; Vogel, Carola S.; Heinemann, Frank W.; Wasserscheid, Peter; Meyer, Karsten","Solid-State Structures of Double-Long-Chain Imidazolium Ionic Liquids: Influence of Anion Shape on Cation Geometry and Crystal Packing","Crystal Growth & Design","2011","11","5","1974","","10.1021/cg200169u","","","0.71073","","","0.0466","0.0352","","","0.079","0.0836","","","","","","1.07","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4500862","18.82","0.016","7.292","0.006","23.444","0.015","90","","123.17","0.05","90","","2693","4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C25.5 H13 F9 O6 Zn -","- C25.5 H13 F9 O6 Zn -","- C102 H52 F36 O24 Zn4 -","4","1","","Wu, Ya-Pan; Li, Dong-Sheng; Fu, Feng; Dong, Wen-Wen; Zhao, Jun; Zou, Kun; Wang, Yao-Yu","Stoichiometry of N-Donor Ligand Mediated Assembly in the ZnII-Hfipbb System: From a 2-Fold Interpenetrating Pillared-Network to Unique (3,4)-Connected Isomeric Nets","Crystal Growth & Design","2011","11","9","3850","","10.1021/cg200389q","","","0.71073","MoKα","","0.1178","0.0987","","","0.2914","0.3077","","","","","","1.031","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500984","9.9686","0.0012","9.3686","0.0007","24.551","0.003","90","","90.215","0.011","90","","2292.8","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C41 H39 N4 Ni2 O18 -","- C41 H30.994 N4 Ni2 O18 -","- C82 H61.988 N8 Ni4 O36 -","2","0.5","","Guo, Jiao; Ma, Jian-Fang; Liu, Bo; Kan, Wei-Qiu; Yang, Jin","A Series of 2D and 3D Metal‒Organic Frameworks Based on a Flexible Tetrakis(4-pyridyloxymethylene)methane Ligand and Polycarboxylates: Syntheses, Structures, and Photoluminescent Properties","Crystal Growth & Design","2011","11","8","3609","","10.1021/cg200581w","","","0.71073","MoKα","","0.1362","0.0598","","","0.1305","0.1442","","","","","","0.81","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4501608","10.3376","0.0011","9.4092","0.001","24.353","0.003","90","","93.978","0.002","90","","2363.1","0.5","273","2","273","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C41 H36 Co2 N4 O16 -","- C41 H36 Co2 N4 O16 -","- C82 H72 Co4 N8 O32 -","2","0.5","","Hu, Jin-Song; Shang, Yong-Jia; Yao, Xiao-qiang; Qin, Ling; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen; Xue, Zi-Ling","Syntheses, Structures, and Photoluminescence of Five New Metal−Organic Frameworks Based on Flexible Tetrapyridines and Aromatic Polycarboxylate Acids","Crystal Growth & Design","2010","10","6","2676","","10.1021/cg1001557","","","0.71073","MoKα","","0.0604","0.0547","","","0.1546","0.1589","","","","","","1.064","","","","has coordinates","179547","2020-10-21","18:00:00",""
"4501746","8.1653","0.0008","7.7354","0.0005","15.2305","0.0011","90","","109.283","0.005","90","","908.02","0.13","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C9 H9 Co0.5 N2 O2 -","- C9 H9 Co0.5 N2 O2 -","- C36 H36 Co2 N8 O8 -","4","1","","Li, Xiaoju; Weng, Xiulan; Tang, Ruijie; Lin, Yuanmiao; Ke, Zhilong; Zhou, Wenbiao; Cao, Rong","Conformational Isomerism of 1,2-Bis(imidazol-1′-yl)ethane Affected by the Orientation of Functional Carboxylate Groups in Cadmium and Cobalt Helical Coordination Polymers","Crystal Growth & Design","2010","10","7","3228","","10.1021/cg100350b","","","0.71073","MoKα","","0.0405","0.0371","","","0.0963","0.0987","","","","","","1.087","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4501853","9.4815","0.0019","8.6468","0.0018","12.217","0.003","90","","110.667","0.003","90","","937.2","0.4","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H20 Ag2 N6 O5 -","- C14 H20 Ag2 N6 O5 -","- C28 H40 Ag4 N12 O10 -","2","0.5","","Sun, Di; Zhang, Na; Huang, Rong-Bin; Zheng, Lan-Sun","Series of Ag(I) Coordination Complexes Derived from Aminopyrimidyl Ligands and Dicarboxylates: Syntheses, Crystal Structures, and Properties","Crystal Growth & Design","2010","10","8","3699","","10.1021/cg100554u","","","0.71073","MoKα","","0.0311","0.0291","","","0.0655","0.0665","","","","","","1.175","","","","has coordinates","179549","2020-10-21","18:00:00",""
"4502029","10.219","0.004","6.155","0.001","16.422","0.005","90","","102.1","0.01","90","","1010","0.5","294","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C10 H19 O2.5 -","- C10 H19 O2.5 -","- C40 H76 O10 -","4","1","","Chan, Isa Y. H.; Nguyen, Vi T.; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.","The Design of “Awkward” Molecules Expected to Yield Multiple Crystal Forms30†","Crystal Growth & Design","2010","10","10","4582","","10.1021/cg100883s","","x-ray","0.71073","MoKα","","","0.048","","","","0.054","","","","","","1.42","","","","has coordinates","179551","2020-10-21","18:00:00",""
"4502106","13.781","0.004","9.697","0.002","14.046","0.004","90","","117.899","0.005","90","","1658.9","0.8","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C19 H17 N O3 S -","- C19 H17 N O3 S -","- C76 H68 N4 O12 S4 -","4","1","","Eccles, Kevin S.; Elcoate, Curtis J.; Stokes, Stephen P.; Maguire, Anita R.; Lawrence, Simon E.","Sulfoxides: Potent Co-Crystal Formers","Crystal Growth & Design","2010","10","10","4243","","10.1021/cg1010192","","","0.71073","MoKα","","0.0473","0.0364","","","0.1016","0.1149","","","","","","1.058","","","","has coordinates","179552","2020-10-21","18:00:00",""
"4502184","7.9928","0.0009","10.9734","0.0011","20.816","0.002","90","","93.657","0.002","90","","1822","0.3","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C14 H13.75 Cu K0.5 La0.5 N2 O13 -","- C14 H12.8 Cu K0.5 La0.5 N2 O12.9 -","- C56 H51.2 Cu4 K2 La2 N8 O51.6 -","4","1","","Sun, Ya-guang; Gu, Xiao-fu; Ding, Fu; Smet, Philippe F.; Gao, En-jun; Poelman, Dirk; Verpoort, Francis","Synthesis, Crystal Structures, and Properties of Novel Heterometallic La/Pr−Cu−K and Sm/Eu/Tb−Cu Coordination Polymers","Crystal Growth & Design","2010","10","3","1059","","10.1021/cg900299v","","","0.71073","MoKα","","0.0333","0.0271","","","0.0713","0.0746","","","","","","1.078","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4502185","7.9977","0.0014","10.9472","0.0019","20.722","0.004","90","","93.796","0.003","90","","1810.3","0.6","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C14 H13.8 Cu K0.5 N2 O12.9 Pr0.5 -","- C14 H13.8 Cu K0.5 N2 O12.9 Pr0.5 -","- C56 H55.2 Cu4 K2 N8 O51.6 Pr2 -","4","1","","Sun, Ya-guang; Gu, Xiao-fu; Ding, Fu; Smet, Philippe F.; Gao, En-jun; Poelman, Dirk; Verpoort, Francis","Synthesis, Crystal Structures, and Properties of Novel Heterometallic La/Pr−Cu−K and Sm/Eu/Tb−Cu Coordination Polymers","Crystal Growth & Design","2010","10","3","1059","","10.1021/cg900299v","","","0.71073","MoKα","","0.0485","0.0345","","","0.0791","0.0864","","","","","","1.052","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4502877","17.3468","0.0008","7.2668","0.0003","24.8936","0.0009","90","","111.93","0.002","90","","2910.9","0.2","187","2","187","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C28 H32 Cd N6 O6 -","- C28 H18 Cd N6 O6 -","- C112 H72 Cd4 N24 O24 -","4","1","","Song, Xue-Zhi; Song, Shu-Yan; Qin, Chao; Su, Sheng-Qun; Zhao, Shu-Na; Zhu, Min; Hao, Zhao-Min; Zhang, Hong-Jie","Syntheses, Structures, and Photoluminescent Properties of Coordination Polymers Based on 1,4-Bis(imidazol-l-yl-methyl)benzene and Various Aromatic Dicarboxylic Acids","Crystal Growth & Design","2012","12","1","253","","10.1021/cg201025u","","","0.71073","MoKα","","0.0525","0.0396","","","0.104","0.1121","","","","","","1.042","","","","has coordinates","201370","2020-10-21","18:00:00",""
"4502917","7.889","0.002","5.7444","0.0017","16.373","0.005","90","","101.986","0.006","90","","725.8","0.4","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H12 Ag N5 O3 -","- C14 H12 Ag N5 O3 -","- C28 H24 Ag2 N10 O6 -","2","0.5","","Liu, Fu-Jing; Sun, Di; Hao, Hong-Jun; Huang, Rong-Bin; Zheng, Lan-Sun","Anion-Controlled Assembly of Silver(I)/Aminobenzonitrile Compounds: Syntheses, Crystal Structures, and Photoluminescence Properties","Crystal Growth & Design","2012","12","1","354","","10.1021/cg201159z","","","0.71073","MoKα","","0.0329","0.0316","","","0.0759","0.0769","","","","","","1.143","","","","has coordinates","179560","2020-10-21","18:00:00",""
"4502982","13.4961","0.0015","9.383","0.001","13.5797","0.0015","90","","93.542","0.003","90","","1716.4","0.3","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H12 Cd2 N2 O11 -","- C14 H12 Cd2 N2 O11 -","- C56 H48 Cd8 N8 O44 -","4","1","","Kukovec, Boris-Marko; Venter, Gerhard A.; Oliver, Clive L.","Structural and DFT Studies on the Polymorphism of a Cadmium(II) Dipicolinate Coordination Polymer","Crystal Growth & Design","2012","12","1","456","","10.1021/cg201285g","","","0.71073","MoKα","","0.0423","0.0266","","","0.0583","0.0636","","","","","","1.015","","","","has coordinates","179560","2020-10-21","18:00:00",""
"4503021","14.132","0.003","25.112","0.005","19.91","0.003","90","","121.51","0.01","90","","6024","2","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C47 H42 Cd3 N O18 -","- C47 H42 Cd3 N O18 -","- C188 H168 Cd12 N4 O72 -","4","1","","Cui, Jiehu; Lu, Zhenzhong; Li, Yizhi; Guo, Zijian; Zheng, Hegen","Five Novel Coordination Polymers Based on a C-Centered Triangular Flexible Ligand","Crystal Growth & Design","2012","12","2","1022","","10.1021/cg201552g","","","0.71073","MoKα","","0.0927","0.066","","","0.1795","0.1925","","","","","","1.17","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4503022","13.3185","0.0013","9.4298","0.0009","25.8321","0.0019","90","","116.342","0.004","90","","2907.4","0.5","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C60 H52 Cd3 N4 O16 -","- C60 H52 Cd3 N4 O16 -","- C120 H104 Cd6 N8 O32 -","2","0.5","","Cui, Jiehu; Lu, Zhenzhong; Li, Yizhi; Guo, Zijian; Zheng, Hegen","Five Novel Coordination Polymers Based on a C-Centered Triangular Flexible Ligand","Crystal Growth & Design","2012","12","2","1022","","10.1021/cg201552g","","","0.71073","MoKα","","0.0506","0.0447","","","0.1174","0.1205","","","","","","1.054","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4503120","17.314","0.003","5.3628","0.0011","23.927","0.007","90","","133.577","0.017","90","","1609.5","0.8","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C56 H64 Br4 Cu2 N16 O12 -","- C56 H64 Br4 Cu2 N16 O12 -","- C56 H64 Br4 Cu2 N16 O12 -","1","0.25","","Zeng, Qingdao; Li, Min; Wu, Dongxia; Lei, Shengbin; Liu, Caiming; Piao, Lingyu; Yang, Yanlian; An, Shiyan; Wang, Chen","Organic−Inorganic Hybrid Aligned by the Ligand−Ligand Hydrogen Bonds by Using Pyridyl-Substituted Oxalamides as the Building Blocks","Crystal Growth & Design","2008","8","3","869","","10.1021/cg070506u","","","0.71073","MoKα","","0.0862","0.0479","","","0.111","0.1344","","","","","","0.975","","","","has coordinates","179562","2020-10-21","18:00:00",""
"4503256","15.161","0.003","6.4431","0.0013","7.1366","0.0014","90","","91.87","0.03","90","","696.8","0.2","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C16 H12 Cd O5 -","- C16 H12 Cd O5 -","- C32 H24 Cd2 O10 -","2","0.5","","Wang, Huan-Yu; Gao, Shan; Huo, Li-Hua; Ng, Seik Weng; Zhao, Jing-Gui","Three Interpenetrated Frameworks Assembly from a Long Multicarboxylate Ligand and Transition Metal","Crystal Growth & Design","2008","8","2","665","","10.1021/cg700896j","","","0.71073","MoKα","","0.0435","0.0388","","","0.0883","0.0913","","","","","","1.097","","","","has coordinates","179563","2020-10-21","18:00:00",""
"4503257","14.799","0.003","6.2738","0.0013","7.3671","0.0015","90","","93.13","0.03","90","","683","0.2","295","2","295","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C16 H12 O5 Zn -","- C16 H12 O5 Zn -","- C32 H24 O10 Zn2 -","2","0.5","","Wang, Huan-Yu; Gao, Shan; Huo, Li-Hua; Ng, Seik Weng; Zhao, Jing-Gui","Three Interpenetrated Frameworks Assembly from a Long Multicarboxylate Ligand and Transition Metal","Crystal Growth & Design","2008","8","2","665","","10.1021/cg700896j","","","0.71073","MoKα","","0.0308","0.0253","","","0.0596","0.0616","","","","","","1.101","","","","has coordinates","179563","2020-10-21","18:00:00",""
"4503311","19.374","0.002","14.8874","0.0018","15.3721","0.0018","90","","111.753","0.002","90","","4118","0.8","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C32.5 H28.5 Cd4 K N10.5 O19.5 -","- C32.5 H18.5 Cd4 K N10.5 O19.45 -","- C130 H74 Cd16 K4 N42 O77.8 -","4","1","","Lu, Wen-Guan; Jiang, Long; Feng, Xiao-Long; Lu, Tong-Bu","Four 3D Porous Metal−Organic Frameworks with Various Layered and Pillared Motifs","Crystal Growth & Design","2008","8","3","986","","10.1021/cg700979r","","","0.71073","MoKα","","0.111","0.0679","","","0.2062","0.2422","","","","","","1.061","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4503386","12.301","0.003","6.6095","0.0013","16.694","0.006","90","","112.97","0.02","90","","1249.7","0.6","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H22 Co N6 O8 -","- C24 H22 Co N6 O8 -","- C48 H44 Co2 N12 O16 -","2","0.5","","Qi, Yan; Luo, Feng; Batten, Stuart R.; Che, Yun-Xia; Zheng, Ji-Min","Syntheses and Crystal Structures of a Series of Novel Helical Coordination Polymers Constructed from Flexible Bis(imidazole) Ligands and Metal Salts","Crystal Growth & Design","2008","8","8","2806","","10.1021/cg701061q","","","0.71073","MoKα","","0.0448","0.0345","","","0.0921","0.0964","","","","","","1.062","","","","has coordinates","179564","2020-10-21","18:00:00",""
"4503394","8.998","0.002","9.709","0.002","15.555","0.004","90","","91.066","0.004","90","","1358.7","0.5","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C18 H26 Fe N14 O S2 -","- C18 H26 Fe N14 O S2 -","- C36 H52 Fe2 N28 O2 S4 -","2","0.5","","Gu, Zhi-Guo; Xu, Yi-Fan; Zhou, Xin-Hui; Zuo, Jing-Lin; You, Xiao-Zeng","Assembly of Iron(II)-Triazole Polymers from 1D Chains to 3D Interpenetrated Frameworks: Syntheses, Structures, and Magnetic Properties","Crystal Growth & Design","2008","8","4","1306","","10.1021/cg7010666","","","0.71073","MoKα","","0.0509","0.0434","","","0.122","0.1269","","","","","","1.039","","","","has coordinates,has disorder","179564","2020-10-21","18:00:00",""
"4503445","9.6701","0.0019","11.742","0.002","18.852","0.004","90","","97.91","0.03","90","","2120.2","0.7","193","2","193","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C74 H56 Cu8 Mo2 N15 S8 -","- C74 H56 Cu8 Mo2 N15 S8 -","- C74 H56 Cu8 Mo2 N15 S8 -","1","0.25","","Zhang, Wen-Hua; Lang, Jian-Ping; Zhang, Yong; Abrahams, Brendan F.","Stepwise Guest Exchange in a Cluster-Supported Three-Dimensional Host","Crystal Growth & Design","2008","8","2","399","","10.1021/cg701131t","","","0.71073","MoKα","","0.1176","0.0921","","","0.2014","0.2144","","","","","","1.207","","","","has coordinates","179565","2020-10-21","18:00:00",""
"4503446","9.625","0.0019","11.78","0.002","18.714","0.004","90","","98.18","0.03","90","","2100.3","0.7","193","2","193","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C36 H28 Cu4 Mo N8 S4 -","- C37 H28 Cu4 Mo N8 S4 -","- C74 H56 Cu8 Mo2 N16 S8 -","2","0.5","","Zhang, Wen-Hua; Lang, Jian-Ping; Zhang, Yong; Abrahams, Brendan F.","Stepwise Guest Exchange in a Cluster-Supported Three-Dimensional Host","Crystal Growth & Design","2008","8","2","399","","10.1021/cg701131t","","","0.71073","MoKα","","0.086","0.0745","","","0.2105","0.2231","","","","","","1.115","","","","has coordinates,has disorder","179565","2020-10-21","18:00:00",""
"4503447","9.6362","0.0019","11.462","0.002","19.147","0.004","90","","97.98","0.03","90","","2094.3","0.7","193","2","193","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C33 H28 Cu4 Mo N8 O S4 -","- C33 H28 Cu4 Mo N8 O S4 -","- C66 H56 Cu8 Mo2 N16 O2 S8 -","2","0.5","","Zhang, Wen-Hua; Lang, Jian-Ping; Zhang, Yong; Abrahams, Brendan F.","Stepwise Guest Exchange in a Cluster-Supported Three-Dimensional Host","Crystal Growth & Design","2008","8","2","399","","10.1021/cg701131t","","","0.71073","MoKα","","0.1084","0.0885","","","0.2155","0.2287","","","","","","1.126","","","","has coordinates,has disorder","179565","2020-10-21","18:00:00",""
"4503599","21.48","0.002","7.205","0.0008","28.057","0.003","90","","110.467","0.003","90","","4068.1","0.7","90","0.2","90","0.2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","2-(Phenylamino)nicotinic acid","","- C12 H10 N2 O2 -","- C12 H10 N2 O2 -","- C192 H160 N32 O32 -","16","4","","Long, Sihui; Parkin, Sean; Siegler, Maxime A.; Cammers, Arthur; Li, Tonglei","Polymorphism and Phase Behaviors of 2-(Phenylamino)nicotinic Acid","Crystal Growth & Design","2008","8","11","4006","","10.1021/cg800123z","","","1.54178","CuKα","","0.0409","0.039","","","0.1127","0.1142","","","","","","1.123","","","","has coordinates","179569","2020-10-21","18:00:00",""
"4503639","14.874","0.003","6.8373","0.0014","13.141","0.003","90","","108.51","0.03","90","","1267.3","0.5","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C24 H12 Co3 O16 -","- C24 H12 Co3 O16 -","- C48 H24 Co6 O32 -","2","0.5","","Luo, Feng; Che, Yunxia; Zheng, Jimin","Employing La2- (La = Eu, Tb, Pr) or Co3-Based Molecule Building Blocks To Construct 3,8-Connected Nets: Hydrothermal Synthesis, Structure, Luminescence, and Magnetic Properties","Crystal Growth & Design","2008","8","6","2006","","10.1021/cg8001898","","x-ray","0.71073","MoKα","","0.1458","0.139","","","0.344","0.3486","","","","","","1.015","","","","has coordinates","179571","2020-10-21","18:00:00",""
"4503738","11.6924","0.0007","15.5292","0.0009","19.158","0.0009","90","","109.159","0.003","90","","3285.9","0.3","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C146 H102 Cd4 N10 O26 -","- C146 H88 Cd4 N10 O26 -","- C146 H88 Cd4 N10 O26 -","1","0.25","","Shi, Qian; Sun, Yunti; Sheng, Lizi; Ma, Kefang; Hu, Maolin; Hu, Xingen; Huang, Shaoming","Anion-Dependent Crystallization of Four Supramolecular Cadmium Complexes: Structures and Property Studies","Crystal Growth & Design","2008","8","9","3401","","10.1021/cg8003504","","","0.71073","MoKα","","0.0561","0.0495","","","0.1369","0.1432","","","","","","1.163","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4503886","20.159","0.004","4.073","0.001","20.481","0.004","90","","108.75","0.01","90","","1592.4","0.6","293","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C26 H4 Cl F6 I4 Se4 -","- C26 H4 Cl F6 I4 Se4 -","- C52 H8 Cl2 F12 I8 Se8 -","2","0.5","","Yamamoto, Hiroshi M.; Kosaka, Yosuke; Maeda, Ryoko; Yamaura, Jun-ichi; Nakao, Akiko; Nakamura, Toshikazu; Kato, Reizo","Supramolecular insulating networks sheathing conducting nanowires based on organic radical cations.","ACS nano","2008","2","1","143","155","10.1021/nn700035t","","","0.7107","MoKα","","","0.0442","","","","0.1313","","","","","","1.046","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4503913","9.2011","0.0017","5.7246","0.001","14.876","0.003","90","","104.855","0.003","90","","757.4","0.2","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C12 H8 Cu2 N4 S3 -","- C12 H8 Cu2 N4 S3 -","- C24 H16 Cu4 N8 S6 -","2","0.5","","Hao, Zheng-Ming; Zhang, Xian-Ming","Ligand Concentration Controlled Supramolecular Isomerism in Two CuSCN Based Coordination Polymers with in Situ Synthesized 4,4‘-Dipyridylsulfide as a Co-Ligand","Crystal Growth & Design","2007","7","1","64","","10.1021/cg060371c","","","0.71073","MoKα","","0.1191","0.0716","","","0.1711","0.1961","","","","","","0.95","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503989","23.003","0.001","6.4923","0.0003","20.888","0.001","90","","97.163","0.001","90","","3095.1","0.2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","trans-Dichloro-bis(2,4,6-trifluoroaniline-N)-palladium(ii)","","- C12 H8 Cl2 F6 N2 Pd -","- C12 H8 Cl2 F6 N2 Pd -","- C96 H64 Cl16 F48 N16 Pd8 -","8","2","","Baldovino-Pantaleón, Oscar; Morales-Morales, David; Hernández-Ortega, Simón; Toscano, Rubén A.; Valdés-Martínez, Jesús","Pd−N−H···Cl−Pd Hydrogen Bonds and π−π Interactions between Fluorinated Aromatic Rings intrans-[PdCl2(NH2ArF)2]","Crystal Growth & Design","2007","7","1","117","","10.1021/cg0606388","","","0.71073","MoKα","","0.0743","0.0424","","","0.0691","0.0739","","","","","","0.992","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4504102","12.93","0.005","9.969","0.004","15.716","0.006","90","","90.365","0.008","90","","2025.7","1.4","173.1","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C16 H17 Br3 Hg N4 O0.5 -","- C16 H13 Br3 Hg N4 O0.5 -","- C64 H52 Br12 Hg4 N16 O2 -","4","1","","Wang, Xiao-Feng; Lv, Yang; Okamura, Taka-aki; Kawaguchi, Hiroyuki; Wu, Gang; Sun, Wei-Yin; Ueyama, Norikazu","Structure Variation of Mercury(II) Halide Complexes with Different Imidazole-Containing Ligands","Crystal Growth & Design","2007","7","6","1125","","10.1021/cg060814c","","","0.7107","MoKα","","","0.038","","","","0.093","","","","","","1.016","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504202","21.293","0.004","7.159","0.001","22.218","0.004","90","","105.07","0.03","90","","3270.4","1.1","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C68 H52 Co3 N10 O21 -","- C68 H52 Co3 N10 O21 -","- C136 H104 Co6 N20 O42 -","2","0.5","","Liu, Cai-Ming; Gao, Song; Zhang, De-Qing; Zhu, Dao-Ben","Three-Dimensional Eight- or Four-Connected Metal−Organic Frameworks Tuned by Hydrothermal Temperatures","Crystal Growth & Design","2007","7","7","1312","","10.1021/cg0700216","","","0.71073","MoKα","","0.111","0.0739","","","0.1795","0.2015","","","","","","1.09","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504369","10.815","0.004","7.332","0.002","10.033","0.003","90","","111.529","0.005","90","","740.1","0.4","273","2","273","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C4 H8 Mg O8 -","- C4 H8 Mg O8 -","- C16 H32 Mg4 O32 -","4","1","","Kam, Kinson C.; Young, Karen L. M.; Cheetham, Anthony K.","Chemical and Structural Diversity in Chiral Magnesium Tartrates and their Racemic andMesoAnalogues","Crystal Growth & Design","2007","7","8","1522","","10.1021/cg070388a","","","0.71073","MoKα","","0.0548","0.0442","","","0.1179","0.1271","","","","","","1.056","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504388","13.261","0.005","9.342","0.005","11.266","0.005","90","0.005","91.01","0.005","90","0.005","1395.5","1.1","83","","83","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","(H4TETA)(Hmal)4 2(H2O)","","","- C22 H39 N4 O18 -","- C22 H36 N4 O17 -","- C44 H72 N8 O34 -","2","0.5","","Wichmann, Kathrin A.; Boyd, Peter D. W.; Söhnel, Tilo; Allen, Grant R.; Phillips, Anthony R. J.; Cooper, Garth J. S.","Characterization of Dicarboxylic Salts of Protonated Triethylenetetramine Useful for the Treatment of Copper-Related Pathologies†","Crystal Growth & Design","2007","7","9","1844","","10.1021/cg0704549","","","0.71069","MoKα","","0.0534","0.0449","","","0.1172","0.1241","","","","","","1.157","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504408","25.271","0.002","19.6049","0.0014","21.8179","0.0016","90","","101.369","0.003","90","","10597.3","1.4","120","2","120","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C208 H208 Cl8 Cu8 N48 S16 -","- C208 H208 Cl8 Cu8 N48 S16 -","- C416 H416 Cl16 Cu16 N96 S32 -","2","0.5","","Lenthall, Joseph T.; Anderson, Kirsty M.; Smith, Stephen J.; Steed, Jonathan W.","Crystal Packing in Equilibrating Systems: A Single Crystal Containing Three Isomers of CuCl(1-pyridin-2-yl-3-p-tolyl-thiourea)2","Crystal Growth & Design","2007","7","9","1858","","10.1021/cg070533k","","","0.71073","MoKα","","0.1752","0.0776","","","0.1044","0.1262","","","","","","1.023","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504740","8.4886","0.0015","10.5837","0.0018","20.733","0.004","90","","96.619","0.003","90","","1850.3","0.6","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","2","","","- C11 H22 N4 O11 S Zn -","- C11 H21 N4 O11 S Zn -","- C44 H84 N16 O44 S4 Zn4 -","4","1","","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","","0.0501","0.0381","","","0.0849","0.0886","","","","","","1.089","","","","has coordinates","179582","2020-10-21","18:00:00",""
"4504793","19.321","0.003","8.6155","0.0014","23.943","0.004","90","","110.416","0.003","90","","3735.2","1","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C36 H70 N2 O5 -","- C36 H70 N2 O5 -","- C144 H280 N8 O20 -","4","1","","Trivedi, Darshak R.; Dastidar, Parthasarathi","Supramolecular Hydrogen Bond Isomerism in Organic Salts: A Transition from 0D to 1D","Crystal Growth & Design","2006","6","4","1022","","10.1021/cg050674r","","","0.71073","MoKα","","0.0583","0.0525","","","0.1477","0.1549","","","","","","1.053","","","","has coordinates","179582","2020-10-21","18:00:00",""
"4504942","6.2477","0.0001","8.4165","0.0002","15.0632","0.0004","90","","101.78","0.0011","90","","775.4","0.03","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H14 Ag N5 O3 -","- C14 H14 Ag N5 O3 -","- C28 H28 Ag2 N10 O6 -","2","0.5","","Gao, En-Qing; Cheng, Ai-Ling; Xu, Yan-Xia; Yan, Chun-Hua; He, Ming-Yuan","New Inorganic−Organic Hybrid Supramolecular Architectures Generated from 2,5-Bis(3-pyridyl)-3,4-diaza-2,4-hexadiene","Crystal Growth & Design","2005","5","3","1005","","10.1021/cg049659x","","","0.71073","MoKα","","0.0327","0.0277","","","0.0685","0.0715","","","","","","1.097","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504945","5.746","0.002","11.867","0.005","16.084","0.006","90","","90.473","0.005","90","","1096.7","0.7","173","2","173","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","2Y (EBA)(C6(CN)6)","","","- C22 H20 N10 -","- C22 H20 N10 -","- C44 H40 N20 -","2","0.5","","Lee, Sang-Ok; Shacklady, Danielle M.; Horner, Matthew J.; Ferlay, Sylvie; Hosseini, Mir W.; Ward, Michael D.","Structural Transference and Regulation of Bimodal Assembly of Charge-Assisted Hydrogen-Bonded Networks","Crystal Growth & Design","2005","5","3","995","","10.1021/cg049660w","","","0.71073","MoKα","","0.1256","0.0741","","","0.177","0.1928","","","","","","1.18","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4505069","11.7633","0.0019","9.5108","0.0015","16.581","0.003","90","","92.208","0.004","90","","1853.7","0.5","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C28 H28 Ba Cr2 N4 O22 -","- C28 H16 Ba Cr2 N4 O22 -","- C56 H32 Ba2 Cr4 N8 O44 -","2","0.5","","Marinescu, Gabriela; Andruh, Marius; Julve, Miguel; Lloret, Francesc; Llusar, Rosa; Uriel, Santiago; Vaissermann, Jacqueline","Heteropolymetallic Supramolecular Solid-State Architectures Constructed from [Cr(AA)(C2O4)2]-Tectons, and Sustained by Coordinative, Hydrogen Bond and π−π Stacking Interactions (AA = 2,2‘-Bipyridine; 1,10-Phenanthroline)","Crystal Growth & Design","2005","5","1","261","","10.1021/cg049944g","","","0.71073","MoKα","","0.0585","0.0344","","","0.0874","0.094","","","","","","0.955","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505128","7.8179","0.0016","9.4709","0.0019","15.568","0.003","90","","91.16","0.03","90","","1152.5","0.4","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Bis(2-amino-4-hydroxypteridinate)ethylenediaminenickel(II)","","- C7 H13 N6 Ni0.5 O3.5 -","- C7 H13 N6 Ni0.5 O3.5 -","- C28 H52 N24 Ni2 O14 -","4","1","","Crispini, Alessandra; Pucci, Daniela; Bellusci, Anna; Barberio, Giovanna; La Deda, Massimo; Cataldi, Antonella; Ghedini, Mauro","Hydrogen-Bonding Network in Metal−Pterin Complexes: Synthesis and Characterization of Water-Soluble Octahedral Nickel and Cadmium Pterine Derivatives","Crystal Growth & Design","2005","5","4","1597","","10.1021/cg050075k","","","0.71073","MoKα","","0.0862","0.065","","","0.1828","0.1949","","","","","","1.025","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505387","9.3896","0.0007","6.9093","0.001","19.3766","0.0016","90","","90.951","0.008","90","","1256.9","0.2","150","1","150","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C8 H12 N6 O4 Zn -","- C8 H12 N6 O4 Zn -","- C32 H48 N24 O16 Zn4 -","4","1","","Escorihuela, Inmaculada; Falvello, Larry R.; Tomás, Milagros; Urriolabeitia, Esteban P.","Influence of Noncovalent Interactions on Uracil Tautomer Selection: Coordination of Both N1 and N3 Uracilate to the Same Metal in the Solid State","Crystal Growth & Design","2004","4","4","655","","10.1021/cg0499111","","","0.71073","MoKα","","0.0684","0.0428","","","0.0904","0.1014","","","","","","1.02","","","","has coordinates","179588","2020-10-21","18:00:00",""
"4505550","14.8314","0.0011","9.7047","0.0017","22.344","0.002","90","","131.552","0.006","90","","2406.8","0.6","296","","296","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C46 H46 Ag3 N7 O14 -","- C46 H46 Ag3 N7 O14 -","- C92 H92 Ag6 N14 O28 -","2","0.5","","Li, Bo; Zang, Shuang-Quan; Ji, Can; Hou, Hong-Wei; Mak, Thomas C. W.","Syntheses, Structures, and Properties of Silver‒Organic Frameworks Constructed with 1,1′-Biphenyl-2,2′,6,6′-tetracarboxylic Acid","Crystal Growth & Design","2012","12","3","1443","","10.1021/cg2015447","","","0.71073","MoKα","","0.087","0.0653","","","0.1332","0.1442","","","","","","1.009","","","","has coordinates","179590","2020-10-21","18:00:00",""
"4505551","13.6268","0.0013","11.3907","0.0009","22.824","0.003","90","","110.823","0.008","90","","3311.3","0.6","296","","296","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C36 H28 Ag2 N4 O10 -","- C36 H28 Ag2 N4 O10 -","- C144 H112 Ag8 N16 O40 -","4","1","","Li, Bo; Zang, Shuang-Quan; Ji, Can; Hou, Hong-Wei; Mak, Thomas C. W.","Syntheses, Structures, and Properties of Silver‒Organic Frameworks Constructed with 1,1′-Biphenyl-2,2′,6,6′-tetracarboxylic Acid","Crystal Growth & Design","2012","12","3","1443","","10.1021/cg2015447","","","0.71073","MoKα","","0.2022","0.0821","","","0.1043","0.1311","","","","","","0.939","","","","has coordinates","179590","2020-10-21","18:00:00",""
"4505552","13.1642","0.0005","9.9022","0.0005","16.0294","0.0011","90","","124.52","0.004","90","","1721.6","0.18","296","","296","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C36 H24 Ag2 Cl N4 O12 -","- C36 H24 Ag2 Cl N4 O12 -","- C72 H48 Ag4 Cl2 N8 O24 -","2","0.5","","Li, Bo; Zang, Shuang-Quan; Ji, Can; Hou, Hong-Wei; Mak, Thomas C. W.","Syntheses, Structures, and Properties of Silver‒Organic Frameworks Constructed with 1,1′-Biphenyl-2,2′,6,6′-tetracarboxylic Acid","Crystal Growth & Design","2012","12","3","1443","","10.1021/cg2015447","","","0.71073","MoKα","","0.0759","0.0604","","","0.1524","0.1611","","","","","","1.042","","","","has coordinates","179590","2020-10-21","18:00:00",""
"4505773","18.7245","0.0006","6.7899","0.0003","8.0295","0.0003","90","","91.394","0.001","90","","1020.55","0.07","163","2","163","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Anilinium butanebisphosphonate","","- C16 H26 N2 O6 P2 -","- C16 H26 N2 O6 P2 -","- C32 H52 N4 O12 P4 -","2","0.5","","Mahmoudkhani, Amir H.; Langer, Vratislav","Supramolecular Isomerism and Isomorphism in the Structures of 1,4-Butanebisphosphonic Acid and Its Organic Ammonium Salts","Crystal Growth & Design","2002","2","1","21","","10.1021/cg015553f","","","0.71073","MoKα","","0.097","0.06","","","0.144","0.173","","","","","","1.087","","","","has coordinates","179593","2020-10-21","18:00:00",""
"4505927","14.52","0.003","7.166","0.0014","15.901","0.003","90","","97.63","0.03","90","","1639.9","0.6","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C16 H13 N5 O4 Zn -","- C16 H13 N5 O4 Zn -","- C64 H52 N20 O16 Zn4 -","4","1","","Huang, Fu-Ping; Zhang, Qian; Yu, Qing; Bian, He-Dong; Liang, Hong; Yan, Shi-Ping; Liao, Dai-Zheng; Cheng, Peng","Coordination Assemblies of CoII/NiII/ ZnII/CdIIwith Succinic Acid and Bent Connectors: Structural Diversity and Spin-Canted Antiferromagnetism","Crystal Growth & Design","2012","12","4","1890","","10.1021/cg201577w","","","0.71073","MoKα","","0.0506","0.0365","","","0.0807","0.0838","","","","","","0.994","","","","has coordinates","179595","2020-10-21","18:00:00",""
"4505931","13.4051","0.0013","11.8197","0.0012","20.186","0.0015","90","","127.807","0.004","90","","2527","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C25 H26 Co N6 O7 -","- C25 H20 Co N6 O7 -","- C100 H80 Co4 N24 O28 -","4","1","","Chen, Shui-Sheng; Chen, Zhi-Hao; Fan, Jian; Okamura, Taka-aki; Bai, Zheng-Shuai; Lv, Mei-Fang; Sun, Wei-Yin","Synthesis and Characterization of Metal Complexes with Mixed 4-Imidazole-Containing Tripodal Ligand and Varied Dicarboxylic Acid","Crystal Growth & Design","2012","12","5","2315","","10.1021/cg2016275","","","0.71073","MoKα","","0.0881","0.0605","","","0.1179","0.1282","","","","","","1.01","","","","has coordinates","179595","2020-10-21","18:00:00",""
"4506137","10.4063","0.0012","9.3137","0.0011","23.889","0.003","90","","91.603","0.002","90","","2314.4","0.5","273","2","273","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C41 H38 Co2 N4 O17 -","- C41 H38 Co2 N4 O17 -","- C82 H76 Co4 N8 O34 -","2","0.5","","Hu, Jin-Song; Yao, Xiao-Qiang; Zhang, Ming-Dao; Qin, Ling; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen; Xue, Zi-Ling","Syntheses, Structures, and Characteristics of Four New Metal‒Organic Frameworks Based on Flexible Tetrapyridines and Aromatic Polycarboxylate Acids","Crystal Growth & Design","2012","12","7","3426","","10.1021/cg201362x","","","0.71073","MoKα","","0.0668","0.0578","","","0.1557","0.1608","","","","","","1.082","","","","has coordinates","179597","2020-10-21","18:00:00",""
"4506545","11.875","0.002","5.0074","0.001","30.424","0.008","90","","111.91","0.03","90","","1678.4","0.7","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C12 H18 N3 Na O12 Zn -","- C12 H12 N3 Na O12 Zn -","- C48 H48 N12 Na4 O48 Zn4 -","4","1","","Li, Huijun; Zhao, Bei; Ding, Ran; Jia, Yanyuan; Hou, Hongwei; Fan, Yaoting","Structural Diversity for a Series of Novel Zn Metal‒Organic Frameworks Based on Different Secondary Building Units","Crystal Growth & Design","2012","12","8","4170","","10.1021/cg3006794","","","0.71073","MoKα","","0.0691","0.0595","","","0.1882","0.2085","","","","","","1.069","","","","has coordinates","179601","2020-10-21","18:00:00",""
"4506565","12.353","0.003","10.952","0.002","19.413","0.004","90","","102.469","0.006","90","","2564.4","0.9","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C56 H42 Br2 Cu3 N8 O10 -","- C56 H38 Br2 Cu3 N8 O10 -","- C112 H76 Br4 Cu6 N16 O20 -","2","0.5","","Banerjee, Kaustuv; Biradha, Kumar","Design and Synthesis of Mixed Valent Coordination Networks Containing Pyridine Appended Terpyridyl, Halide, and Dicarboxylates","Crystal Growth & Design","2012","12","8","4264","","10.1021/cg300770b","","","0.71073","MoKα","","0.0456","0.0336","","","0.1008","0.1095","","","","","","0.831","","","","has coordinates","179601","2020-10-21","18:00:00",""
"4506759","14.7453","0.0011","7.6151","0.0006","23.8558","0.0017","90","","102.432","0.001","90","","2615.9","0.3","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C26 H17 Co F6 N2 O4 -","- C26 H17 Co F6 N2 O4 -","- C104 H68 Co4 F24 N8 O16 -","4","1","","Manna, Paulami; Tripuramallu, Bharat Kumar; Das, Samar K.","Synthesis, Structural Characterization, and Magnetic Properties of a New Series of Coordination Polymers: Importance of Steric Hindrance at the Coordination Sphere","Crystal Growth & Design","2012","12","9","4607","","10.1021/cg300800h","","","0.71073","MoKα","","0.0658","0.055","","","0.1216","0.1284","","","","","","0.991","","","","has coordinates","179603","2020-10-21","18:00:00",""
"4506765","9.2407","0.0014","15.876","0.002","15.9418","0.0018","90","","110.773","0.007","90","","2186.7","0.5","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C40 H48 Co2 N8 O14 -","- C40 H48 Co2 N8 O14 -","- C80 H96 Co4 N16 O28 -","2","0.5","","Qin, Ling; Hu, Jinsong; Zhang, Mingdao; Li, Yizhi; Zheng, Hegen","Construction of Metal‒Organic Frameworks Based on Two Neutral Tetradentate Ligands","Crystal Growth & Design","2012","12","10","4911","","10.1021/cg300803n","","","0.71073","MoKα","","0.0755","0.0593","","","0.1667","0.1759","","","","","","1.031","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"4506902","16.965","0.004","15.5171","0.0013","14.0726","0.0014","90","","108.119","0.018","90","","3520.9","1","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C37 H36 N3 O19 Zn3 -","- C33 H20 N O19 Zn3 -","- C66 H40 N2 O38 Zn6 -","2","0.5","","Manos, Manolis J.; Moushi, Eleni E.; Papaefstathiou, Giannis S.; Tasiopoulos, Anastasios J.","New Zn2+Metal Organic Frameworks with Unique Network Topologies from the Combination of Trimesic Acid and Amino-Alcohols","Crystal Growth & Design","2012","12","11","5471","","10.1021/cg301047w","","","0.71073","MoKα","","0.0991","0.073","","","0.1967","0.2135","","","","","","0.891","","","","has coordinates","179605","2020-10-21","18:00:00",""
"4506976","12.1981","0.0013","4.6782","0.0005","15.3941","0.0013","90","","122.302","0.006","90","","742.52","0.14","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C13 H14 Cl2 N4 O Zn -","- C13 H14 Cl2 N4 O Zn -","- C26 H28 Cl4 N8 O2 Zn2 -","2","0.5","","Banerjee, Subhabrata; Adarsh, N. N.; Dastidar, Parthasarathi","Solvent-Driven Structural Diversities in ZnIICoordination Polymers and Complexes Derived from Bis-pyridyl Ligands Equipped with a Hydrogen-Bond-Capable Urea Backbone","Crystal Growth & Design","2012","12","12","6061","","10.1021/cg301190d","","","0.71073","MoKα","","0.0232","0.0218","","","0.0683","0.07","","","","","","1.137","","","","has coordinates","179605","2020-10-21","18:00:00",""
"4507016","22.153","0.003","9.7615","0.0012","17.488","0.002","90","","98.224","0.003","90","","3742.8","0.8","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C38 H56 N4 O4 -","- C38 H56 N4 O4 -","- C152 H224 N16 O16 -","4","1","","Sahoo, Pathik; Dastidar, Parthasarathi","Secondary Ammonium Dicarboxylate (SAD)—A Supramolecular Synthon in Designing Low Molecular Weight Gelators Derived from Azo-Dicarboxylates","Crystal Growth & Design","2012","12","12","5917","","10.1021/cg301245c","","","0.71073","MoKα","","0.0619","0.0429","","","0.1133","0.1256","","","","","","1.024","","","","has coordinates","179606","2020-10-21","18:00:00",""
"4507216","13.262","0.003","11.519","0.002","9.2992","0.0018","90","","90.913","0.004","90","","1420.4","0.5","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Cobalt Carboxylate","","","- C17 H12 Co0.5 N2 O2.5 -","- C17 H12 Co0.5 N2 O2.5 -","- C68 H48 Co2 N8 O10 -","4","1","","Mahata, Partha; Draznieks, Caroline-Mellot; Roy, Partha; Natarajan, Srinivasan","Solid State and Solution Mediated Multistep Sequential Transformations in Metal‒Organic Coordination Networks","Crystal Growth & Design","2013","13","1","155","","10.1021/cg301306m","","","0.71073","MoKα","","0.0615","0.0455","","","0.0984","0.1061","","","","","","1.059","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4507302","19.31","0.02","8.558","0.011","27.25","0.04","90","","108.28","0.03","90","","4276","9","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C34 H21 Mn N5 O8 -","- C34 H21 Mn N5 O8 -","- C136 H84 Mn4 N20 O32 -","4","1","","Zhang, Xiutang; Fan, Liming; Sun, Zhong; Zhang, Wei; Li, Dacheng; Dou, Jianmin; Han, Lei","Syntheses, Structures, and Properties of a Series of Multidimensional Metal‒Organic Polymers Based on 3,3′,5,5′-Biphenyltetracarboxylic Acid and N-Donor Ancillary Ligands","Crystal Growth & Design","2013","13","2","792","","10.1021/cg301502u","","","0.71073","MoKα","","0.1086","0.0677","","","0.1289","0.1455","","","","","","1.001","","","","has coordinates","179609","2020-10-21","18:00:00",""
"4507303","19.282","0.009","8.542","0.004","27.116","0.013","90","","108.45","0.01","90","","4237","3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C34 H21 Fe N5 O8 -","- C34 H21 Fe N5 O8 -","- C136 H84 Fe4 N20 O32 -","4","1","","Zhang, Xiutang; Fan, Liming; Sun, Zhong; Zhang, Wei; Li, Dacheng; Dou, Jianmin; Han, Lei","Syntheses, Structures, and Properties of a Series of Multidimensional Metal‒Organic Polymers Based on 3,3′,5,5′-Biphenyltetracarboxylic Acid and N-Donor Ancillary Ligands","Crystal Growth & Design","2013","13","2","792","","10.1021/cg301502u","","","0.71073","MoKα","","0.065","0.0445","","","0.1091","0.1198","","","","","","0.999","","","","has coordinates","179609","2020-10-21","18:00:00",""
"4507304","19.002","","8.39","","26.833","","90","","108.73","","90","","4051.35","","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C34 H21 Co N5 O8 -","- C34 H21 Co N5 O8 -","- C136 H84 Co4 N20 O32 -","4","1","","Zhang, Xiutang; Fan, Liming; Sun, Zhong; Zhang, Wei; Li, Dacheng; Dou, Jianmin; Han, Lei","Syntheses, Structures, and Properties of a Series of Multidimensional Metal‒Organic Polymers Based on 3,3′,5,5′-Biphenyltetracarboxylic Acid and N-Donor Ancillary Ligands","Crystal Growth & Design","2013","13","2","792","","10.1021/cg301502u","","","0.71073","MoKα","","0.1124","0.0673","","","0.094","0.1043","","","","","","0.895","","","","has coordinates","179609","2020-10-21","18:00:00",""
"4507305","19.392","0.009","8.516","0.004","27.144","0.012","90","","109.504","0.01","90","","4225","3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C34 H21 N5 O8 Zn -","- C34 H21 N5 O8 Zn -","- C136 H84 N20 O32 Zn4 -","4","1","","Zhang, Xiutang; Fan, Liming; Sun, Zhong; Zhang, Wei; Li, Dacheng; Dou, Jianmin; Han, Lei","Syntheses, Structures, and Properties of a Series of Multidimensional Metal‒Organic Polymers Based on 3,3′,5,5′-Biphenyltetracarboxylic Acid and N-Donor Ancillary Ligands","Crystal Growth & Design","2013","13","2","792","","10.1021/cg301502u","","","0.71073","MoKα","","0.0887","0.0655","","","0.1872","0.2255","","","","","","0.998","","","","has coordinates","179609","2020-10-21","18:00:00",""
"4507355","19.266","0.014","8.553","0.006","27.325","0.019","90","","108.189","0.016","90","","4278","5","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C34 H21 Cd N5 O8 -","- C34 H21 Cd N5 O8 -","- C136 H84 Cd4 N20 O32 -","4","1","","Sun, Di; Han, Lu-Lu; Yuan, Shuai; Deng, Yong-Kai; Xu, Meng-Zhen; Sun, Dao-Feng","Four New Cd(II) Coordination Polymers with Mixed Multidentate N-Donors and Biphenyl-Based Polycarboxylate Ligands: Syntheses, Structures, and Photoluminescent Properties","Crystal Growth & Design","2013","13","1","377","","10.1021/cg301573c","","","0.71073","MoKα","","0.0688","0.0491","","","0.1103","0.1177","","","","","","0.97","","","","has coordinates","179609","2020-10-21","18:00:00",""
"4507542","8.8794","0.0017","10.993","0.002","12.0665","0.0017","90","","121.531","0.01","90","","1003.9","0.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C21 H17 Cd N3 O6 -","- C21 H17 Cd N3 O6 -","- C42 H34 Cd2 N6 O12 -","2","0.5","","Wan, Chong-Qing; Li, Ai-Min; Al-Thabaiti, Shaeel A.; Mak, Thomas C. W.","Group 12 Metal Complexes of Semirigid 2,6-Pyridinediylbis(3-pyridinyl)methanone: Role of Counteranions and Solvent in Product Formation","Crystal Growth & Design","2013","13","5","1926","","10.1021/cg3017408","","","0.71073","MoKα","","0.0264","0.0257","","","0.069","0.0696","","","","","","1.112","","","","has coordinates","179611","2020-10-21","18:00:00",""
"4507543","8.7188","0.0003","10.9954","0.0003","12.0144","0.0003","90","","121.556","0.002","90","","981.47","0.05","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C21 H17 N3 O6 Zn -","- C21 H17 N3 O6 Zn -","- C42 H34 N6 O12 Zn2 -","2","0.5","","Wan, Chong-Qing; Li, Ai-Min; Al-Thabaiti, Shaeel A.; Mak, Thomas C. W.","Group 12 Metal Complexes of Semirigid 2,6-Pyridinediylbis(3-pyridinyl)methanone: Role of Counteranions and Solvent in Product Formation","Crystal Growth & Design","2013","13","5","1926","","10.1021/cg3017408","","","0.71073","MoKα","","0.0264","0.0247","","","0.0731","0.0749","","","","","","1.122","","","","has coordinates","179611","2020-10-21","18:00:00",""
"4507544","8.9228","0.0019","10.996","0.002","12.0653","0.0018","90","","121.556","0.011","90","","1008.7","0.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C21 H17 Hg N3 O6 -","- C21 H17 Hg N3 O6 -","- C42 H34 Hg2 N6 O12 -","2","0.5","","Wan, Chong-Qing; Li, Ai-Min; Al-Thabaiti, Shaeel A.; Mak, Thomas C. W.","Group 12 Metal Complexes of Semirigid 2,6-Pyridinediylbis(3-pyridinyl)methanone: Role of Counteranions and Solvent in Product Formation","Crystal Growth & Design","2013","13","5","1926","","10.1021/cg3017408","","","0.71073","MoKα","","0.0542","0.0376","","","0.0782","0.0873","","","","","","1.094","","","","has coordinates","179611","2020-10-21","18:00:00",""
"4507737","20.499","0.004","11.142","0.002","26.08","0.01","90","","123.51","0.02","90","","4967","3","223","2","223","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C98 H86 Ag4 Cl2 N10 P6 -","- C98 H83 Ag4 Cl2 N10 P6 -","- C196 H166 Ag8 Cl4 N20 P12 -","2","0.5","","Yang, Jü-Hua; Wu, Xin-Yi; He, Run-Tian; Ren, Zhi-Gang; Li, Hong-Xi; Wang, Hui-Fang; Lang, Jian-Ping","Degradation versus Expansion of the AgX Frameworks: Formation of Oligomeric and Polymeric Silver Complexes from Reactions of Bulk AgX withN,N-Bis(diphenylphosphanylmethyl)-2-aminopyridine","Crystal Growth & Design","2013","13","5","2124","","10.1021/cg4002048","","","0.71073","MoKα","","0.0828","0.0685","","","0.1758","0.188","","","","","","1.074","","","","has coordinates,has disorder","179613","2020-10-21","18:00:00",""
"4507783","15.604","0.002","8.665","0.001","17.69","0.002","90","","111.47","0.002","90","","2225.9","0.5","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C42 H32 Cd3 N8 O16 -","- C42 H24 Cd3 N8 O16 -","- C84 H48 Cd6 N16 O32 -","2","0.5","","Luo, Li; Chen, Kai; Liu, Qing; Lu, Yi; Okamura, Taka-aki; Lv, Gao-Chao; Zhao, Yue; Sun, Wei-Yin","Zinc(II) and Cadmium(II) Complexes with 1,3,5-Benzenetricarboxylate and Imidazole-Containing Ligands: Structural Variation via Reaction Temperature and Solvent","Crystal Growth & Design","2013","13","6","2312","","10.1021/cg301815w","","","0.71073","MoKα","","0.0454","0.0381","","","0.1169","0.1235","","","","","","1.049","","","","has coordinates,has disorder","179613","2020-10-21","18:00:00",""
"4507826","9.5305","0.0014","9.8936","0.0014","16.379","0.002","90","","98.188","0.002","90","","1528.6","0.4","273","2","273","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C37 H25 Co N5 O4 -","- C37 H25 Co N5 O4 -","- C74 H50 Co2 N10 O8 -","2","0.5","","Fan, Liming; Zhang, Xiutang; Sun, Zhong; Zhang, Wei; Ding, Yuanshuai; Fan, Weiliu; Sun, Liming; Zhao, Xian; Lei, Han","Ancillary Ligands Dependent Structural Diversity of A Series of Metal‒Organic Frameworks Based on 3,5-Bis(3-carboxyphenyl)pyridine","Crystal Growth & Design","2013","13","6","2462","","10.1021/cg400172w","","","0.71073","MoKα","","0.0581","0.0432","","","0.1093","0.1208","","","","","","1.003","","","","has coordinates","179614","2020-10-21","18:00:00",""
"4507965","6.9266","0.0006","13.3091","0.0011","15.0058","0.0013","90","","95.106","0.002","90","","1377.8","0.2","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C28 H32 Cu N4 O7 -","- C28 H32 Cu N4 O7 -","- C56 H64 Cu2 N8 O14 -","2","0.5","","Wang, Xiu-Li; Luan, Jian; Sui, Fang-Fang; Lin, Hong-Yan; Liu, Guo-Cheng; Xu, Chuang","Structural Diversities and Fluorescent and Photocatalytic Properties of a Series of CuIICoordination Polymers Constructed from Flexible Bis-pyridyl-bis-amide Ligands with Different Spacer Lengths and Different Aromatic Carboxylates","Crystal Growth & Design","2013","13","8","3561","","10.1021/cg400538c","","","0.71073","MoKα","","0.0586","0.0444","","","0.1253","0.1341","","","","","","1.033","","","","has coordinates","179615","2020-10-21","18:00:00",""
"4507970","8.956","0.0014","12.184","0.0019","14.2625","0.0016","90","","127.328","0.006","90","","1237.6","0.3","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H26 Cu N4 O9 -","- C28 H17 Cu N4 O9 -","- C56 H34 Cu2 N8 O18 -","2","0.5","","Wang, Xiu-Li; Luan, Jian; Sui, Fang-Fang; Lin, Hong-Yan; Liu, Guo-Cheng; Xu, Chuang","Structural Diversities and Fluorescent and Photocatalytic Properties of a Series of CuIICoordination Polymers Constructed from Flexible Bis-pyridyl-bis-amide Ligands with Different Spacer Lengths and Different Aromatic Carboxylates","Crystal Growth & Design","2013","13","8","3561","","10.1021/cg400538c","","","0.71073","MoKα","","0.1219","0.0918","","","0.2518","0.2778","","","","","","1.064","","","","has coordinates,has disorder","179615","2020-10-21","18:00:00",""
"4508057","15.526","0.004","12.813","0.003","10.324","0.002","90","","104.633","0.004","90","","1987.2","0.8","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C40 H30 N6 O4 Zn -","- C40 H30 N6 O4 Zn -","- C80 H60 N12 O8 Zn2 -","2","0.5","","Singh, Ruchi; Bharadwaj, Parimal K.","Coordination Polymers Built with a Linear Bis-Imidazole and Different Dicarboxylates: Unusual Entanglement and Emission Properties","Crystal Growth & Design","2013","13","8","3722","","10.1021/cg400756z","","","0.71073","MoKα","","0.1051","0.0857","","","0.2363","0.2475","","","","","","1.068","","","","has coordinates","179616","2020-10-21","18:00:00",""
"4508081","12.1526","0.0004","4.8183","0.0002","12.3055","0.0004","90","","109.222","0.002","90","","680.38","0.04","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H8 O6 Rb S -","- C14 H8 O6 Rb S -","- C28 H16 O12 Rb2 S2 -","2","0.5","","Senthil Raja, Duraisamy; Luo, Jheng-Hong; Wu, Cheng-You; Cheng, Yu-Jung; Yeh, Chun-Ting; Chen, Ya-Ting; Lo, Sheng-Han; Lai, Yu-Lun; Lin, Chia-Her","Solvothermal Synthesis, Structural Diversity, and Properties of Alkali Metal‒Organic Frameworks Based on V-shaped Ligand","Crystal Growth & Design","2013","13","8","3785","","10.1021/cg400801s","","","0.71073","MoKα","","0.0676","0.0461","","","0.1171","0.1264","","","","","","1.075","","","","has coordinates","179616","2020-10-21","18:00:00",""
"4508330","15.5125","0.0017","21.9149","0.0012","16.3766","0.0016","90","","116.89","0.002","90","","4965.3","0.8","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C87 H63 Cl3 Mn2 N17 O -","- C87 H63 Cl3 Mn2 N17 O -","- C174 H126 Cl6 Mn4 N34 O2 -","2","0.5","","Zha, Quanzheng; Ding, Caixia; Rui, Xing; Xie, Yongshu","A Novel Porphyrin-Based Ligand Containing Four 4,4′-Dipyridylamine Moieties: Syntheses, Structures, and Luminescent Properties of Mn(II), Cu(II), Zn(II), and Cd(II) Coordination Polymers","Crystal Growth & Design","2013","13","10","4583","","10.1021/cg4011289","","","0.71073","MoKα","","0.1638","0.0783","","","0.203","0.2301","","","","","","1.054","","","","has coordinates,has disorder","179619","2020-10-21","18:00:00",""
"4508387","10.142","0.004","7.283","0.004","19.288","0.007","90","","112.66","0.02","90","","1314.7","1","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C26 H24 N8 O7 -","- C26 H24 N8 O7 -","- C52 H48 N16 O14 -","2","0.5","","Ivanova, Bojidarka; Spiteller, Michael","On the application of the organic barbiturates as NLO materials","Crystal Growth and Design","2010","10","","2470","2474","10.1021/cg100284r","","","0.71073","MoKα","","0.1389","0.0766","","","0.2029","0.2389","","","","","","0.86","","","","has coordinates","179619","2020-10-21","18:00:00",""
"4508608","24.0394","0.0005","8.8925","0.0001","21.0847","0.0004","90","","116.022","0.002","90","","4050.36","0.14","123","0.1","123","0.1","","","","","","","synthesis","7","P 1 2/c 1","-P 2yc","13","","","","- C14.5 H20 Au Cl3 N3 O3.5 S -","- C14.5 H20 Au Cl3 N3 O3.5 S -","- C116 H160 Au8 Cl24 N24 O28 S8 -","8","2","","Tomás-Mendivil, Eder; Toullec, Patrick Y.; Borge, Javier; Conejero, Salvador; Michelet, Véronique; Cadierno, Victorio","Water-Soluble Gold(I) and Gold(III) Complexes with SulfonatedN-Heterocyclic Carbene Ligands: Synthesis, Characterization, and Application in the Catalytic Cycloisomerization of γ-Alkynoic Acids into Enol-Lactones","ACS Catalysis","2013","3","12","3086","","10.1021/cs4009144","","","1.54184","CuKα","","0.061","0.0581","","","0.1663","0.1712","","","","","","1.075","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4508832","11.3233","0.0003","4.4018","0.0001","10.8499","0.0004","90","","95.454","0.002","90","","538.34","0.03","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C9 H14 O6 U -","- C9 H14 O6 U -","- C18 H28 O12 U2 -","2","0.5","","Borkowski, Lauren A.; Cahill, Christopher L.","Crystal Engineering with the Uranyl Cation I. Aliphatic Carboxylate Coordination Polymers: Synthesis, Crystal Structures, and Fluorescent Properties","Crystal Growth & Design","2006","6","10","2241","","10.1021/cg060329h","","","0.71073","MoKα","","0.0438","0.0392","","","0.095","0.0968","","","","","","1.068","","","","has coordinates","179624","2020-10-21","18:00:00",""
"4508972","13.868","0.005","5.817","0.002","20.578","0.008","90","","91.174","0.005","90","","1659.7","1","293","2","273","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C36 H32 Cu N4 O5 -","- C36 H32 Cu N4 O5 -","- C72 H64 Cu2 N8 O10 -","2","0.5","","Ma, Yu; Cheng, Ai-Ling; Zhang, Jian-Yong; Yue, Qi; Gao, En-Qing","One-, Two-, and Three-Dimensional Coordination Polymers of Stilbenedicarboxylate with Different Metal Ions","Crystal Growth & Design","2009","9","2","867","","10.1021/cg800506g","","","0.71073","MoKα","","0.0899","0.0579","","","0.1355","0.1567","","","","","","0.997","","","","has coordinates","179625","2020-10-21","18:00:00",""
"4509120","22.55","0.01","14.187","0.007","25.681","0.012","90","","92.096","0.009","90","","8210","7","294","2","294","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C66.5 H66.5 Co3 N3.5 O19.5 -","- C62 H54 Co3 N2 O18 -","- C248 H216 Co12 N8 O72 -","4","1","","Luo, Feng; Che, Yun-xia; Zheng, Ji-min","Trinuclear Cobalt Based Porous Coordination Polymers Showing Unique Topological and Magnetic Variety upon Different Dicarboxylate-like Ligands","Crystal Growth & Design","2009","9","2","1066","","10.1021/cg800895g","","","0.71073","MoKα","","0.3233","0.2256","","","0.4838","0.5282","","","","","","1.462","","","","has coordinates","179627","2020-10-21","18:00:00",""
"4509121","22.55","0.01","14.187","0.007","25.681","0.012","90","","92.096","0.009","90","","8210","7","294","2","294","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C56 H32 Co3 N3 O16 -","- C56 H32 Co3 O16 -","- C224 H128 Co12 O64 -","4","1","","Luo, Feng; Che, Yun-xia; Zheng, Ji-min","Trinuclear Cobalt Based Porous Coordination Polymers Showing Unique Topological and Magnetic Variety upon Different Dicarboxylate-like Ligands","Crystal Growth & Design","2009","9","2","1066","","10.1021/cg800895g","","","0.71073","MoKα","","0.2041","0.1401","","","0.3393","0.3632","","","","","","0.941","","","","has coordinates","179627","2020-10-21","18:00:00",""
"4509626","8.9065","0.0002","15.0925","0.0003","8.5028","0.0002","90","","96.26","0.001","90","","1136.14","0.04","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C16 H14 Gd2 O19 -","- C16 H14 Gd2 O19 -","- C32 H28 Gd4 O38 -","2","0.5","","Gurunatha, K. L.; Mohapatra, Sudip; Suchetan, P. A.; Maji, Tapas Kumar","Single-Crystal-to-Single-Crystal Structural Transformation in a Flexible Porous Gadolinium-Organic Framework with Selective and Controlled Sorption Properties","Crystal Growth & Design","2009","9","9","3844","","10.1021/cg900541a","","","0.71073","MoKα","","0.0337","0.0285","","","0.0753","0.0783","","","","","","1.054","","","","has coordinates","179632","2020-10-21","18:00:00",""
"4509627","8.8975","0.0005","15.1126","0.0011","8.496","0.0006","90","","96.21","0.005","90","","1135.71","0.13","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C16 H14 Gd2 O17 -","- C16 H14 Gd2 O17 -","- C32 H28 Gd4 O34 -","2","0.5","","Gurunatha, K. L.; Mohapatra, Sudip; Suchetan, P. A.; Maji, Tapas Kumar","Single-Crystal-to-Single-Crystal Structural Transformation in a Flexible Porous Gadolinium-Organic Framework with Selective and Controlled Sorption Properties","Crystal Growth & Design","2009","9","9","3844","","10.1021/cg900541a","","","0.71073","MoKα","","0.1266","0.0689","","","0.1396","0.1737","","","","","","1.07","","","","has coordinates","179632","2020-10-21","18:00:00",""
"4509628","8.916","0.0007","15.1027","0.0014","8.5126","0.0008","90","","96.304","0.005","90","","1139.34","0.18","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C16 H4 Gd2 O19 -","- C16 H4 Gd2 O19 -","- C32 H8 Gd4 O38 -","2","0.5","","Gurunatha, K. L.; Mohapatra, Sudip; Suchetan, P. A.; Maji, Tapas Kumar","Single-Crystal-to-Single-Crystal Structural Transformation in a Flexible Porous Gadolinium-Organic Framework with Selective and Controlled Sorption Properties","Crystal Growth & Design","2009","9","9","3844","","10.1021/cg900541a","","","0.71073","MoKα","","0.1448","0.0756","","","0.1384","0.1649","","","","","","1.046","","","","has coordinates","179632","2020-10-21","18:00:00",""
"4509827","18.241","0.008","4.4906","0.0019","15.404","0.007","90","","113.219","0.007","90","","1159.6","0.9","90","","90","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C23 H32 O10 -","- C23 H32 O10 -","- C46 H64 O20 -","2","0.5","","Kohmoto, Shigeo; Kuroda, Yu; Kishikawa, Keiki; Masu, Hyuma; Azumaya, Isao","Generation of Square-Shaped Cyclic Dimers vs Zigzag Hydrogen-Bonding Networks and Pseudoconformational Polymorphism of Tethered Benzoic Acids","Crystal Growth & Design","2009","9","12","5017","","10.1021/cg901244v","","","0.71073","MoKα","","0.121","0.0682","","","0.1786","0.2079","","","","","","0.978","","","","has coordinates","179634","2020-10-21","18:00:00",""
"4509898","10.9063","0.0004","10.9553","0.0004","16.599","0.0007","90","","101.655","0.001","90","","1942.39","0.13","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C17 H12 N O5 Zn -","- C17 H12 N O5 Zn -","- C68 H48 N4 O20 Zn4 -","4","1","","Zhang, Chuanlei; Zhang, Mingdao; Qin, Ling; Zheng, Hegen","Crystal Structures and Spectroscopic Properties of Metal‒Organic Frameworks Based on Rigid Ligands with Flexible Functional Groups","Crystal Growth & Design","2014","14","2","491","","10.1021/cg401149h","","","0.71073","MoKα","","0.0541","0.0384","","","0.1036","0.1074","","","","","","1.005","","","","has coordinates,has disorder","179634","2020-10-21","18:00:00",""
"4509901","10.2536","0.0005","11.9941","0.0006","25.9444","0.0012","90","","105.733","0.002","90","","3071.2","0.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C34 H29 Co N2 O6.5 -","- C34 H29 Co N2 O6.5 -","- C136 H116 Co4 N8 O26 -","4","1","","Zhang, Chuanlei; Zhang, Mingdao; Qin, Ling; Zheng, Hegen","Crystal Structures and Spectroscopic Properties of Metal‒Organic Frameworks Based on Rigid Ligands with Flexible Functional Groups","Crystal Growth & Design","2014","14","2","491","","10.1021/cg401149h","","","0.71073","MoKα","","0.0789","0.0454","","","0.0992","0.1048","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4509911","19.056","0.009","9.7904","0.0015","26.613","0.007","90","","134.35","0.02","90","","3550","2","453","","453","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C24 H24 N4 Ni2 O17 V6 -","- C24 H24 N4 Ni2 O17 V6 -","- C96 H96 N16 Ni8 O68 V24 -","4","1","","Fernández de Luis, Roberto; Orive, Joseba; Larrea, Edurne S.; Urtiaga, M. Karmele; Arriortua, María I.","Reversible Solid-State Transformation in {Ni2(H2O)2(Bpa)2}(V6O17) Proved by Synchrotron Radiation: Color and Magnetic Properties Change","Crystal Growth & Design","2014","14","2","658","","10.1021/cg401540s","powder diffraction","","0.82548","synchrotron","","13.92","","","","","","","","0.51","","","","","","","has coordinates","179635","2020-10-21","18:00:00",""
"4509912","19.6177","0.001","9.3725","0.0003","26.6897","0.0017","90","","132.445","0.008","90","","3621.3","0.6","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C24 H28 N4 Ni2 O19 V6 -","- C24 H24 N4 Ni2 O19 V6 -","- C96 H96 N16 Ni8 O76 V24 -","4","1","","Fernández de Luis, Roberto; Orive, Joseba; Larrea, Edurne S.; Urtiaga, M. Karmele; Arriortua, María I.","Reversible Solid-State Transformation in {Ni2(H2O)2(Bpa)2}(V6O17) Proved by Synchrotron Radiation: Color and Magnetic Properties Change","Crystal Growth & Design","2014","14","2","658","","10.1021/cg401540s","","","0.71073","MoKα","","0.0979","0.0925","","","0.2241","0.2315","","","","","","1.06","","","","has coordinates","179635","2020-10-21","18:00:00",""
"4509977","13.254","0.002","7.3495","0.0013","13.555","0.002","90","","110.68","0.003","90","","1235.3","0.3","291","2","291","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H16 Ag2 N10 O6 S2 -","- C20 H16 Ag2 N10 O6 S2 -","- C40 H32 Ag4 N20 O12 S4 -","2","0.5","","Hu, Bin; Tao, Tao; Bin, Zheng-Yang; Peng, Yu-Xin; Ma, Bin-Bin; Huang, Wei","Architectural Diversity for Anion-Mediated Self-Assembly of Four Pairs of Silver(I) Polymeric Isomers Having Linear andV-Shaped Imidazole/Thiophene/Imidazole Bridging Spacers","Crystal Growth & Design","2014","14","1","300","","10.1021/cg401581q","","","0.71073","MoKα","","0.0689","0.0601","","","0.1664","0.1729","","","","","","1.142","","","","has coordinates","179635","2020-10-21","18:00:00",""
"4510179","17.523","0.008","17.315","0.009","15.91","0.008","90","","108.41","0.009","90","","4580","4","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C38 H40 N4 Ni2 O16 -","- C38 H28 N4 Ni2 O14 -","- C152 H112 N16 Ni8 O56 -","4","1","","Liu, Bo; Wei, Lei; Li, Nan-nan; Wu, Wei-Ping; Miao, Hui; Wang, Yao-Yu; Shi, Qi-Zhen","Solvent/Temperature and Dipyridyl Ligands Induced Diverse Coordination Polymers Based on 3-(2′,5′-Dicarboxylphenyl)pyridine","Crystal Growth & Design","2014","14","3","1110","","10.1021/cg401599x","","","0.71073","MoKα","","0.1275","0.0785","","","0.247","0.3078","","","","","","1.05","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4510407","17.053","0.006","11.363","0.004","18.518","0.006","90","","116.226","0.004","90","","3218.9","1.9","98","2","98","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C56 H50 N4 O14 Zn2 -","- C56 H50 N4 O14 Zn2 -","- C112 H100 N8 O28 Zn4 -","2","0.5","","Alawisi, Hussah; Li, Bin; He, Yabing; Arman, Hadi D.; Asiri, Abdullah M.; Wang, Hailong; Chen, Banglin","A Microporous Metal‒Organic Framework Constructed from a New Tetracarboxylic Acid for Selective Gas Separation","Crystal Growth & Design","2014","14","5","2522","","10.1021/cg500235j","","","0.71073","MoKα","","0.1139","0.1088","","","0.3484","0.3606","","","","","","1.65","","","","has coordinates,has disorder","179651","2020-10-21","18:00:00",""
"4510526","12.6902","0.0006","6.6202","0.0003","11.4593","0.0007","90","","90.146","0.006","90","","962.71","0.09","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Cs4 Mo4 O16 Th -","- Cs4 Mo4 O16 Th -","- Cs8 Mo8 O32 Th2 -","2","0.5","","Xiao, Bin; Dellen, Jakob; Schlenz, Hartmut; Bosbach, Dirk; Suleimanov, Evgeny V.; Alekseev, Evgeny V.","Unexpected Structural Complexity in Cesium Thorium Molybdates","Crystal Growth & Design","2014","14","5","2677","","10.1021/cg500418e","","","0.71073","MoKα","","0.0473","0.0321","","","0.0627","0.0688","","","","","","1.063","","","","has coordinates","179652","2020-10-21","18:00:00",""
"4510716","14.5375","0.0009","8.1374","0.0004","19.3409","0.0009","90","","107.31","0.004","90","","2184.4","0.2","200","2","200","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","{[Mn2(tppen)(H2O)4(adc)](adc).4H2O}n","","","- C37 H50 Mn2 N6 O16 -","- C37 H50 Mn2 N6 O16 -","- C74 H100 Mn4 N12 O32 -","2","0.5","","Khullar, Sadhika; Mandal, Sanjay K.","Structural Diversity of Mn(II) Complexes with Acetylene Dicarboxylate and Hexadentate Ancillary Ligands under Ambient Conditions: Effect of Methylene Chain Length on Coordination Architectures","Crystal Growth & Design","2013","13","7","3116","","10.1021/cg400507n","","","0.71073","MoKα","","0.0853","0.0462","","","0.092","0.1082","","","","","","0.966","","","","has coordinates","179654","2020-10-21","18:00:00",""
"4510760","15.9717","0.0015","7.6328","0.0007","23.774","0.002","90","","96.924","0.002","90","","2877.1","0.4","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C26 H14 Cd F6 N O4 S -","- C26 H14 Cd F6 N O4 S -","- C104 H56 Cd4 F24 N4 O16 S4 -","4","1","","Shi, Zhi-Qiang; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Six New 2D or 3D Metal‒Organic Frameworks Based on Bithiophene-Containing Ligand and Dicarboxylates: Syntheses, Structures, and Properties","Crystal Growth & Design","2013","13","7","3078","","10.1021/cg400490y","","","0.71073","MoKα","","0.0345","0.0303","","","0.0934","0.097","","","","","","1.011","","","","has coordinates","179654","2020-10-21","18:00:00",""
"4510761","15.4994","0.0014","7.5708","0.0007","23.427","0.002","90","","96.993","0.002","90","","2728.5","0.4","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C26 H14 F6 N O4 S Zn -","- C26 H14 F6 N O4 S Zn -","- C104 H56 F24 N4 O16 S4 Zn4 -","4","1","","Shi, Zhi-Qiang; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Six New 2D or 3D Metal‒Organic Frameworks Based on Bithiophene-Containing Ligand and Dicarboxylates: Syntheses, Structures, and Properties","Crystal Growth & Design","2013","13","7","3078","","10.1021/cg400490y","","","0.71073","MoKα","","0.0487","0.0346","","","0.0845","0.0887","","","","","","1.099","","","","has coordinates","179654","2020-10-21","18:00:00",""
"4510762","15.4985","0.0011","7.5058","0.0005","23.5458","0.0017","90","","96.272","0.001","90","","2722.7","0.3","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C26 H14 Co F6 N O4 S -","- C26 H14 Co F6 N O4 S -","- C104 H56 Co4 F24 N4 O16 S4 -","4","1","","Shi, Zhi-Qiang; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Six New 2D or 3D Metal‒Organic Frameworks Based on Bithiophene-Containing Ligand and Dicarboxylates: Syntheses, Structures, and Properties","Crystal Growth & Design","2013","13","7","3078","","10.1021/cg400490y","","","0.71073","MoKα","","0.0419","0.0386","","","0.1323","0.1358","","","","","","1.036","","","","has coordinates","179654","2020-10-21","18:00:00",""
"4510763","12.9879","0.0016","6.2776","0.0008","19.104","0.0017","90","","114.325","0.006","90","","1419.3","0.3","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C26 H22 N2 O4 S2 Zn -","- C26 H22 N2 O4 S2 Zn -","- C52 H44 N4 O8 S4 Zn2 -","2","0.5","","Shi, Zhi-Qiang; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Six New 2D or 3D Metal‒Organic Frameworks Based on Bithiophene-Containing Ligand and Dicarboxylates: Syntheses, Structures, and Properties","Crystal Growth & Design","2013","13","7","3078","","10.1021/cg400490y","","","0.71073","MoKα","","0.0411","0.0369","","","0.1123","0.1147","","","","","","1.042","","","","has coordinates","179654","2020-10-21","18:00:00",""
"4511099","10.689","0.002","11.221","0.002","21.392","0.004","90","","93.74","0.03","90","","2560.3","0.8","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","((R)-1-phenylethylammonium)2×(naphthalene-1,5-disulfonate)","","- C26 H30 N2 O6 S2 -","- C26 H30 N2 O6 S2 -","- C104 H120 N8 O24 S8 -","4","1","","Lemmerer, Andreas; Bourne, Susan A.; Fernandes, Manuel A.","Centrosymmetric and NoncentrosymmetricR44(12) Rings As Primary Motifs in Salts of Sulfonate Anions and Chiral Primary Ammonium Cations: Their Occurrence in Hydrates, Nonhydrates, and the Zöllner Illusion","Crystal Growth & Design","2009","9","5","2265","","10.1021/cg8010585","","","0.71073","MoKα","","0.1108","0.0816","","","0.1851","0.1941","","","","","","1.239","","","","has coordinates,has disorder","194592","2020-10-21","18:00:00",""
"4511363","10.247","0.002","12.096","0.002","13.312","0.002","90","","90.92","0.06","90","","1649.8","0.5","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C28 H23 K N4 O22 Zr -","- C28 H23 K N4 O22 Zr -","- C56 H46 K2 N8 O44 Zr2 -","2","0.5","","Imaz, Inhar; Thillet, Anthony; Sutter, Jean-Pascal","Charge-Assisted Hydrogen-Bonded Assemblage of an Anionic {M(C2O4)4}4-Building Unit and Organic Cations: A Versatile Approach to Hybrid Supramolecular Architectures","Crystal Growth & Design","2007","7","9","1753","","10.1021/cg060905+","","","0.71073","MoKα","","0.0562","0.0333","","","0.0917","0.1403","","","","","","1.253","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4511478","24.488","0.004","4.749","0.001","22.065","0.003","90","","110.87","0.01","90","","2397.7","0.7","293","2","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C30 H24 O6 -","- C30 H18 O6 -","- C120 H72 O24 -","4","1","","Vergadou, Vassiliki; Pistolis, George; Michaelides, Adonis; Varvounis, George; Siskos, Michael; Boukos, Nikos; Skoulika, Stavroula","Self-Organization of Four Symmetric Tri-phenyl-benzene Derivatives","Crystal Growth & Design","2006","6","11","2486","","10.1021/cg060183m","","","0.71073","MoKα","","0.1055","0.0629","","","0.1791","0.2244","","","","","","0.927","","","","has coordinates","287904","2023-11-30","17:49:47",""
"4511480","14.381","0.006","9.979","0.004","16.373","0.007","90","","110.993","0.006","90","","2193.7","1.6","298","2","298","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C14 H18 Ag F6 N4 O S2 Sb -","- C14 H18 Ag F6 N4 O S2 Sb -","- C56 H72 Ag4 F24 N16 O4 S8 Sb4 -","4","1","","Dong, Yu-Bin; Wang, Le; Ma, Jian-Ping; Zhao, Xia-Xia; Shen, Da-Zhong; Huang, Ru-Qi","Ag(I) Complexes Generated from Double Schiff-Base Ligand with Thiazole as the Terminal Binding Sites","Crystal Growth & Design","2006","6","11","2475","","10.1021/cg060158g","","","0.71073","MoKα","","0.0972","0.062","","","0.1569","0.1743","","","","","","0.917","","","","has coordinates","179661","2020-10-21","18:00:00",""
"4511554","16.309","0.003","14.636","0.003","13.941","0.004","90","","93.67","0.03","90","","3320.9","1.3","163","2","163","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C22 H25 Ag2 F12 N7 P2 S -","- C22 H25 Ag2 F12 N7 P2 S -","- C88 H100 Ag8 F48 N28 P8 S4 -","4","1","","Amoore, Jarrod J. M.; Black, Cory A.; Hanton, Lyall R.; Spicer, Mark D.","Increasing Structural Dimensionality in Ag(I) Coordination Polymers Formed from the Same Flexible Multimodal Thioether Pyrazine Ligand","Crystal Growth & Design","2005","5","3","1255","","10.1021/cg050011+","","","0.71073","MoKα","","0.1154","0.1027","","","0.2656","0.2704","","","","","","1.186","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511637","15.258","0.0004","18.0513","0.001","16.9899","0.0008","90","","95.344","0.003","90","","4659.1","0.4","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C86 H90 N10 Ni2 O39 U4 -","- C86 H80 N10 Ni2 O39 U4 -","- C172 H160 N20 Ni4 O78 U8 -","2","0.5","","Thuéry, Pierre; Harrowfield, Jack","Uranyl Ion Complexes with all-cis-1,3,5-Cyclohexanetricarboxylate: Unexpected Framework and Nanotubular Assemblies","Crystal Growth & Design","2014","14","8","4214","","10.1021/cg500828s","","","0.71073","MoKα","","0.0636","0.0502","","","0.1211","0.1251","","","","","","1.099","","","","has coordinates","179663","2020-10-21","18:00:00",""
"4511946","7.2406","0.0006","9.8413","0.0007","11.7694","0.001","90","","104.596","0.009","90","","811.59","0.12","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Cl2 Mn4 O12 Sb6 -","- Cl2 Mn4 O12 Sb6 -","- Cl4 Mn8 O24 Sb12 -","2","0.5","","Zimmermann, Iwan; Johnsson, Mats","A Synthetic Route toward Layered Materials: Introducing Stereochemically Active Lone-Pairs into Transition Metal Oxohalides","Crystal Growth & Design","2014","14","10","5252","","10.1021/cg5010374","","","0.71069","MoKα","","0.1447","0.0521","","","0.0601","0.0738","","","","","","0.666","","","","has coordinates","179666","2020-10-21","18:00:00",""
"4511973","12.8331","0.0019","15.626","0.002","7.545","0.0011","90","","93.225","0.003","90","","1510.6","0.4","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C8 H8 Cd N5 O4 -","- C8 H8 Cd N5 O4 -","- C32 H32 Cd4 N20 O16 -","4","1","","Mohapatra, Balaram; Venkatesh, V.; Verma, Sandeep","Crystal Engineering with 2-Aminopurine Containing a Carboxylic Acid Pendant","Crystal Growth & Design","2014","14","10","5042","","10.1021/cg501142v","","","0.71073","MoKα","","0.0951","0.0834","","","0.2496","0.2597","","","","","","1.023","","","","has coordinates","179666","2020-10-21","18:00:00",""
"4512067","11.4071","0.0007","15.8882","0.0012","13.1892","0.0007","90","","99.639","0.006","90","","2356.6","0.3","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C34 H29 Fe N6 O2.5 S2 -","- C34 H24 Fe N6 S2 -","- C68 H48 Fe2 N12 S4 -","2","0.5","","Wu, Xue-Ru; Yang, Xü; Wei, Rong-Jia; Li, Jia; Zheng, Lan-Sun; Tao, Jun","Solvent-Mediated Isomerization of FeIIComplexes from a 3D 65·8 Framework to a 2D 44Rhombus-Grid Network","Crystal Growth & Design","2014","14","10","4891","","10.1021/cg5011506","","","0.71073","MoKα","","0.0909","0.0683","","","0.2051","0.2247","","","","","","1.057","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4512069","12.2567","0.0004","9.1981","0.0004","11.9933","0.0004","90","","98.048","0.003","90","","1338.79","0.09","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C12 H16 F6 N8 O10 S4 Zn -","- C12 H12 F6 N8 O10 S4 Zn -","- C24 H24 F12 N16 O20 S8 Zn2 -","2","0.5","","Yao, Jia; Chen, Jia-Mei; Xu, Yi-Bo; Lu, Tong-Bu","Enhancing the Solubility of 6-Mercaptopurine by Formation of Ionic Cocrystal with Zinc Trifluoromethanesulfonate: Single-Crystal-to-Single-Crystal Transformation","Crystal Growth & Design","2014","14","10","5019","","10.1021/cg5005819","","","1.54178","CuKα","","0.0531","0.0476","","","0.1302","0.1356","","","","","","1.041","","","","has coordinates,has disorder","179667","2020-10-21","18:00:00",""
"4512071","12.1058","0.0005","9.1233","0.0007","11.96","0.0005","90","","96.781","0.004","90","","1311.68","0.13","300","2","300","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C12 H10 F6 N8 O7 S4 Zn -","- C12 H10 F6 N8 O7 S4 Zn -","- C24 H20 F12 N16 O14 S8 Zn2 -","2","0.5","","Yao, Jia; Chen, Jia-Mei; Xu, Yi-Bo; Lu, Tong-Bu","Enhancing the Solubility of 6-Mercaptopurine by Formation of Ionic Cocrystal with Zinc Trifluoromethanesulfonate: Single-Crystal-to-Single-Crystal Transformation","Crystal Growth & Design","2014","14","10","5019","","10.1021/cg5005819","","","1.54178","CuKα","","0.0928","0.0779","","","0.2198","0.2439","","","","","","1.042","","","","has coordinates,has disorder","179667","2020-10-21","18:00:00",""
"4512141","8.3104","0.0015","7.6619","0.0014","10.7189","0.0019","90","","94.267","0.003","90","","680.6","0.2","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C12 H10 Cd N2 O8 -","- C12 H10 Cd N2 O8 -","- C24 H20 Cd2 N4 O16 -","2","0.5","","Kang, Yi-Fan; Liu, Jian-Qiang; Liu, Bo; Zhang, Wen-Tao; Liu, Qing; Liu, Ping; Wang, Yao-Yu","Series of Cd(II) and Pb(II) Coordination Polymers Based on a Multilinker (R,S-)2,2′-Bipyridine-3,3′-dicarboxylate-1,1′-dioxide","Crystal Growth & Design","2014","14","11","5466","","10.1021/cg5006192","","","0.71073","MoKα","","0.051","0.0363","","","0.099","0.1058","","","","","","1.017","","","","has coordinates","179668","2020-10-21","18:00:00",""
"4512532","11.3517","0.0012","11.3956","0.001","13.2806","0.0012","90","","110.274","0.011","90","","1611.5","0.3","296.15","","296.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H16 Co2 N2 O10 -","- C26 H16 Co2 N2 O10 -","- C52 H32 Co4 N4 O20 -","2","0.5","","Munn, Alexis S.; Amabilino, Silvia; Stevens, Thomas W.; Daniels, Luke M.; Clarkson, Guy J.; Millange, Franck; Lennox, Matthew J.; Düren, Tina; Bourelly, Sandrine; Llewellyn, Philip L.; Walton, Richard I.","Metal‒Organic Frameworks from Divalent Metals and 1,4-Benzenedicarboxylate with Bidentate Pyridine-N-oxide Co-ligands","Crystal Growth & Design","2015","15","2","891","","10.1021/cg501690b","","","0.7107","MoKα","","0.1554","0.0738","","","0.1089","0.1261","","","","","","0.962","","","","has coordinates","179672","2020-10-21","18:00:00",""
"4512637","24.8834","0.0005","22.8378","0.0005","24.3802","0.0006","90","","105.497","0.007","90","","13351.1","0.7","173","","173","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C53 H65 Cr2 Mn2 N3 O37 -","- C53 H65 Cr2 Mn2 N3 O37 -","- C424 H520 Cr16 Mn16 N24 O296 -","8","2","","Endo, Toru; Kubo, Kazuya; Yoshitake, Masashi; Noro, Shin-ichiro; Hoshino, Norihisa; Akutagawa, Tomoyuki; Nakamura, Takayoshi","Three-Dimensional Architectures of [MnIICrIII(oxalate)3]−Complexes with Cage-Type Networks Surrounding Supramolecular Cations","Crystal Growth & Design","2015","15","3","1186","","10.1021/cg501560z","","","0.71075","MoKα","","","0.0907","","","","0.2762","","","","","","1.023","","","","has coordinates","179674","2020-10-21","18:00:00",""
"4512657","17.8116","0.0005","18.5505","0.0006","16.688","0.0005","90","","107.597","0.002","90","","5255.9","0.3","296","2","296.15","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H21.25 Cl2 Cu N9.25 O8 -","- C20 H21.25 Cl2 Cu N9.25 O8 -","- C160 H170 Cl16 Cu8 N74 O64 -","8","2","","Ferguson, Jayne L.; Fitchett, Christopher M.","N,N′-Dimethylene-2,2′-biimidazole—A Mimic of Carboxylate for the Formation of Complexes with Copper(I) And the Anion Directed Formation of a Solvent Pocket","Crystal Growth & Design","2015","15","3","1280","","10.1021/cg5016803","","","0.71073","MoKα","","0.0867","0.0501","","","0.1196","0.1426","","","","","","1.014","","","","has coordinates,has disorder","179674","2020-10-21","18:00:00",""
"4512727","13.0503","0.0004","11.4707","0.0003","18.8224","0.0005","90","","91.808","0.001","90","","2816.24","0.14","149","2","149","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C36 H28 O6 -","- C36 H28 O6 -","- C144 H112 O24 -","4","1","","Tamboli, Majid I.; Bahadur, Vir; Gonnade, Rajesh G.; Shashidhar, Mysore S.","Cocrystallization of 2,3-Dihydroxynaphthalene with Itspara-,meta-, andortho-Ditoluates: Insight into Cocrystal Formation and Clues for the Construction of Supramolecular Assemblies Capable of Intermolecular Acyl Group Transfer Reactivity","Crystal Growth & Design","2015","15","3","1226","","10.1021/cg501620g","","","0.71073","MoKα","","0.0509","0.0412","","","0.1163","0.1268","","","","","","1.03","","","","has coordinates","179675","2020-10-21","18:00:00",""
"4512901","17.033","0.004","9.182","0.002","23.177","0.004","90","","131.684","0.012","90","","2707.1","1.1","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C53 H40 Co2 N6 O12 -","- C53 H40 Co2 N6 O12 -","- C106 H80 Co4 N12 O24 -","2","0.5","","Hu, Jin-Song; Huang, Xin-Hua; Pan, Cheng-Ling; Zhang, Lei","Photochemical and Magnetic Properties of Seven New Metal‒Organic Frameworks Constructed by Flexible Tetrapyridines and V-Shaped Polycarboxylate Acids","Crystal Growth & Design","2015","15","5","2272","","10.1021/acs.cgd.5b00067","","","0.71073","MoKα","","0.0495","0.0385","","","0.1019","0.108","","","","","","1.035","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4512933","29.1636","0.0008","9.5465","0.0003","21.3518","0.0006","90","","100.586","0.0015","90","","5843.4","0.3","110","2","110","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C116 H80 I6 N24 O7 Sn2 -","- C116 H80 I6 N24 O7 Sn2 -","- C232 H160 I12 N48 O14 Sn4 -","2","0.5","","Titi, Hatem M.; Nandi, Goutam; Tripuramallu, Bharat Kumar; Goldberg, Israel","Exploring Supramolecular Self-Assembly of Tetraarylporphyrins by Halogen Interactions. 3. Tin(L)2(A2B2-Porphyrin) Arrays Supported by Concerted Halogen and Hydrogen Bonding","Crystal Growth & Design","2015","15","6","3063","","10.1021/acs.cgd.5b00543","","","0.71073","MoKα","","0.0812","0.0612","","","0.1346","0.1409","","","","","","1.093","","","","has coordinates","138049","2020-10-21","18:00:00",""
"4513107","4.6825","0.0011","6.799","0.0015","23.173","0.005","90","","101.429","0.006","90","","723.1","0.3","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","1,2-di(pyridine-4-yl)diazene caynuric acid","","- C13 H11 N7 O3 -","- C13 H11 N7 O3 -","- C26 H22 N14 O6 -","2","0.5","","Ravat, Prince; SeethaLekshmi, Sunil; Biswas, Sharmita Nandy; Nandy, Purnendu; Varughese, Sunil","Equivalence of Ethylene and Azo-Bridges in the Modular Design of Molecular Complexes: Role of Weak Interactions","Crystal Growth & Design","2015","15","5","2389","","10.1021/acs.cgd.5b00183","","","0.71073","MoKα","","0.1695","0.1158","","","0.2761","0.2973","","","","","","1.507","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4513444","17.9388","0.0013","9.2136","0.0006","26.536","0.002","90","","108.127","0.004","90","","4168.2","0.5","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C68 H48 Co2 N4 O10 -","- C68 H48 Co2 N4 O10 -","- C136 H96 Co4 N8 O20 -","2","0.5","","Park, In-Hyeok; Medishetty, Raghavender; Lee, Hyeong-Hwan; Herng, Tun Seng; Ding, Jun; Lee, Shim Sung; Vittal, Jagadese J.","Influence of Angular Dicarboxylate Ligand on the Structures of Single and Double Pillared-Layer Coordination Polymers of Co(II)","Crystal Growth & Design","2015","15","8","4156","","10.1021/acs.cgd.5b00766","","","0.71073","MoKα","","0.0972","0.0785","","","0.2128","0.2251","","","","","","1.065","","","","has coordinates,has disorder","154572","2020-10-21","18:00:00",""
"4513471","12.1599","0.0015","7.1495","0.0011","13.5183","0.0014","90","","90.035","0.01","90","","1175.2","0.3","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C10 H12 N5 O3.5 -","- C10 H11 N5 O3.5 -","- C40 H44 N20 O14 -","4","1","","Kamali, Naghmeh; Aljohani, Marwah; McArdle, Patrick; Erxleben, Andrea","Hydrogen Bonding Networks and Solid-State Conversions in Benzamidinium Salts","Crystal Growth & Design","2015","15","8","3905","","10.1021/acs.cgd.5b00529","","","0.71073","MoKα","","0.0634","0.0449","","","0.1102","0.1222","","","","","","1.016","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4513718","5.706","0.009","9.274","0.002","14.059","0.003","90","","98.052","0.007","90","","736.6","1.2","150","","150","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C13 H26 N2 O4 -","- C13 H26 N2 O4 -","- C26 H52 N4 O8 -","2","0.5","","Martins, Inês C. B.; Sardo, Mariana; Santos, Sérgio M.; Fernandes, Auguste; Antunes, Alexandra; André, Vânia; Mafra, Luís; Duarte, M. Teresa","Packing Interactions and Physicochemical Properties of Novel Multicomponent Crystal Forms of the Anti-Inflammatory Azelaic Acid Studied by X-ray and Solid-State NMR","Crystal Growth & Design","2016","16","1","154","","10.1021/acs.cgd.5b01057","","","0.71069","MoKα","","0.1048","0.0528","","","0.1231","0.1389","","","","","","0.952","","","","has coordinates","175768","2020-10-21","18:00:00",""
"4514561","18.272","0.001","12.9436","0.0008","17.0277","0.0007","90","","100.118","0.003","90","","3964.5","0.4","120","","120","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","2,7-bis(9,9-dimethyl-acridin-10-yl)-3,6,9,9-tetramethylthioxanthene-S,S-dioxide","","- C47.75 H45.5 Cl1.5 N2 O2 S -","- C47 H44 N2 O2 S -","- C188 H176 N8 O8 S4 -","4","1","","Stachelek, Patrycja; Ward, Jonathan S.; Dos Santos, Paloma L.; Danos, Andrew; Colella, Marco; Haase, Nils; Raynes, Samuel J.; Batsanov, Andrei S.; Bryce, Martin R.; Monkman, Andrew P.","Molecular Design Strategies for Color Tuning of Blue TADF Emitters.","ACS applied materials & interfaces","2019","11","30","27125","27133","10.1021/acsami.9b06364","","x-ray","1.54184","CuKα","","0.1051","0.0754","","","0.1793","0.1963","","","","","","1.048","","","","has coordinates","219746","2020-10-21","18:00:00",""
"4514734","22.883","0.0008","9.2579","0.0003","21.1481","0.0008","90","","115.533","0.004","90","","4042.6","0.3","93","2","93","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C51 H53 Ni P2 -","- C51 H53 Ni P2 -","- C204 H212 Ni4 P8 -","4","1","","Charboneau, David J.; Brudvig, Gary W.; Hazari, Nilay; Lant, Hannah M. C.; Saydjari, Andrew K.","Development of an Improved System for the Carboxylation of Aryl Halides through Mechanistic Studies.","ACS catalysis","2019","9","4","3228","3241","10.1021/acscatal.9b00566","","","0.71073","MoKα","","0.1116","0.0566","","","0.0989","0.1163","","","","","","1.014","","","","has coordinates","219899","2020-10-21","18:00:00",""
"4515501","14.4785","0.0014","9.0523","0.001","16.7522","0.0019","90","","92.179","0.005","90","","2194","0.4","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C23 H31 Cl Fe N2 -","- C23 H31 Cl Fe N2 -","- C92 H124 Cl4 Fe4 N8 -","4","1","","Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong","Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes","ACS Catalysis","2018","9","2","810","","10.1021/acscatal.8b03552","","","0.71073","MoKα","","0.1367","0.0568","","","0.1023","0.1306","","","","","","0.964","","","","has coordinates","225657","2020-10-21","18:00:00",""
"4516454","20.9049","0.0004","14.6808","0.0003","14.2515","0.0003","90","","108.043","0.001","90","","4158.71","0.15","173","2","173","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C68 H56 Ag3 Cl8 F18 N8 P3 S4 -","- C68 H56 Ag3 Cl8 F18 N8 P3 S4 -","- C136 H112 Ag6 Cl16 F36 N16 P6 S8 -","2","0.5","","Lee, Eunji; Ju, Huiyeong; Kim, Seulgi; Park, Ki-Min; Lee, Shim Sung","Anion-Directed Coordination Networks of a Flexible S-Pivot Ligand and Anion Exchange in the Solid State","Crystal Growth & Design","2015","15","11","5427","","10.1021/acs.cgd.5b01050","","","0.71073","MoKα","","0.0587","0.0394","","","0.0903","0.1012","","","","","","1.017","","","","has coordinates","231330","2020-10-21","18:00:00",""
"4516975","17.612","0.013","7.593","0.006","15.88","0.012","90","","109.057","0.009","90","","2007","3","293","","293","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C22 H18 Br N6 O1.5 -","- C22 H18 Br N6 O1.5 -","- C88 H72 Br4 N24 O6 -","4","1","","Ibrahim, Hamada Mohamed; Behbehani, Haider","Sustainable Synthetic Approach for (Pyrazol-4-ylidene)pyridines By Metal Catalyst-Free Aerobic C(sp<sup>2</sup>)-C(sp<sup>3</sup>) Coupling Reactions between 1-Amino-2-imino-pyridines and 1-Aryl-5-pyrazolones.","ACS omega","2019","4","7","11701","11711","10.1021/acsomega.9b01650","","","0.71075","MoKα","","","0.0694","","","","0.2197","","","","","","1.039","","","","has coordinates","271475","2021-12-16","11:44:44",""
"4517651","16.1983","0.0015","6.9475","0.0007","18.7656","0.0017","90","","94.386","0.003","90","","2105.7","0.3","110","2","110","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C14 H24 Fe K2 N3 O13 -","- C14 H24 Fe K2 N3 O13 -","- C56 H96 Fe4 K8 N12 O52 -","4","1","","Waters, Scott E.; Robb, Brian H.; Marshak, Michael P.","Effect of Chelation on Iron‒Chromium Redox Flow Batteries","ACS Energy Letters","2020","","","1758","1762","10.1021/acsenergylett.0c00761","","","0.71073","MoKα","","0.0359","0.0315","","","0.0768","0.0793","","","","","","1.136","","","","has coordinates","257082","2020-10-21","18:00:00",""
"4517842","8.6942","0.0006","5.3788","0.0004","31.905","0.002","90","","95.078","0.006","90","","1486.16","0.18","100.01","0.1","100.01","0.1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","1H-indole-2-methanol","","- C9 H9 N O -","- C9 H9 N O -","- C72 H72 N8 O8 -","8","2","","Pisarek, Joanna; Malinska, Maura","Structure and Morphology of Indole Analogue Crystals.","ACS omega","2020","5","28","17141","17151","10.1021/acsomega.0c01020","","x-ray","1.54184","CuKα","","0.0923","0.0556","","","0.1307","0.1569","","","","","","1.027","","","","has coordinates,has disorder","255799","2020-10-21","18:00:00",""
"4518012","23.6761","0.0012","7.0053","0.0003","22.401","0.0012","90","","117.192","0.001","90","","3304.8","0.3","193","2","193","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C21 H54 N15 P3 -","- C21 H54 N15 P3 -","- C84 H216 N60 P12 -","4","1","","Wang, Lebin; Zhang, Jinbo; Zhao, Na; Ren, Chuanli; Liu, Shaofeng; Li, Zhibo","Synthesis of Tris-Phosphazene Bases with Triazine as Core and Their Applications for Efficient Ring-Opening Alternating Copolymerization of Epoxide and Anhydride: Notable Effect of Basicity and Molecular Size","ACS Macro Letters","2020","9","9","1398","1402","10.1021/acsmacrolett.0c00564","","","0.71073","MoKα","","0.0638","0.0454","","","0.1043","0.1154","","","","","","1.052","","","","has coordinates","257085","2020-10-21","18:00:00",""
"4518510","17.2803","0.0012","9.5964","0.0006","33.993","0.002","90","","90.416","0.004","90","","5636.9","0.6","100","2","99.82","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C30 H42 Hf N2 -","- C30 H42 Hf N2 -","- C240 H336 Hf8 N16 -","8","2","","Zhang, Jialong; Mason, Alexander H.; Motta, Alessandro; Cesar, Laryssa G.; Kratish, Yosi; Lohr, Tracy L.; Miller, Jeffrey T.; Gao, Yanshan; Marks, Tobin J.","Surface vs Homogeneous Organo-Hafnium Catalyst Ion-Pairing and Ligand Effects on Ethylene Homo- and Copolymerizations","ACS Catalysis","2021","","","3239","3250","10.1021/acscatal.0c04678","","","0.71073","MoKα","","0.1411","0.0949","","","0.2218","0.2365","","","","","","1.102","","","","has coordinates","262312","2021-02-27","22:22:41",""
"4518909","13.075","0.0018","9.6442","0.0013","16.634","0.002","90","","107.703","0.005","90","","1998.2","0.5","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C16 H18 Br2 Cu2 N4 O2 -","- C16 H18 Br2 Cu2 N4 O2 -","- C64 H72 Br8 Cu8 N16 O8 -","4","1","","Thapa, Kedar Bahadur; Chen, Baojun; Bian, Li; Xu, Yixiu; He, Jiangang; Huang, Wei; Ju, Qiang; Fang, Zhenlan","Single-Metallic Thermoresponsive Coordination Network as a Dual-Parametric Luminescent Thermometer","ACS Applied Materials & Interfaces","2021","","","","","10.1021/acsami.1c07812","","","0.71073","MoKα","","0.1134","0.0579","","","0.1519","0.1866","","","","","","1.038","","","","has coordinates","267675","2021-07-21","21:18:24",""
"4518910","13.117","0.002","9.6735","0.0014","16.724","0.003","90","","107.702","0.005","90","","2021.6","0.6","295","2","295","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C16 H18 Br2 Cu2 N4 O2 -","- C16 H18 Br2 Cu2 N4 O2 -","- C64 H72 Br8 Cu8 N16 O8 -","4","1","","Thapa, Kedar Bahadur; Chen, Baojun; Bian, Li; Xu, Yixiu; He, Jiangang; Huang, Wei; Ju, Qiang; Fang, Zhenlan","Single-Metallic Thermoresponsive Coordination Network as a Dual-Parametric Luminescent Thermometer","ACS Applied Materials & Interfaces","2021","","","","","10.1021/acsami.1c07812","","","0.71073","MoKα","","0.1001","0.051","","","0.1019","0.1194","","","","","","1.082","","","","has coordinates","267676","2021-07-21","21:18:42",""
"4518911","13.115","0.002","9.6722","0.0013","16.721","0.003","90","","107.715","0.005","90","","2020.5","0.6","297","2","297","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C16 H18 Br2 Cu2 N4 O2 -","- C16 H18 Br2 Cu2 N4 O2 -","- C64 H72 Br8 Cu8 N16 O8 -","4","1","","Thapa, Kedar Bahadur; Chen, Baojun; Bian, Li; Xu, Yixiu; He, Jiangang; Huang, Wei; Ju, Qiang; Fang, Zhenlan","Single-Metallic Thermoresponsive Coordination Network as a Dual-Parametric Luminescent Thermometer","ACS Applied Materials & Interfaces","2021","","","","","10.1021/acsami.1c07812","","","0.71073","MoKα","","0.0999","0.0487","","","0.1026","0.1242","","","","","","1.001","","","","has coordinates","267677","2021-07-21","21:18:58",""
"4518912","13.0548","0.0018","9.6339","0.0012","16.609","0.002","90","","107.692","0.004","90","","1990.1","0.4","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C16 H18 Br2 Cu2 N4 O2 -","- C16 H18 Br2 Cu2 N4 O2 -","- C64 H72 Br8 Cu8 N16 O8 -","4","1","","Thapa, Kedar Bahadur; Chen, Baojun; Bian, Li; Xu, Yixiu; He, Jiangang; Huang, Wei; Ju, Qiang; Fang, Zhenlan","Single-Metallic Thermoresponsive Coordination Network as a Dual-Parametric Luminescent Thermometer","ACS Applied Materials & Interfaces","2021","","","","","10.1021/acsami.1c07812","","","0.71073","MoKα","","0.1197","0.0584","","","0.1253","0.1487","","","","","","1.042","","","","has coordinates","267678","2021-07-21","21:19:14",""
"4519086","12.695","0.0005","9.0348","0.0003","9.2339","0.0003","90","","91.204","0.003","90","","1058.86","0.06","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- Fe2 Mo2 Na O12 P -","- Fe2 Mo2 Na O12 P -","- Fe8 Mo8 Na4 O48 P4 -","4","1","","Wu, Yun; Cao, Zhenyu; Song, Limei; Gao, Jianhua","NaFe<sub>2</sub>PO<sub>4</sub>(MoO<sub>4</sub>)<sub>2</sub>: A Promising NASICON-Type Electrode Material for Sodium-Ion Batteries.","ACS applied materials & interfaces","2021","13","41","48865","48871","10.1021/acsami.1c15010","","","0.71073","MoKα","","0.0549","0.0497","","","0.1342","0.1395","","","","","","1.071","","","","has coordinates","270225","2021-11-03","20:01:57",""
"4519192","12.4443","0.001","12.4258","0.0011","18.7974","0.0017","90","","108.271","0.003","90","","2760.1","0.4","150","2","150","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C40 H70 Mo24 N8 O96 P2 Zn8 -","- C40 H32 Mo24 N8 O96 P2 Zn8 -","- C40 H32 Mo24 N8 O96 P2 Zn8 -","1","0.25","","Chen, Yanhong; Chang, Shenzhen; An, Haiyan; Li, Yanqin; Zhu, Qingshan; Luo, Huiyun; Huang, Yaohui","Two Polymorphic Polyoxometalate-Based Metal–Organic Frameworks for the Efficient Synthesis of Functionalized Sulfoxides and Detoxification of Mustard Gas Simulants","ACS Sustainable Chemistry & Engineering","2021","9","46","15683","15693","10.1021/acssuschemeng.1c06433","","","0.71073","MoKα","","0.1033","0.0499","","","0.1009","0.1171","","","","","","1.011","","","","has coordinates","271058","2021-12-03","22:39:13",""
"4519479","9.3639","0.0003","8.0701","0.0002","10.3114","0.0003","90","","90.497","0.001","90","","779.18","0.04","150","","150","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","benzene-1,2,4,5-tetrakis(ammonium) bis(hydrogen sulfate) sulfate","","- C6 H16 N4 O12 S3 -","- C6 H16 N4 O12 S3 -","- C12 H32 N8 O24 S6 -","2","0.5","","Johann O. E. Sosoe; Thierry Maris; James D. Wuest","Strongly Hydrogen-Bonded Networks Formed by Sulfate and Bisulfate Salts of Benzenetetramines","Crystal Growth and Design","2023","23","","8865","8874","10.1021/acs.cgd.3c00950","","x-ray","1.34139","GaKα","","0.0386","0.0386","","","0.0971","0.0972","","","","","","1.126","","","","has coordinates,has disorder,has Fobs","288090","2023-12-06","15:35:51",""
"5000381","15.031","0.002","11.437","0.002","12.326","0.001","90","","96.702","0.008","90","","2104.48","","223","2","223","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","1,2,3,4,5,6,7,8-Octaphenyl-9-fluorenone","","- C61 H40 O -","- C61 H40 O -","- C122 H80 O2 -","2","0.5","","Ling Tong; Heidi Lau; Douglas M. Ho; Robert A. Pascal","Polyphenylbiphenyls and Polyphenylfluorenes","Journal of the American Chemical Society","1998","120","","6000","6006","10.1021/ja980322r","","","0.71073","MoKα","","0.1645","7.84","","0.3079","7.84","","","","0.962","1.289","1.289","","","","","has coordinates","176451","2020-10-21","18:00:00",""
"5910158","4.691","","5.72","","4.925","","90","","90.38","","90","","132.147","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- O4 W Zn -","- O20 W4 Zn4 -","- O20 W4 Zn4 -","","","","Wyckoff, R. W. G.","Page 41-43 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","","41","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910249","4.8","","5.65","","5.1","","90","","91.3","","90","","138.276","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- O4 Sc Ta -","- O20 Sc4 Ta4 -","- O20 Sc4 Ta4 -","","","","Wyckoff, R. W. G.","Page 41-43 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","","41","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910277","4.6","","5.665","","4.912","","90","","90.5","","90","","127.997","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Ni O4 W -","- Ni4 O20 W4 -","- Ni4 O20 W4 -","","","","Wyckoff, R. W. G.","Page 41 & 42 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","","41","42","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910316","4.66","","5.69","","4.98","","90","","90","","90","","132.047","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Co O4 W -","- Co4 O20 W4 -","- Co4 O20 W4 -","","","","Wyckoff, R. W. G.","Page 41-43 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","","41","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910335","11.58","","10.81","","9.14","","90","","112","","90","","1060.83","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Ba K2 O12 S12 -","- Ba4 K8 O96 S96 -","- Ba4 K8 O96 S96 -","","","","Wyckoff, R. W. G.","Pages 42 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","42","42","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910338","4.8","","5.65","","5.09","","90","","91.42","","90","","137.998","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Nb O4 Sc -","- Nb4 O20 Sc4 -","- Nb4 O20 Sc4 -","","","","Wyckoff, R. W. G.","Page 41-43 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","","41","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910347","4.829","","5.759","","4.998","","90","","91.1","","90","","138.97","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Mn O4 W -","- Mn4 O20 W4 -","- Mn4 O20 W4 -","","","","Wyckoff, R. W. G.","Page 41-43 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","","41","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"6000234","7.9362","","5.9639","","18.4416","","90","","91.325","","90","","872.62","","","","","","","","","","","","","4","P 1 2/c 1","","","","","","- Ba3 Er Ga2 O7.5 -","","","","","","Abakumov, A. M.; Shpanchenko, R. V.; Lebedev, O. I.; Van, Tendeloo G; Amelinckx, S.; Antipov, E. V.","The phase transitions and crystal structures of Ba3RM2O7.5 complex oxides (R = rare-earth elements, m = Al, Ga)","Acta Crystallographica Section A","1999","55","5","828","839","10.1107/S0108767399002068","","","","","","","","","","","","","","","","","","","","","","174685","2020-10-21","18:00:00",""
"6000392","24.25","0.009","6.642","0.002","6.918","0.002","90","","97.43","0.03","90","","1104.92","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Cl9 Nd7 S6 -","- Cl9 Nd7 S6 -","- Cl18 Nd14 S12 -","2","0.5","","Lissner, Falk; Schleid, Thomas","Two novel sulfide chlorides of the lanthanides: Synthesis and crystal structure of Pr7S6Cl9 and Nd7S6Cl9","Zeitschrift Für Anorganische Und Allgemeine Chemie","1998","624","","1903","1908","10.1002/(SICI)1521-3749(1998110)624:11<1903::AID-ZAAC1903>3.0.CO;2-G","","","0.7107","MoKα","","0.06","","","0.048","","","","0.061","","","","","","","","has coordinates","209293","2020-10-21","18:00:00",""
"6000393","24.416","","6.691","","6.963","","90","","97.74","","90","","1127.16","","","","","","","","","","","","","3","P 1 2/c 1","","","","","","- Cl9 Pr7 S6 -","","","","","","Lissner, F.; Schleid, T.","Two novel sulfide chlorides of the lanthanides: Synthesis and crystal structure of Pr7S6Cl9 and Nd7S6Cl9","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1998","624","","1903","1908","10.1002/(SICI)1521-3749(1998110)624:11<1903::AID-ZAAC1903>3.0.CO;2-G","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000441","11.642","","5.771","","24.22","","90","","101.16","","90","","1596.47","","","","","","","","","","","","","5","P 1 2/c 1","","","","","","- Bi11 Mo2 O28 Te2 V3 -","","","","","","Castro, A.; Enjalbert, R.; Baules, P.; Galy, J.","Synthesis and structural evolution of the solid solution Bi(Bi12-xTexO14)Mo4-xV1+xO20 (O <= x <= 2.5)","Journal of Solid State Chemistry","1998","139","","185","193","10.1006/jssc.1998.7831","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000724","21.472","","8.027","","15.413","","90","","90.45","","90","","2656.44","","","","","","","","","","","","","5","P 1 2/c 1","","","","","","- Ag2 Ce H2 N5 O16 -","","","","","","Audebrand, N.; Auffredic, J. P.; Louer, D.","Structure of Ag2Ce(H2O)(NO3)(5) and its thermal decomposition studied by temperature-dependent X-ray powder diffraction","Journal of Solid State Chemistry","1997","132","","361","371","10.1006/jssc.1997.7475","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"7000133","18.1581","0.0004","19.5166","0.0004","19.0706","0.0004","90","","104.596","0.0011","90","","6540.2","0.2","150","1","150","1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","(Ru3(CCPhNO2)2)","","","- C59.5 H51 Cl5 N14 O6 Ru3 -","- C59.5 H51 Cl5 N14 O6 Ru3 -","- C238 H204 Cl20 N56 O24 Ru12 -","4","1","","Kuo, Ching-Kuo; Chang, Jung-Che; Yeh, Chen-Yu; Lee, Gene-Hsiang; Wang, Chih-Chieh; Peng, Shie-Ming","Synthesis, structures, magnetism and electrochemical properties of triruthenium-acetylide complexes.","Dalton transactions (Cambridge, England : 2003)","2005","","22","3696","3701","10.1039/b506267e","","","0.71073","MoKα","","0.133","0.0856","","","0.2441","0.288","","","","","","1.004","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7000479","26.41","0.008","10.589","0.003","19.751","0.006","90","","106.462","0.005","90","","5297","3","150","2","150","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C48 H60 F6 Mo2 N2 O11 S2 -","- C48 H60 F6 Mo2 N2 O11 S2 -","- C192 H240 F24 Mo8 N8 O44 S8 -","4","1","","Cross, Warren B.; Anderson, James C.; Wilson, Claire S.","Nucleophilic reactivity of a d0 molybdenum oxo moiety","Dalton Transactions","2009","","7","1201","1205","10.1039/b817745g","","","0.71073","MoKα","","0.0918","0.0463","","","0.106","0.1264","","","","","","0.993","","","","has coordinates","179682","2020-10-21","18:00:00",""
"7000934","25.29","0.005","8.5496","0.0017","30.769","0.011","90","","127.255","0.019","90","","5295","3","193","2","193","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C44 H50 Cl2 Cu2 Mo2 N4 O8 S4 -","- C44 H54 Cl2 Cu2 Mo2 N4 O8 S4 -","- C176 H216 Cl8 Cu8 Mo8 N16 O32 S16 -","4","1","","Ren, Zhi-Gang; Yang, Jun-Yi; Song, Ying-Lin; Li, Ni-Ya; Li, Hong-Xi; Chen, Yang; Zhang, Yong; Lang, Jian-Ping","From trans-[(η5-C5Me5)2Mo2S2(μ-S)2] to [(η5-C5Me5)2Mo2(μ3-S)4(CuMeCN)2]2+ to [(η5-C5Me5)2Mo2(μ3-S)4Cu2]-based polymeric and dimeric clusters: syntheses, structures and enhanced third-order non-linear optical performances","Dalton Transactions","2009","","14","2578","2587","10.1039/b819240e","","","0.71073","MoKα","","0.0716","0.0645","","","0.1719","0.1759","","","","","","1.362","","","","has coordinates,has disorder","179687","2020-10-21","18:00:00",""
"7001075","23.922","0.005","12.909","0.003","24.742","0.005","90","","113.82","0.03","90","","6990","3","100","2","100","2","","","","","","","","10","P 1 2/c 1","-P 2yc","13","","","","- C64.66 H70.31 B3 Cl1.31 F8 Mn Mo N7 O6 P3 -","- C64.655 H70.31 B3 Cl1.31 F8 Mn Mo N7 O6 P3 -","- C258.62 H281.24 B12 Cl5.24 F32 Mn4 Mo4 N28 O24 P12 -","4","1","","Adams, Christopher J.; Connelly, Neil G.; Onganusorn, Sriwipha","The effect of redox-active cyanomanganese(I) ligands on intramolecular electron transfer to, and alkyne alignment in, M(CO)(RCCR)Tp′ (M = Mo or W) units","Dalton Transactions","2009","","16","3062","3073","10.1039/b816420g","","","0.71073","MoKα","","0.2821","0.0904","","","0.1593","0.2044","","","","","","0.765","","","","has coordinates","179688","2020-10-21","18:00:00",""
"7001356","30.096","0.003","4.0444","0.0004","33.472","0.004","90","","91.153","0.001","90","","4073.4","0.8","125","2","125","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C9 H10 Hg O2 S -","- C9 H10 Hg O2 S -","- C144 H160 Hg16 O32 S16 -","16","4","","Sattler, Wesley; Yurkerwich, Kevin; Parkin, Gerard","Molecular structures of protonated and mercurated derivatives of thimerosal","Dalton Transactions","2009","","22","4327","4333","10.1039/b823467a","","","0.71073","MoKα","","0.0578","0.0354","","","0.0598","0.0652","","","","","","1.02","","","","has coordinates","179710","2020-10-21","18:00:00",""
"7001595","14.538","0.003","9.827","0.002","15.987","0.003","90","","101.1","0.03","90","","2241.3","0.8","113","2","113","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C23 H31 I N2 Ru -","- C23 H31 I N2 Ru -","- C92 H124 I4 N8 Ru4 -","4","1","","Zhang, Congying; Zhao, Yang; Li, Bin; Song, Haibin; Xu, Shansheng; Wang, Baiquan","The intramolecular sp2 and sp3 C‒H bond activation of (p-cymene)ruthenium(ii) N-heterocyclic carbene complexes","Dalton Transactions","2009","","26","5182","5189","10.1039/b818091a","","","0.71073","MoKα","","0.0316","0.0263","","","0.0571","0.0586","","","","","","1.031","","","","has coordinates","179713","2020-10-21","18:00:00",""
"7001655","17.998","0.005","5.0153","0.0013","18.163","0.005","90","","109.464","0.005","90","","1545.8","0.7","153","2","153","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C8 H28 N8 Si -","- C8 H28 N8 Si -","- C32 H112 N32 Si4 -","4","1","","Gronde, Ingo; Neumann, Beate; Willner, Alexander; Pape, Tania; Mitzel, Norbert W.","Syntheses and structures of (N′,N′-dimethylhydrazido)silanes","Dalton Transactions","2009","","27","5300","5309","10.1039/b900293f","","","0.71073","MoKα","","0.0833","0.0497","","","0.1137","0.1293","","","","","","0.991","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7001774","15.3929","0.0006","9.173","0.0003","13.8676","0.0005","90","","103.929","0.001","90","","1900.51","0.12","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C15 H15 Cl Mn N5 O8.5 -","- C15 H15 Cl Mn N5 O8.5 -","- C60 H60 Cl4 Mn4 N20 O34 -","4","1","","Tian, Chun-Yan; Sun, Wei-Wei; Jia, Qin-Xiang; Tian, Hua; Gao, En-Qing","A novel manganese(II) coordination polymer with azide and neutral dicarboxylate ligands: helical structure and magnetic properties","Dalton Transactions","2009","","31","6109","","10.1039/b900110g","","","0.71073","MoKα","","0.0572","0.049","","","0.146","0.1563","","","","","","1.039","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7002041","23.2","0.002","8.9069","0.0008","24.425","0.002","90","","107.756","0.002","90","","4806.8","0.7","200","2","200","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","18 in manuscript","","","- C44 H46 B2 Cu2 F8 N14 -","- C44 H46 B2 Cu2 F8 N14 -","- C176 H184 B8 Cu8 F32 N56 -","4","1","","Deißler, Christine; Rominger, Frank; Kunz, Doris","Controlling the coordination modes of a new and highly flexible ligand bearing two N-heterocyclic carbene moieties at a bipyridine backbone","Dalton Transactions","2009","","35","7152","","10.1039/b907041a","","","0.71073","MoKα","","0.1221","0.0895","","","0.1645","0.1777","","","","","","1.198","","","","has coordinates,has disorder","179718","2020-10-21","18:00:00",""
"7002066","20.4781","0.0005","9.916","0.0002","25.6217","0.0007","90","","113.19","0.003","90","","4782.4","0.2","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C40.84 H54.84 Br2 Cl2.53 N4 O4 Pd -","- C40.843 H54.843 Br2 Cl2.529 N4 O4 Pd -","- C163.372 H219.372 Br8 Cl10.116 N16 O16 Pd4 -","4","1","","Baker, Murray V.; Brown, David H.; Simpson, Peter V.; Skelton, Brian W.; White, Allan H.","Palladium complexes of o-xylyl-linked alkoxybenzimidazolin-2-ylidenes: interesting structural conformations and application as pre-catalysts","Dalton Transactions","2009","","35","7294","","10.1039/b908613g","","","0.71073","MoKα","","0.134","0.0689","","","0.2043","0.2248","","","","","","1.12","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7002227","17.067","0.006","12.31","0.004","27.577","0.009","90","","92.55","0.01","90","","5788","3","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C29 H30 Cl3 O4 P Pt -","- C28 H29 O4 P Pt -","- C224 H232 O32 P8 Pt8 -","8","2","","De Pascali, Sandra A.; Papadia, Paride; Capoccia, Serena; Marchiò, Luciano; Lanfranchi, Maurizio; Ciccarese, Antonella; Fanizzi, Francesco P.","Hard/soft selectivity in ligand substitution reactions of β-diketonate platinum(II) complexes","Dalton Transactions","2009","","37","7786","7795","10.1039/b909209a","","","0.71073","MoKα","","0.0875","0.0384","","","0.0526","0.0554","","","","","","1.002","","","","has coordinates","179720","2020-10-21","18:00:00",""
"7002245","28.225","0.008","22.859","0.007","29.728","0.009","90","","98.209","0.004","90","","18984","10","120","2","120","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C49 H73.06 Cl4 N36 O19.53 Pt2 -","- C49 H62 Cl4 N36 O19.534 Pt2 -","- C490 H620 Cl40 N360 O195.34 Pt20 -","10","2.5","","Kennedy, Alan R.; Florence, Alastair J.; McInnes, Fiona J.; Wheate, Nial J.","A chemical preformulation study of a host‒guest complex of cucurbit[7]uril and a multinuclear platinum agent for enhanced anticancer drug delivery","Dalton Transactions","2009","","37","7695","7700","10.1039/b907917c","","","0.6946","synchrotron","","0.085","0.0651","","","0.1863","0.2001","","","","","","1.108","","","","has coordinates","179720","2020-10-21","18:00:00",""
"7002424","10.799","0.002","12.013","0.002","15.743","0.003","90","","97.25","0.03","90","","2026","0.6","295","","295","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C35.6 H34.4 F6 O7.8 P2 S2 -","- C35.6 H32.4 F6 O7.8 P2 S2 -","- C71.2 H64.8 F12 O15.6 P4 S4 -","2","0.5","","Abdalilah, Mohammed; Zurawinski, Remigiuz; Canac, Yves; Laleu, Benoît; Lacour, Jérôme; Lepetit, Christine; Magro, Germinal; Bernardinelli, Gérald; Donnadieu, Bruno; Duhayon, Carine; Mikolajczyk, Marian; Chauvin, Remi","Vicinal diphosphoniums: electrostatic repulsion under covalent constraint","Dalton Transactions","2009","","40","8493","8508","10.1039/b903933c","","","0.71073","MoKα","","0.0979","0.0561","","","0.1394","0.1652","","","","","","0.933","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7002829","18.48","0.004","13.463","0.003","18.374","0.004","90","","110.22","0.004","90","","4289.7","1.6","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C72 H100.36 Ag12 O32.18 -","- C72 H100.36 Ag12 O32.18 -","- C144 H200.72 Ag24 O64.36 -","2","0.5","","Jin, Jun-Cheng; Wang, Yao-Yu; Zhang, Wei-Hong; Lermontov, Anatoly S.; Lermontova, Elmira Kh.; Shi, Qi-Zhen","New types of di-, tetra-, hexa- and octanuclear Ag(i) complexes containing 1,3-adamantanedicarboxylic acid","Dalton Transactions","2009","","46","10181","10191","10.1039/b909309e","","","0.71073","MoKα","","0.1078","0.0474","","","0.1202","0.1359","","","","","","0.853","","","","has coordinates,has disorder","179732","2020-10-21","18:00:00",""
"7003041","11.1838","0.0002","9.8576","0.0002","23.069","0.004","90","","117.643","0.001","90","","2253","0.4","150","","150","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C16 H48 Cu2 I5 O8 S8 Y -","- C16 H48 Cu2 I5 O8 S8 Y -","- C32 H96 Cu4 I10 O16 S16 Y2 -","2","0.5","","Mishra, Shashank; Jeanneau, Erwann; Chermette, Henry; Daniele, Stéphane; Hubert-Pfalzgraf, Liliane G.","Crystal-to-crystal transformations in heterometallic yttrium(iii)‒copper(i) iodide derivatives in a confined solvent-free environment: Influence of solvated yttrium cations on the nuclearity and dimensionality of iodocuprate clusters","Dalton Transactions","2008","","5","620","630","10.1039/b709338a","","","0.71069","MoKα","","0.049","0.0287","","0.0485","0.029","0.029","","","","","","1.0791","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7003067","11.9679","0.0013","6.3012","0.0006","12.4917","0.0014","90","","92.092","0.007","90","","941.4","0.17","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H14 Mn N10 S2 -","- C14 H14 Mn N10 S2 -","- C28 H28 Mn2 N20 S4 -","2","0.5","","Ju, Zhan-Feng; Yao, Qing-Xia; Wu, Wei; Zhang, Jie","Strong electron-accepting methylviologen dication confined in magnetic hosts: synthesis, structural characterization, charge-transfer and magnetic properties of {(MV)2[Ni(SCN)5]·Cl·2H2O}n and {(MV)[M(N3)2(SCN)2]}n (M = Mn, Co)","Dalton Transactions","2008","","3","355","","10.1039/b710628a","","","0.71073","MoKα","","0.0904","0.0658","","","0.1111","0.1229","","","","","","1.081","","","","has coordinates","179734","2020-10-21","18:00:00",""
"7003190","19.523","0.0005","10.1399","0.0002","18.1745","0.0005","90","","90.181","0.003","90","","3597.83","0.15","120","2","120","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C58 H66 F6 N8 Na3 O24 P Zn4 -","- C58 H62 F6 N8 Na3 O24 P Zn4 -","- C116 H124 F12 N16 Na6 O48 P2 Zn8 -","2","0.5","","Jarenmark, Martin; Kappen, Sascha; Haukka, Matti; Nordlander, Ebbe","Symmetrical and unsymmetrical dizinc complexes as models for the active sites of hydrolytic enzymes","Dalton Transactions","2008","","8","993","996","10.1039/b713664a","","","0.71073","MoKα","","0.0745","0.0653","","","0.1736","0.1794","","","","","","1.111","","","","has coordinates","179735","2020-10-21","18:00:00",""
"7003408","19.9887","0.0015","6.9605","0.0008","14.3162","0.0015","90","","110.304","0.013","90","","1868.1","0.4","203","2","203","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C10 H19 As Na2 O4 Se3 -","- C10 H19 As Na2 O4 Se3 -","- C40 H76 As4 Na8 O16 Se12 -","4","1","","Zell, Thomas; Shi, Weifeng; Langer, Robert; Ponikiewski, Lukasz; Rothenberger, Alexander","Reactivity of a heterocyclic As‒Se compound with metal salts: syntheses and structures of the first copper complexes and of new alkali metal salts containing As‒Se anions","Dalton Transactions","2008","","7","932","937","10.1039/b715947a","","","0.71073","MoKα","","0.0762","0.0471","","","0.1091","0.1293","","","","","","1.073","","","","has coordinates","179738","2020-10-21","18:00:00",""
"7003409","15.196","0.004","6.2989","0.0017","15.096","0.004","90","","100.592","0.004","90","","1420.3","0.7","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C31 H25 N3 O4 Zn -","- C31 H25 N3 O4 Zn -","- C62 H50 N6 O8 Zn2 -","2","0.5","","Cheng, Ai-Ling; Ma, Yu; Zhang, Jian-Yong; Gao, En-Qing","Towards tuning the packing and entanglement of zigzag coordination chains by terminal ligands","Dalton Transactions","2008","","15","1993","2004","10.1039/b715949h","","","0.71073","MoKα","","0.1486","0.0559","","","0.0897","0.115","","","","","","0.838","","","","has coordinates,has disorder","179738","2020-10-21","18:00:00",""
"7003477","10.1726","0.0011","11.6397","0.0013","16.2535","0.0018","90","","103.31","0.003","90","","1872.8","0.4","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18 H18 Mn N2 O8 -","- C18 H12 Mn N2 O8.0002 -","- C72 H48 Mn4 N8 O32.0008 -","4","1","","Feller, Russell K.; Cheetham, Anthony K.","Polytypism, homochirality, interpenetration, and hydrogen-bonding in transition metal (Mn(ii), Ni(ii), Cu(ii), Zn(ii)) 5-hydroxyisophthalate coordination polymers containing 4,4′-bipyridyl","Dalton Transactions","2008","","15","2034","2042","10.1039/b716454h","","","0.71073","MoKα","","0.1083","0.0581","","","0.1313","0.1486","","","","","","0.929","","","","has coordinates,has disorder","179738","2020-10-21","18:00:00",""
"7003683","40.592","0.002","16.1043","0.0006","17.9271","0.0006","90","","94.662","0.002","90","","11680.3","0.8","153","2","153","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C123 H142 N15 O15 U2.5 -","- C123 H142 N15 O15 U2.5 -","- C492 H568 N60 O60 U10 -","4","1","","Melfi, Patricia J.; Camiolo, Salvatore; Lee, Jeong Tae; Ali, Mehnaaz F.; McDevitt, John T.; Lynch, Vincent M.; Sessler, Jonathan L.","Immobilization of a hexaphyrin(1.0.1.0.0.0) derivative onto a tentagel-amino resin and its use in uranyl cation detection","Dalton Transactions","2008","","12","1538","1540","10.1039/b718627d","","","0.71073","MoKα","","0.2297","0.1031","","","0.1345","0.1559","","","","","","1.517","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7004289","41.945","0.002","10.4363","0.0004","17.8074","0.0005","90","","102.196","0.003","90","","7619.3","0.5","150","2","150","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C24 H38 Li2 N4 -","- C24 H38 Li2 N4 -","- C288 H456 Li24 N48 -","12","3","","Chase, Preston A.; Lutz, Martin; Spek, Anthony L.; Gossage, Robert A.; van Koten, Gerard","Solid-state and solution structures of hetero-aggregates formed between nBuLi and NCN pincer aryl lithium","Dalton Transactions","2008","","42","5783","5790","10.1039/b805092a","","","0.71073","MoKα","","0.0878","0.0706","","","0.1681","0.1823","","","","","","1.107","","","","has coordinates","179746","2020-10-21","18:00:00",""
"7004296","11.8033","0.0015","10.6761","0.0015","15.586","0.002","90","","102.576","0.006","90","","1916.9","0.4","240","2","240","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C36 H38 N10 Ni O10 -","- C36 H38 N10 Ni O10 -","- C72 H76 N20 Ni2 O20 -","2","0.5","","Santillan, Guillermo A.; Carrano, Carl J.","Nickel(ii), copper(ii), and cobalt(ii) solid-state structures formed through hydrogen bonding with ditopic heteroscorpionate ligands","Dalton Transactions","2008","","30","3995","4005","10.1039/B805253K","","","0.71073","MoKα","","0.0535","0.0432","","","0.1256","0.1355","","","","","","1.057","","","","has coordinates","179746","2020-10-21","18:00:00",""
"7004740","13.43","0.008","7.756","0.005","13.435","0.009","90","","96.653","0.011","90","","1390","1.5","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C14 H5 Au F5 N O2 -","- C14 H5 Au F5 N O2 -","- C56 H20 Au4 F20 N4 O8 -","4","1","","Coco, Silverio; Cordovilla, Carlos; Domínguez, Cristina; Espinet, Pablo","Luminescent gold(i) metallo-acids and their hydrogen bonded supramolecular liquid crystalline derivatives with decyloxystilbazole as hydrogen acceptor","Dalton Transactions","2008","","48","6894","6900","10.1039/b811482j","","","0.71073","MoKα","","0.0409","0.028","","","0.0628","0.0679","","","","","","1.007","","","","has coordinates","179751","2020-10-21","18:00:00",""
"7004904","14.049","0.005","9.693","0.005","26.772","0.008","90","","91.352","0.005","90","","3645","3","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C74 H122 N4 O4 Yb2 -","- C74 H122 N4 O4 Yb2 -","- C148 H244 N8 O8 Yb4 -","2","0.5","","Delbridge, Ewan E.; Dugah, Divine T.; Nelson, Chassidy R.; Skelton, Brian W.; White, Allan H.","Synthesis, structure and oxidation of new ytterbium(II) bis(phenolate) compounds and their catalytic activity towards epsilon-caprolactone.","Dalton transactions (Cambridge, England : 2003)","2007","","1","143","153","10.1039/b613409b","","","0.71073","MoKα","","0.088","0.063","","0.167","","0.129","","","1.217","","","1.217","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7004970","11.789","0.004","11.507","0.004","14.342","0.005","90","","96.995","0.005","90","","1931.1","1.2","298","2","298","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C23 H38 B20 Co2 Mo O2 S4 -","- C24 H30 B20 Co2 Mo O2 S4 -","- C48 H60 B40 Co4 Mo2 O4 S8 -","2","0.5","","Chen, Yin-Qiang; Zhang, Jiasheng; Cai, Shuyi; Hou, Xiu-Feng; Schumann, Herbert; Jin, Guo-Xin","Syntheses and structures of heterometallic clusters by the reaction of o-carboranyl cobaltadichalcogenolato complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","7","749","758","10.1039/b614123d","","","0.71073","MoKα","","0.0886","0.0394","","","0.0788","0.0878","","","","","","0.786","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7005001","13.5397","0.0002","10.3523","0.0002","28.4128","0.0005","90","","91.776","0.0009","90","","3980.62","0.12","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C80 H62 Cl2 Co7 N32 O -","- C80 H62 Cl2 Co7 N32 O -","- C160 H124 Cl4 Co14 N64 O2 -","2","0.5","","Wang, Wen-Zhen; Ismayilov, Rayyat Huseyn; Lee, Gene-Hsiang; Liu, Isiah Po-Chun; Yeh, Chen-Yu; Peng, Shie-Ming","The nano-scale molecule with the longest delocalized metal-metal bonds: linear heptacobalt(II) metal string complexes [Co7(micro7-L)4X2].","Dalton transactions (Cambridge, England : 2003)","2007","","8","830","839","10.1039/b614661a","","","0.71073","MoKα","","0.1417","0.0787","","","0.2672","0.3174","","","","","","1.095","","","","has coordinates,has disorder","179754","2020-10-21","18:00:00",""
"7005311","19.2247","0.0003","10.3082","0.0002","21.5836","0.0004","90","","108.044","0.0013","90","","4066.91","0.13","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C35.25 H32 Cl2.5 N20 Ni3 O0.75 -","- C35.25 H32 Cl2.5 N20 Ni3 O0.75 -","- C141 H128 Cl10 N80 Ni12 O3 -","4","1","","Ismayilov, Rayyat Huseyn; Wang, Wen-Zhen; Lee, Gene-Hsiang; Wang, Rui-Ren; Liu, Isiah Po-Chun; Yeh, Chen-Yu; Peng, Shie-Ming","New versatile ligand family, pyrazine-modulated oligo-alpha-pyridylamino ligands, from coordination polymer to extended metal atom chains.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2898","2907","10.1039/b700533d","","","0.71073","MoKα","","0.1128","0.0489","","","0.1082","0.1335","","","","","","0.977","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005372","21.018","0.005","7.6267","0.0016","16.295","0.004","90","","104.475","0.005","90","","2529.1","1","153","2","153","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C18 H33 Cl Mn0.5 N6 Ni O4.5 S2 -","- C18 H33 Cl Mn0.5 N6 Ni O4.5 S2 -","- C72 H132 Cl4 Mn2 N24 Ni4 O18 S8 -","4","1","","Bieńko, Alina; Kłak, Julia; Mroziński, Jerzy; Boca, Roman; Brüdgam, Irene; Hartl, Hans","Trinuclear thiocyanate-bridged compounds of the type [ML]2[Mn(NCS)4](ClO4)2 (where M = Cu(II), Ni(II); L = N-dl-5,7,7,12,14,14-hexamethyl-1,4,8,11-tetraazacyclotetradeca-4,11-diene).","Dalton transactions (Cambridge, England : 2003)","2007","","25","2681","2688","10.1039/b701465a","","","0.71073","MoKα","","0.0903","0.0486","","","0.1141","0.1329","","","","","","1.035","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005462","11.206","0.005","7.084","0.003","16.026","0.007","90","","98.857","0.008","90","","1257","0.9","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C9 H5 Cl Mn N O8 -","- C9 H5 Cl Mn N O8 -","- C36 H20 Cl4 Mn4 N4 O32 -","4","1","","Alvarez, Celedonio M.; García-Rodríguez, Raúl; Miguel, Daniel","Pyridine-2-carboxaldehyde as ligand: synthesis and derivatization of carbonyl complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3546","3554","10.1039/b702418e","","","0.71073","MoKα","","0.0309","0.0283","","","0.0731","0.0749","","","","","","1.054","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005584","25.8436","0.001","10.8312","0.0005","20.3081","0.001","90","","109.556","0.005","90","","5356.7","0.4","150","2","150","2","","","","","","","synthesis","10","P 1 2/c 1","-P 2yc","13","","","","- C101 H90 Ag2 Cl2 F12 N4 O8 P8 S4 Sb2 -","- C101 H90 Ag2 Cl2 F12 N4 O8 P8 S4 Sb2 -","- C202 H180 Ag4 Cl4 F24 N8 O16 P16 S8 Sb4 -","2","0.5","","Cadierno, Victorio; Díez, Josefina; García-Alvarez, Joaquín; Gimeno, José","Silver(I) complexes of N-thiophosphorylated bis(iminophosphorane) ligands: from monomers to polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2760","2769","10.1039/b703348f","","","1.5418","CuKα","","0.0497","0.0458","","","0.1206","0.1268","","","","","","1.045","","","","has coordinates,has disorder","179759","2020-10-21","18:00:00",""
"7005633","10.691","0.002","13.868","0.003","28.711","0.006","90","","97.64","0.03","90","","4219","1.5","180","2","180","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C40 H30 B2 F8 Fe N14 -","- C40 H30 B2 F8 Fe N14 -","- C160 H120 B8 F32 Fe4 N56 -","4","1","","Rajadurai, Chandrasekar; Qu, Zhirong; Fuhr, Olaf; Gopalan, Balaji; Kruk, Robert; Ghafari, Mohammed; Ruben, Mario","Lattice-solvent controlled spin transitions in iron(II) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3531","3537","10.1039/b703700g","","","0.71073","MoKα","","0.0679","0.0564","","","0.1528","0.1607","","","","","","1.013","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005635","10.808","0.002","13.925","0.003","28.685","0.006","90","","97.77","0.03","90","","4277.5","1.5","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C40 H30 Cl2 Fe N14 O8 -","- C40 H30 Cl2 Fe N14 O8 -","- C160 H120 Cl8 Fe4 N56 O32 -","4","1","","Rajadurai, Chandrasekar; Qu, Zhirong; Fuhr, Olaf; Gopalan, Balaji; Kruk, Robert; Ghafari, Mohammed; Ruben, Mario","Lattice-solvent controlled spin transitions in iron(II) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3531","3537","10.1039/b703700g","","","0.71073","MoKα","","0.0508","0.0375","","","0.0892","0.094","","","","","","1.026","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005650","12.0861","0.0008","14.6555","0.0008","21.5673","0.0015","90","","104.025","0.008","90","","3706.3","0.4","213","2","213","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","Copper(ii) Tetrafluoroborate 1:2 Complex with 4,4'- Bipyridazine, Solvate with 3.33 Water","Copper(II) Tetrafluoroborate 1:2 Complex with 4,4'-Bipyridazine, Solvate with 3.33 Water","","- C48 H46 B6 Cu3 F24 N24 O10 -","- C48 H36 B6 Cu3 F24 N24 O10 -","- C96 H72 B12 Cu6 F48 N48 O20 -","2","0.5","","Konstantin V. Domasevitch; Il'ya A. Gural'skiy; Pavlo V. Solntsev; Eduard B. Rusanov; Harald Krautscheid; Judith A. K. Howard; Alexander N. Chernega","4,4'-Bipyridazine: a new twist for the synthesis of coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3140","3148","10.1039/b703911e","","","0.71073","MoKα","","0.0811","0.0594","","","0.1574","0.1657","","","","","","0.943","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7005697","17.229","0.0002","19.548","0.0002","20.444","0.0002","90","","95.453","0.0006","90","","6854.23","0.13","173","2","173","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C63 H88 Cl2 N2 O4 Si4 Sn2 -","- C63 H88 Cl2 N2 O4 Si4 Sn2 -","- C252 H352 Cl8 N8 O16 Si16 Sn8 -","4","1","","Dickie, Diane A.; Lee, Peter T. K.; Labeodan, Ojisamola A.; Schatte, Gabriele; Weinberg, Noham; Lewis, Andrew R.; Bernard, Guy M.; Wasylishen, Roderick E.; Clyburne, Jason A. C.","Flexible coordination of the carboxylate ligand in tin(II) amides and a 1,3-diaza-2,4-distannacyclobutanediyl.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2862","2869","10.1039/b704588c","","","0.71073","MoKα","","0.0704","0.0368","","","0.0716","0.083","","","","","","1.019","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005891","21.8742","0.0006","10.9039","0.0003","20.839","0.0005","90","","97.598","0.002","90","","4926.8","0.2","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C52 H74 N4 Sn -","- C52 H74 N4 Sn -","- C208 H296 N16 Sn4 -","4","1","","Nimitsiriwat, Nonsee; Gibson, Vernon C.; Marshall, Edward L.; White, Andrew J. P.; Dale, Sophie H.; Elsegood, Mark R. J.","Tert-butylamidinate tin(ii) complexes: high activity, single-site initiators for the controlled production of polylactide.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4464","4471","10.1039/b706663e","","","0.71073","MoKα","","0.0801","0.0758","","","0.1729","0.1758","","","","","","1.236","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7006174","39.775","0.004","8.8662","0.0013","25.857","0.003","90","","106.393","0.007","90","","8747.9","1.9","173","","173","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C92 H84 Cl4 N12 O16 Ru2 -","- C92 H82 Cl4 N12 O16 Ru2 -","- C368 H328 Cl16 N48 O64 Ru8 -","4","1","","Constable, Edwin C.; Dunphy, Emma L.; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Schaper, Frank; Batten, Stuart R.","Expanded ligands: bis(2,2':6',2''-terpyridine carboxylic acid)ruthenium(ii) complexes as metallosupramolecular analogues of dicarboxylic acids.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4323","4332","10.1039/b709557k","","","0.71073","MoKα","","0.0784","0.0367","","0.0576","0.0388","0.0388","","","","","","1.0756","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006264","15.824","0.0002","11.375","0.0001","20.093","0.0002","90","","97.458","0.0008","90","","3586.1","0.07","120","2","120","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C31 H55 F3 O5 P2 Pt S -","- C31 H55 F3 O5 P2 Pt S -","- C124 H220 F12 O20 P8 Pt4 S4 -","4","1","","Vuzman, Dana; Poverenov, Elena; Diskin-Posner, Yael; Leitus, Gregory; Shimon, Linda J. W.; Milstein, David","Reactivity and stability of platinum(II) formyl complexes based on PCP-type ligands. The significance of sterics.","Dalton transactions (Cambridge, England : 2003)","2007","","48","5692","5700","10.1039/b711444c","","","0.71073","MoKα","","0.0388","0.0271","","","0.0641","0.0678","","","","","","1.036","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006284","14.25","0.009","18.493","0.012","21.397","0.014","90","","99.3","0.02","90","","5565","6","153","2","153","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C40 H66.5 Cu4 N8 O27.5 P2.5 -","- C40 H32 Cu4 N8 O27.5 P2.5 -","- C160 H128 Cu16 N32 O110 P10 -","4","1","","Doyle, Robert P.; Bauer, Thomas; Julve, Miguel; Lloret, Francesc; Cano, Joan; Nieuwenhuyzen, Mark; Kruger, Paul E.","Metamorphosis of a butterfly: synthesis, structural, thermal, magnetic and DFT characterisation of a ferromagnetically coupled tetranuclear copper(II) complex.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5140","5147","10.1039/b711655a","","","0.71073","MoKα","","0.1743","0.0851","","","0.2132","0.2517","","","","","","0.979","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7006406","15.9084","0.0003","13.6094","0.0003","15.1155","0.0002","90","","104.347","0.0008","90","","3170.5","0.1","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Bis[2,6-di(pyrazol-1-yl)pyridine]iron(II) hemiiodide sesqui(triiodide)","","- C22 H18 Fe I5 N10 -","- C22 H18 Fe I5 N10 -","- C88 H72 Fe4 I20 N40 -","4","1","","Elhaïk, Jérôme; Kilner, Colin A.; Halcrow, Malcolm A.","Structural diversity in iron(II) complexes of 2,6-di(pyrazol-1-yl)pyridine and 2,6-di(3-methylpyrazol-1-yl)pyridine.","Dalton transactions (Cambridge, England : 2003)","2006","","6","823","830","10.1039/b510370c","","","0.71073","MoKα","","0.0709","0.0489","","","0.1186","0.1327","","","","","","1.068","","","","has coordinates,has disorder","179768","2020-10-21","18:00:00",""
"7006430","10.54073","0.00022","7.89512","0.00016","10.32709","0.00022","90","","109.819","0.0013","90","","808.52","0.03","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C6 Al3 O15 P2 -","- C6 Al3 O15 P2 -","- C12 Al6 O30 P4 -","2","0.5","","Gómez-Alcantara, M Mar; Aranda, Miguel A. G.; Olivera-Pastor, Pascual; Beran, Premysl; García-Muñoz, José L; Cabeza, Aurelio","Layered and pillared metal carboxyethylphosphonate hybrid compounds.","Dalton transactions (Cambridge, England : 2003)","2006","","4","577","585","10.1039/b510482c","powder diffraction","x-ray","0.429697","","","","","","","","","0.07413","","0.96","","","","","","","has coordinates","179768","2020-10-21","18:00:00",""
"7006483","8.872","0.009","11.883","0.013","15.842","0.017","90","","99.743","0.01","90","","1646","3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H29 Eu N12 O9 -","- C26 H29 Eu N12 O9 -","- C52 H58 Eu2 N24 O18 -","2","0.5","","Foreman, Mark R. S.; Hudson, Michael J.; Drew, Michael G. B.; Hill, Clément; Madic, Charles","Complexes formed between the quadridentate, heterocyclic molecules 6,6'-bis-(5,6-dialkyl-1,2,4-triazin-3-yl)-2,2'-bipyridine (BTBP) and lanthanides(III): implications for the partitioning of actinides(III) and lanthanides(III).","Dalton transactions (Cambridge, England : 2003)","2006","","13","1645","1653","10.1039/b511321k","","","0.71073","MoKα","","0.098","0.093","","0.2245","0.2178","","","","1.1","1.102","1.102","","","","","has coordinates","179768","2020-10-21","18:00:00",""
"7006486","8.853","0.009","12.008","0.014","15.904","0.017","90","","99.885","0.01","90","","1666","3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H28 La N11 O10 -","- C24 H26 La N11 O10 -","- C48 H52 La2 N22 O20 -","2","0.5","","Foreman, Mark R. S.; Hudson, Michael J.; Drew, Michael G. B.; Hill, Clément; Madic, Charles","Complexes formed between the quadridentate, heterocyclic molecules 6,6'-bis-(5,6-dialkyl-1,2,4-triazin-3-yl)-2,2'-bipyridine (BTBP) and lanthanides(III): implications for the partitioning of actinides(III) and lanthanides(III).","Dalton transactions (Cambridge, England : 2003)","2006","","13","1645","1653","10.1039/b511321k","","","0.71073","MoKα","","0.1462","0.1063","","0.2517","0.2186","","","","1.204","1.266","1.266","","","","","has coordinates","179768","2020-10-21","18:00:00",""
"7006487","8.859","0.009","11.992","0.013","15.897","0.017","90","","99.834","0.01","90","","1664","3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H28 Ce N11 O10 -","- C24 H26 Ce N11 O10 -","- C48 H52 Ce2 N22 O20 -","2","0.5","","Foreman, Mark R. S.; Hudson, Michael J.; Drew, Michael G. B.; Hill, Clément; Madic, Charles","Complexes formed between the quadridentate, heterocyclic molecules 6,6'-bis-(5,6-dialkyl-1,2,4-triazin-3-yl)-2,2'-bipyridine (BTBP) and lanthanides(III): implications for the partitioning of actinides(III) and lanthanides(III).","Dalton transactions (Cambridge, England : 2003)","2006","","13","1645","1653","10.1039/b511321k","","","0.71073","MoKα","","0.1447","0.1202","","0.3225","0.3036","","","","1.086","1.138","1.138","","","","","has coordinates","179768","2020-10-21","18:00:00",""
"7006488","8.809","0.009","11.928","0.013","15.846","0.018","90","","99.983","0.01","90","","1640","3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H29 N11 O10.5 Pr -","- C24 H26 N11 O10.5 Pr -","- C48 H52 N22 O21 Pr2 -","2","0.5","","Foreman, Mark R. S.; Hudson, Michael J.; Drew, Michael G. B.; Hill, Clément; Madic, Charles","Complexes formed between the quadridentate, heterocyclic molecules 6,6'-bis-(5,6-dialkyl-1,2,4-triazin-3-yl)-2,2'-bipyridine (BTBP) and lanthanides(III): implications for the partitioning of actinides(III) and lanthanides(III).","Dalton transactions (Cambridge, England : 2003)","2006","","13","1645","1653","10.1039/b511321k","","","0.71073","MoKα","","0.0381","0.0363","","0.0938","0.0928","","","","1.182","1.193","1.193","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006489","8.826","0.009","11.906","0.012","15.829","0.017","90","","99.983","0.01","90","","1638","3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H28 N11 Nd O10 -","- C24 H26 N11 Nd O10 -","- C48 H52 N22 Nd2 O20 -","2","0.5","","Foreman, Mark R. S.; Hudson, Michael J.; Drew, Michael G. B.; Hill, Clément; Madic, Charles","Complexes formed between the quadridentate, heterocyclic molecules 6,6'-bis-(5,6-dialkyl-1,2,4-triazin-3-yl)-2,2'-bipyridine (BTBP) and lanthanides(III): implications for the partitioning of actinides(III) and lanthanides(III).","Dalton transactions (Cambridge, England : 2003)","2006","","13","1645","1653","10.1039/b511321k","","","0.71073","MoKα","","0.0381","0.0357","","0.0969","0.0956","","","","1.148","1.163","1.163","","","","","has coordinates","179768","2020-10-21","18:00:00",""
"7006490","8.82","0.009","11.867","0.012","15.813","0.017","90","","99.985","0.01","90","","1630","3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H28 N11 O10 Sm -","- C24 H26 N11 O10 Sm -","- C48 H52 N22 O20 Sm2 -","2","0.5","","Foreman, Mark R. S.; Hudson, Michael J.; Drew, Michael G. B.; Hill, Clément; Madic, Charles","Complexes formed between the quadridentate, heterocyclic molecules 6,6'-bis-(5,6-dialkyl-1,2,4-triazin-3-yl)-2,2'-bipyridine (BTBP) and lanthanides(III): implications for the partitioning of actinides(III) and lanthanides(III).","Dalton transactions (Cambridge, England : 2003)","2006","","13","1645","1653","10.1039/b511321k","","","0.71073","MoKα","","0.0353","0.0326","","0.108","0.0963","","","","1.478","1.501","1.501","","","","","has coordinates","179768","2020-10-21","18:00:00",""
"7006830","17.962","0.003","8.9123","0.001","26.282","0.006","90","","129.608","0.013","90","","3241.4","1.2","193","2","193","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C33 H33 N6 O2 Pd Rh -","- C33 H33 N6 O2 Pd Rh -","- C132 H132 N24 O8 Pd4 Rh4 -","4","1","","Adams, Christopher J.; Baber, R. Angharad; Connelly, Neil G.; Harding, Phimphaka; Hayward, Owen D.; Kandiah, Mathivathani; Orpen, A. Guy","Triazenide-bridged rhodium-palladium complexes: [I2Rh(mu-p-MeC6H4NNNC6H4Me-p)2Pd(eta(3)-C3H5)]-, a stable paramagnetic [RhPd]4+ species with a localised Rh(II) centre.","Dalton transactions (Cambridge, England : 2003)","2006","","14","1749","1757","10.1039/b514513a","","","0.71073","MoKα","","0.035","0.0321","","","0.085","0.0872","","","","","","1.08","","","","has coordinates","179772","2020-10-21","18:00:00",""
"7007049","11.588","0.001","13.554","0.001","26.571","0.003","90","","101.58","0.01","90","","4088.4","0.7","120","2","120","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C28 H24 B2 F6 O4 -","- C28 H24 B2 F6 O4 -","- C168 H144 B12 F36 O24 -","6","1.5","","Adams, Christopher J.; Baber, R. Angharad; Batsanov, Andrei S.; Bramham, George; Charmant, Jonathan P. H.; Haddow, Mairi F.; Howard, Judith A. K.; Lam, Wai Han; Lin, Zhenyang; Marder, Todd B.; Norman, Nicholas C.; Orpen, A. Guy","Synthesis and reactivity of cobalt boryl complexes.","Dalton transactions (Cambridge, England : 2003)","2006","","11","1370","1373","10.1039/b516594f","","","0.71073","MoKα","","0.1129","0.0874","","","0.1979","0.209","","","","","","1.106","","","","has coordinates,has disorder","179774","2020-10-21","18:00:00",""
"7007052","14.651","0.003","8.674","0.003","20.993","0.004","90","","90.27","0.02","90","","2667.8","1.2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C21 H23.5 Cl4 Fe2 N4.5 O1.5 -","- C21 H23.5 Cl4 Fe2 N4.5 O1.5 -","- C84 H94 Cl16 Fe8 N18 O6 -","4","1","","Li, Fei; Wang, Mei; Ma, Chengbing; Gao, Aiping; Chen, Hongbo; Sun, Licheng","Mono- and binuclear complexes of iron(II) and iron(III) with an N4O ligand: synthesis, structures and catalytic properties in alkane oxidation.","Dalton transactions (Cambridge, England : 2003)","2006","","20","2427","2434","10.1039/b516697g","","","0.71073","MoKα","","0.0656","0.0406","","","0.0981","0.1143","","","","","","1.002","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7007113","20.1575","0.0019","14.8847","0.0008","16.1968","0.0012","90","","113.234","0.006","90","","4465.5","0.6","173","2","120","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C17 H20 F24 N5 O16 S8 Tm -","- C17.004 H20 F24.012 N5 O16.008 S8.004 Tm -","- C68.016 H80 F96.048 N20 O64.032 S32.016 Tm4 -","4","1","","Babai, Arash; Mudring, Anja-Verena","The first homoleptic bis(trifluoromethanesulfonyl)amide complex compounds of trivalent f-elements.","Dalton transactions (Cambridge, England : 2003)","2006","","15","1828","1830","10.1039/b517694h","","","0.71073","MoKα","","0.1212","0.0938","","","0.252","0.2796","","","","","","1.066","","","","has coordinates","179775","2020-10-21","18:00:00",""
"7007114","20.1333","0.0015","14.8617","0.0009","16.2065","0.0011","90","","113.182","0.005","90","","4457.7","0.5","120","2","120","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C17 H20 F24 Lu N5 O16 S8 -","- C16.998 F23.994 Lu N5 O15.996 S7.998 -","- C67.992 F95.976 Lu4 N20 O63.984 S31.992 -","4","1","","Babai, Arash; Mudring, Anja-Verena","The first homoleptic bis(trifluoromethanesulfonyl)amide complex compounds of trivalent f-elements.","Dalton transactions (Cambridge, England : 2003)","2006","","15","1828","1830","10.1039/b517694h","","","0.71073","MoKα","","0.0881","0.077","","","0.2134","0.224","","","","","","1.082","","","","has coordinates","179775","2020-10-21","18:00:00",""
"7008423","14.032","0.003","11.238","0.002","12.259","0.003","90","","93.85","0.03","90","","1928.8","0.7","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C38 H40 N4 Ni2 O20 -","- C38 H40 N4 Ni2 O20 -","- C76 H80 N8 Ni4 O40 -","2","0.5","","Qin, Chao; Wang, Xin-Long; Li, Yang-Guang; Wang, En-Bo; Su, Zhong-Min; Xu, Lin; Clérac, Rodolphe","Three-dimensional mesomeric networks assembled from helix-linked sheets: syntheses, structures, and magnetisms.","Dalton transactions (Cambridge, England : 2003)","2005","","15","2609","2614","10.1039/b502651b","","","0.71073","MoKα","","0.0587","0.0374","","","0.0804","0.086","","","","","","1.002","","","","has coordinates","179788","2020-10-21","18:00:00",""
"7008752","19.8259","0.0004","7.6318","0.0002","16.3772","0.0006","90","","108.045","0.0017","90","","2356.11","0.12","150","2","150","2","","","","","","","synthesized by the authors","6","P 1 2/c 1","-P 2yc","13","(1,4,8,11-tetraazacyclotetradecane-1-yl)methylphosphonic acid tribromide tetrahydrate","","","- C11 H38 Br3 N4 O7 P -","- C11 H28 Br3 N4 O7 P -","- C44 H112 Br12 N16 O28 P4 -","4","1","","Füzerová, Silvia; Kotek, Jan; Císarová, Ivana; Hermann, Petr; Binnemans, Koen; Lukes, Ivan","Cyclam (1,4,8,11-tetraazacyclotetradecane) with one methylphosphonate pendant arm: a new ligand for selective copper(ii) binding.","Dalton transactions (Cambridge, England : 2003)","2005","","17","2908","2915","10.1039/b507062g","","","0.71073","MoKα","","0.0863","0.0659","","","0.1932","0.2085","","","","","","1.056","","","","has coordinates,has disorder","179791","2020-10-21","18:00:00",""
"7008762","21.5883","0.0004","15.8577","0.0003","22.7514","0.0005","90","","100.547","0.001","90","","7657.1","0.3","273","2","273","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C55 H75 Cu3 N11 O55 P W11 -","- C47.5 H38 Cu3 N9.5 O43 P W11 -","- C190 H152 Cu12 N38 O172 P4 W44 -","4","1","","Lisnard, Laurent; Dolbecq, Anne; Mialane, Pierre; Marrot, Jérôme; Codjovi, Epiphane; Sécheresse, Francis","Molecular and multidimensional polyoxotungstates functionalized by {Cu(bpy)}2+ groups.","Dalton transactions (Cambridge, England : 2003)","2005","","24","3913","3920","10.1039/b507124k","","","0.71073","MoKα","","0.1189","0.0757","","","0.1619","0.1895","","","","","","1.089","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7009761","18.9754","0.0004","12.8666","0.0003","19.7197","0.0004","90","","118.571","0.001","90","","4228.25","0.16","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C37.75 H65 N4 Ni O11.75 S -","- C34 H50 N4 Ni O8 S -","- C136 H200 N16 Ni4 O32 S4 -","4","1","","Miller, Hamish A.; Laing, Norman; Parsons, Simon; Parkin, Andrew; Tasker, Peter A.; White, David J.","Supramolecular assemblies from ditopic ligands and transition metal salts †","Journal of the Chemical Society, Dalton Transactions","2000","","21","3773","","10.1039/b003436n","","","0.71073","MoKα","","0.0736","0.0502","","","0.1358","0.1457","","","","","","1.084","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7009994","17.165","0.005","18.243","0.007","26.613","0.008","90","","96.63","0.04","90","","8278","5","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C119 H76 Cl26 Co13 N20 O30 -","- C119 H76 Cl26 Co13 N20 O30 -","- C238 H152 Cl52 Co26 N40 O60 -","2","0.5","","Brechin, Euan K.; Graham, Alasdair; Parkin, Andrew; Parsons, Simon; Seddon, Annela M.; Winpenny, Richard E. P.","Structural studies of heptanuclear cobalt complexes and larger oligomers based on heptanuclear fragments","Journal of the Chemical Society, Dalton Transactions","2000","","19","3242","","10.1039/b005019i","","","0.71073","MoKα","","0.1881","0.0926","","0.2744","0.2013","","","","1.021","1.12","1.12","","","","","has coordinates,has disorder","179803","2020-10-21","18:00:00",""
"7010179","14.8356","0.0004","11.8116","0.0003","19.4734","0.0004","90","","101.587","0.001","90","","3342.83","0.14","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C53 H43 O20 Os6 Sb2 -","- C53 H43 O20 Os6 Sb2 -","- C106 H86 O40 Os12 Sb4 -","2","0.5","","Leong, Weng Kee; Chen, Guizhu","The reaction of [Os3(μ-H)(CO)10(μ-CO)]− with Ph2SbCl: a cluster with a six-membered Os4Sb2 ring and another with fluxional metal‒metal bonds †","Journal of the Chemical Society, Dalton Transactions","2000","","23","4442","","10.1039/b006669i","","","0.71073","MoKα","","0.0506","0.0323","","0.0808","0.0704","","","","1.189","1.164","1.164","","","","","has coordinates,has disorder","179805","2020-10-21","18:00:00",""
"7010279","5.859","0.001","6.44","0.002","14.316","0.005","90","","94.52","0.01","90","","538.5","0.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C5 H10 Ag2 N4 S2 -","- C5 H10 Ag2 N4 S2 -","- C10 H20 Ag4 N8 S4 -","2","0.5","","Ren, Chun-Xia; Zhu, Hai-Liang; Yang, Guang; Chen, Xiao-Ming","Syntheses and crystal structures of five two-dimensional networks constructed from staircase-like silver(I) thiocyanate chains and bridging polyamines","Journal of the Chemical Society, Dalton Transactions","2001","","1","85","","10.1039/b007665l","","","0.71073","MoKα","","0.0615","0.0503","","","0.1364","0.1463","","","","","","1.022","","","","has coordinates","179806","2020-10-21","18:00:00",""
"7010318","28.749","0.002","8.5745","0.0007","40.222","0.003","90","","131.477","0.002","90","","7428.6","1","150","2","150","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C114 H156 O62 Rh8 -","- C114 H142 O62 Rh8 -","- C228 H284 O124 Rh16 -","2","0.5","","Bickley, Jamie F.; Bonar-Law, Richard P.; Femoni, Cristina; MacLean, Elizabeth J.; Steiner, Alexander; Teat, Simon J.","Dirhodium(II) carboxylate complexes as building blocks. Synthesis and structures of square boxes with tilted walls †","Journal of the Chemical Society, Dalton Transactions","2000","","22","4025","","10.1039/b008060h","","","0.6885","","","0.1841","0.1514","","","0.2936","0.304","","","","","","1.349","","","","has coordinates","179807","2020-10-21","18:00:00",""
"7010475","19.458","0.001","22.577","0.001","45.763","0.002","90","","96.352","0.001","90","","19980.4","1.6","243","2","243","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C278.1 H260.2 Cl8.2 N48 O50 Rh12 -","- C278.1 Cl8.2 N48 O50 Rh12 -","- C556.2 Cl16.4 N96 O100 Rh24 -","2","0.5","","Cotton, F. Albert; Lin, Chun; Murillo, Carlos A.","The first dirhodium-based supramolecular assemblies with interlocking lattices and double helices","Journal of the Chemical Society, Dalton Transactions","2001","","5","499","","10.1039/b009612l","","","0.71073","MoKα","","0.1403","0.0858","","","0.2441","0.2941","","","","","","1.047","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7010757","17.1122","0.0019","9.9572","0.0009","17.7322","0.0018","90","","101.522","0.012","90","","2960.5","0.5","160","2","160","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C21 H18 O11 Ru4 S Si2 -","- C21 H18 O11 Ru4 S Si2 -","- C84 H72 O44 Ru16 S4 Si8 -","4","1","","Alcalde, M. I.; Carty, A. J.; Chi, Y.; Delgado, E.; Donnadieu, B.; Hernández, E.; Dallmann, K.; Sánchez-Nieves, J.","Syntheses of new ruthenium clusters containing sulfur, ynyl and diynyl ligands. Crystal structures of [Ru3(CO)9(µ-η2-SCCSiMe3)(µ3-η2-CCSiMe3)], [Ru4(CO)12(µ4-S)(µ-η2-CCSiMe3)2] and [Ru4(CO)9(µ-CO)2(µ4-S)(µ4-η2-C(SiMe3)C(CCSiMe3)]","Journal of the Chemical Society, Dalton Transactions","2001","","17","2502","","10.1039/b103202j","","","0.71073","MoKα","","0.0246","0.0198","","","0.0472","0.0502","","","","","","1.015","","","","has coordinates","179811","2020-10-21","18:00:00",""
"7011259","7.08","0.0014","8.828","0.002","10.299","0.002","90","","106.24","0.03","90","","618","0.2","110","2","110","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C6 H8 Fe K N3 O10 -","- C6 H8 Fe K N3 O10 -","- C12 H16 Fe2 K2 N6 O20 -","2","0.5","","Galán-Mascarós, José-Ramón; Clemente-Juan, Juan-Modesto; Dunbar, Kim R.","Synthesis, structure and magnetic properties of the one-dimensional chain compound {K[Fe(1,3,5-triazine-2,4,6-tricarboxylate)(H2O)2]·2H2O}\ιnfty","Journal of the Chemical Society, Dalton Transactions","2002","","13","2710","","10.1039/b109585b","","","0.71069","MoKα","","0.0476","0.0383","","","0.0969","0.1038","","","","","","1.053","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7011334","6.9868","0.0002","7.1366","0.0002","11.9209","0.0004","90","","90.955","0.002","90","","594.32","0.03","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- B6 Ba3 H6 O15 -","- B6 Ba3 H6 O15 -","- B12 Ba6 H12 O30 -","2","0.5","","Yu, Zhen-Tao; Shi, Zhan; Chen, Wei; Jiang, Yu-Sheng; Yuan, Hong-Ming; Chen, Jie-Sheng","Synthesis and X-ray crystal structures of two new alkaline-earth metal borates: SrBO2(OH) and Ba3B6O9(OH)6","Journal of the Chemical Society, Dalton Transactions","2002","","9","2031","","10.1039/b110468c","","","0.71073","MoKα","","0.0245","0.0207","","","0.0515","0.0525","","","","","","1.108","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7012051","13.181","0.003","6.5","0.0013","14.432","0.003","90","","97.63","0.03","90","","1225.5","0.5","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C14 H13 N3 O2 -","- C14 H13 N3 O2 -","- C56 H52 N12 O8 -","4","1","","Dinda, Rupam; Sengupta, Parbati; Ghosh, Saktiprosad; Mayer-Figge, Heike; Sheldrick, William S.","A family of mononuclear molybdenum-(vi), and -(iv) oxo complexes with a tridentate (ONO) ligand","Journal of the Chemical Society, Dalton Transactions","2002","","23","4434","","10.1039/b207129k","","","0.71073","MoKα","","0.1335","0.0617","","","0.1136","0.1396","","","","","","1.059","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7012095","12.7957","0.0013","17.2978","0.0009","25.1666","0.0014","90","","94.434","0.008","90","","5553.6","0.7","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C108 H108 Cl10 Mn5 N20 -","- C108 H108 Cl10 Mn5 N20 -","- C216 H216 Cl20 Mn10 N40 -","2","0.5","","Gibson, Vernon C.; McTavish, Stuart; Redshaw, Carl; Solan, Gregory A.; White, Andrew J. P.; Williams, David J.","From monomeric to polymeric manganese complexes bearing bis(imino)pyridine and related ligands","Dalton Transactions","2003","","2","221","","10.1039/b207384f","","","1.54178","CuKα","","0.0897","0.0515","","0.126","0.1081","","","","1.029","1.1","1.1","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7012313","8.887","0.001","7.17","0.002","21.945","0.003","90","","90.22","0.01","90","","1398.3","0.5","296","2","296","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","1-(2-picolyl)-orthocarborane","","- C8 H17 B10 N -","- C8 H17 B10 N -","- C32 H68 B40 N4 -","4","1","","Alekseyeva, Elena S.; Batsanov, Andrei S.; Boyd, Lynn A.; Fox, Mark A.; Hibbert, Thomas G.; Howard, Judith A. K.; Hugh MacBride, J. A.; Mackinnon, Angus; Wade, Kenneth","Intra- and inter-molecular carboranyl C‒H⋯N hydrogen bonds in pyridyl-containing ortho-carboranesElectronic supplementary information (ESI) available: rotatable 3-D molecular structure diagrams of experimental structures of 1‒4 and of MP2/6-31G* optimised geometries 1a‒7b in CHIME format. Computed GIAO NMR data for 1b‒4c. See http://www.rsc.org/suppdata/dt/b2/b209931d/","Dalton Transactions","2003","","3","475","","10.1039/b209931d","","","1.54178","CuKα","","0.1335","0.0564","","","0.1506","0.1835","","","","","","1.03","","","","has coordinates","179827","2020-10-21","18:00:00",""
"7012633","24.8172","0.0004","9.1563","0.0002","21.3197","0.0004","90","","107.703","0.001","90","","4615.14","0.15","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C48 H52 Fe N6 O2 P3 -","- C48 H52 Fe N6 O2 P3 -","- C192 H208 Fe4 N24 O8 P12 -","4","1","","Dean, Philip A. W.; Fisher, Keith; Craig, Don; Jennings, Michael; Ohene-Fianko, Ohenewa; Scudder, Marcia; Willett, Gary; Dance, Ian","Nanoclusters of phenylphosphonium cations and cyanoferrate anions in the gas phase, and the principles of association of these ions in crystals","Dalton Transactions","2003","","8","1520","","10.1039/b212488b","","","0.71073","MoKα","","0.0908","0.0458","","","0.1246","0.1374","","","","","","0.978","","","","has coordinates","179830","2020-10-21","18:00:00",""
"7012679","6.5755","0.0011","8.3861","0.0014","20.449","0.003","90","","97.06","0.003","90","","1119.1","0.3","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C11 H7 F3 N2 S Zn0.5 -","- C11 H7 F3 N2 S Zn0.5 -","- C44 H28 F12 N8 S4 Zn2 -","4","1","","Sousa-Pedrares, Antonio; Romero, Jaime; Arturo García-Vázquez, José; Luz Durán, María; Casanova, Isabel; Sousa, Antonio","Electrochemical synthesis and structural characterisation of zinc, cadmium and mercury complexes of heterocyclic bidentate ligands (N, S)","Dalton Transactions","2003","","7","1379","1388","10.1039/b300133b","","","0.71073","MoKα","","0.0464","0.0291","","","0.0697","0.0758","","","","","","0.985","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7013032","18.2826","0.0003","11.914","0.0002","12.7693","0.0003","90","","106.965","0.001","90","","2660.36","0.09","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C19 H20 Au Cl N6 O0.5 P -","- C19 H20 Au Cl N6 O0.5 P -","- C76 H80 Au4 Cl4 N24 O2 P4 -","4","1","","Zhang, Qingzhi; Hua, Guoxiong; Bhattacharyya, Pravat; Slawin, Alexandra M. Z.; Derek Woollins, J.","Synthesis and coordination chemistry of aminophosphine derivatives of adenine","Dalton Transactions","2003","","16","3250","","10.1039/b303715k","","","0.71073","MoKα","","0.0602","0.0378","","","0.0836","0.0899","","","","","","0.935","","","","has coordinates","188927","2020-10-21","18:00:00",""
"7013095","26.963","0.0007","9.4494","0.0002","18.3389","0.0004","90","","100.905","0.002","90","","4588.09","0.19","183","2","183","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C36 H60 N9 O2 Ru1.5 -","- C36 H60 N9 O2 Ru1.5 -","- C144 H240 N36 O8 Ru6 -","4","1","","Daniel Dönnecke; Wolfgang Imhof","The formation of cis- and trans-[Ru(CN)2(CNtBu)4] by reductive cleavage of isocyanide ligands; isomer separation by supramolecular interactions with various solvents","Dalton Trans.","2003","","13","2737","2744","10.1039/b304199a","","","0.71073","MoKα","","0.0847","0.0507","","0.1317","0.1124","","","","1.053","1.126","1.126","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7013262","15.719","0.01","13.7","0.008","35.49","0.02","90","","90.364","0.012","90","","7643","8","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C83 H71 Br N Ni1.5 P4 -","- C83 H71 Br N Ni1.5 P4 -","- C332 H284 Br4 N4 Ni6 P16 -","4","1","","Wei, Pingrong; Chan, Katie T. K.; Stephan, Douglas W.","Metallated triphenylphosphinimine complexes","Dalton Transactions","2003","","19","3804","","10.1039/b305877h","","","0.71073","MoKα","","0.1126","0.048","","","0.1069","0.1215","","","","","","0.818","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7013333","15.451","0.011","9.902","0.017","20.311","0.013","90","","102.82","0.1","90","","3030","6","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C30 H51 N6 O0.5 -","- C30 H51 N6 O0.5 -","- C120 H204 N24 O2 -","4","1","","Sílvia Carvalho; Carla Cruz; Rita Delgado; Michael G. B. Drew; Vítor Félix","Dinuclear copper and zinc complexes of a hexaazamacrocycle containing p-xylyl spacers and bridging anions: theoretical and spectroscopic studies","Dalton Trans.","2003","","22","4261","4270","10.1039/b306486g","","","0.71073","MoKα","","0.1778","0.1105","","","0.3112","0.3512","","","","","","1.198","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7013350","12.192","0.002","8.263","0.002","29.793","0.006","90","","97.74","0.03","90","","2974.1","1.1","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C14 H28 Cl2 N4 O2 Pt -","- C14 H26.6667 Cl2 N4 O2 Pt -","- C84 H160 Cl12 N24 O12 Pt6 -","6","1.5","","Cristina M. P. Ferreira; M. Fátima C. Guedes da Silva; Rino A. Michelin; Vadim Yu. Kukushkin; João J. R. Fraústo da Silva; Armando J. L. Pombeiro","2-Amino-2-oxazoline and trialkylisourea Pt(II) complexes derived from organocyanamides","Dalton Trans.","2003","","19","3751","3756","10.1039/b306690h","","","1.5418","CuKα","","0.0269","0.0269","","","0.0716","0.0716","","","","","","1.068","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7013503","14.25","0.009","18.493","0.012","21.397","0.014","90","","99.3","0.02","90","","5565","6","153","2","153","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C41 H67 Cu4 N8 O26.5 P2 -","- C41 H32 Cu4 N8 O26.5 P2 -","- C164 H128 Cu16 N32 O106 P8 -","4","1","","Doyle, Robert P.; Kruger, Paul E.; Moubaraki, Boujemaa; Murray, Keith S.; Nieuwenhuyzen, Mark","Synthesis and structural and magnetic characterisation of tetranuclear Cu(ii) complexes possessing novel [Cu4(�4-PO4)2(�2-CO3)] butterfly cores that exhibit supramolecular isomerismElectronic supplementary information (ESI) available: Figs. S1?3: Selected views of the 3D H-bonded water networks encapsulating 1, 1a and 2 showing oxygen?oxygen close contacts. See http://www.rsc.org/suppdata/dt/b3/b309275e/","Dalton Transactions","2003","","22","4230","","10.1039/b309275e","","","0.71073","MoKα","","0.1356","0.0789","","","0.2002","0.2352","","","","","","1.042","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7013516","5.477","0.003","8.37","0.005","12.711","0.007","90","","93.762","0.01","90","","581.4","0.6","168","2","168","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C11 H10 Ag N3 O3 -","- C11 H10 Ag N3 O3 -","- C22 H20 Ag2 N6 O6 -","2","0.5","","Steel, Peter J.; Sumby, Christopher J.","Coordination chemistry of di-2-pyridylmethane and related bridging ligands with silver(i), copper(ii), palladium(ii) and zinc(ii)","Dalton Transactions","2003","","23","4505","","10.1039/b309479k","","","0.71073","MoKα","","0.0656","0.0504","","","0.1262","0.1332","","","","","","0.978","","","","has coordinates","179839","2020-10-21","18:00:00",""
"7013555","11.5538","0.0006","11.5495","0.0006","22.3761","0.0012","90","","104.724","0.002","90","","2887.8","0.3","173","2","193","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C40 H84 Fe6 N6 O32 -","- C36 H60 Fe6 N6 O24 -","- C72 H120 Fe12 N12 O48 -","2","0.5","","Murugesu, Muralee; Abboud, Khalil A.; Christou, George","Preparation and properties of new Fe6 and Fe8 clusters of iron(iii) with tripodal ligands","Dalton Transactions","2003","","23","4552","","10.1039/b310030h","","","0.71073","MoKα","","0.041","0.0331","","","0.0851","0.0872","","","","","","1.076","","","","has coordinates","179839","2020-10-21","18:00:00",""
"7013891","15.045","0.003","11.053","0.002","13.108","0.003","90","","109.34","0.03","90","","2056.8","0.8","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C12 H24 Cl2 O14 Sm -","- C12 H24 Cl2 O14 Sm -","- C48 H96 Cl8 O56 Sm4 -","4","1","","Starynowicz, Przemysław","Two complexes of Sm(II) with crown ethers-electrochemical synthesis, structure and spectroscopy.","Dalton transactions (Cambridge, England : 2003)","2004","","5","825","832","10.1039/b316253b","","","0.71073","MoKα","","0.13","0.1017","","","0.2121","0.2265","","","","","","1.323","","","","has coordinates,has disorder","179842","2020-10-21","18:00:00",""
"7013913","14.03","0.005","9.517","0.004","20.476","0.008","90","","108.79","0.006","90","","2588.3","1.8","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C45 H48 Cd Cl2 N0 O14 S6 -","- C45 H47 Cd Cl2 O14.02 S6 -","- C90 H94 Cd2 Cl4 O28.04 S12 -","2","0.5","","Li, Jian-Rong; Bu, Xian-He; Zhang, Ruo-Hua","Novel Cd(II) coordination polymers with flexible disulfoxide ligands: effects of ligand spacers, terminal groups and counter anions on the complex framework formations.","Dalton transactions (Cambridge, England : 2003)","2004","","5","813","819","10.1039/b316441a","","","0.71073","MoKα","","0.0566","0.0384","","","0.1011","0.1102","","","","","","1.037","","","","has coordinates","179843","2020-10-21","18:00:00",""
"7014405","13.375","0.004","5.0372","0.001","16.368","0.005","90","","113.22","0.01","90","","1013.4","0.5","120","2","120","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","dibromo(1,5,9,13-tetraselenacyclohexadecane- Se,Se')germanium(ii)","dibromo(1,5,9,13-tetraselenacyclohexadecane-Se,Se')germanium(II)","","- C12 H24 Br2 Ge Se4 -","- C12 H24 Br2 Ge Se4 -","- C24 H48 Br4 Ge2 Se8 -","2","0.5","","Hector, Andrew L.; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian","Supramolecular assemblies of germanium(II) halides with O-, S- and Se-donor macrocycles - the effects of donor atom type upon structure.","Dalton transactions (Cambridge, England : 2003)","2011","40","3","694","700","10.1039/c0dt00749h","","","0.71073","MoKα","","0.0595","0.0409","","","0.0897","0.1015","","","","","","0.921","","","","has coordinates","179848","2020-10-21","18:00:00",""
"7014995","10.3004","0.0015","9.4257","0.0011","13.875","0.002","90","","101.678","0.004","90","","1319.2","0.3","223","2","223","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C12 H40 Gd N9 Se4 Sn -","- C12 H26 Gd N9 Se4 Sn -","- C24 H52 Gd2 N18 Se8 Sn2 -","2","0.5","","Liang, Jingjing; Chen, Jiangfang; Zhao, Jing; Pan, Yingli; Zhang, Yong; Jia, Dingxian","Effects of lanthanide metal size and amino ligand denticity on the solvothermal systems Ln/Sn/Se/en and Ln/Sn/Se/dien (Ln = lanthanide)","Dalton Transactions","2011","40","11","2631","","10.1039/c0dt01424a","","","0.71073","MoKα","","0.0393","0.0308","","","0.0772","0.081","","","","","","1.052","","","","has coordinates","179853","2020-10-21","18:00:00",""
"7015063","25.4693","0.0008","13.6167","0.0005","25.9759","0.0009","90","","117.403","0.002","90","","7997.8","0.5","213","2","213","2","","","","","","","","9","P 1 2/c 1","-P 2yc","13","(Ru(bpy)2(dppcb)PtCl2)(PF6)2","[Ru(bpy)2(dppcb)PtCl2](PF6)2","","- C75.5 H65 Cl9 F12 N4 O0.5 P6 Pt Ru -","- C75.5 H65 Cl9 F12 N4 O0.5 P6 Pt Ru -","- C302 H260 Cl36 F48 N16 O2 P24 Pt4 Ru4 -","4","1","","Eller, Sylvia; Trettenbrein, Barbara; Fessler, Markus; Haringer, Stephan; Ruggenthaler, Martin; Gutmann, Rene; van der Veer, Wytze E.; Kopacka, Holger; Müller, Thomas; Obendorf, Dagmar; Brüggeller, Peter","Surprising photochemical reactivity and visible light-driven energy transfer in heterodimetallic complexes.","Dalton transactions (Cambridge, England : 2003)","2011","40","15","3815","3829","10.1039/c0dt00253d","","","0.71073","MoKα","","0.0849","0.0497","","","0.1522","0.1797","","","","","","1.026","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7015064","25.2396","0.0005","13.4989","0.0003","25.5113","0.0006","90","","118.25","0.001","90","","7656.6","0.3","243","2","243","2","","","","","","","","9","P 1 2/c 1","-P 2yc","13","","[Ru(bpy)2(dppcb)PdCl2](PF6)2","","- C73.3 H64 Cl4.6 F12 N4 O P6 Pd Ru -","- C73.3 H64 Cl4.6 F12 N4 O P6 Pd Ru -","- C293.2 H256 Cl18.4 F48 N16 O4 P24 Pd4 Ru4 -","4","1","","Eller, Sylvia; Trettenbrein, Barbara; Fessler, Markus; Haringer, Stephan; Ruggenthaler, Martin; Gutmann, Rene; van der Veer, Wytze E.; Kopacka, Holger; Müller, Thomas; Obendorf, Dagmar; Brüggeller, Peter","Surprising photochemical reactivity and visible light-driven energy transfer in heterodimetallic complexes.","Dalton transactions (Cambridge, England : 2003)","2011","40","15","3815","3829","10.1039/c0dt00253d","","","0.71073","MoKα","","0.0713","0.0486","","","0.1317","0.1789","","","","","","1.026","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7015114","21.715","0.001","9.014","0.003","20.493","0.002","90","","116.97","0.01","90","","3575","1.3","200","","200","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C30 H34 F12 N10 P2 Ru -","- C30 H34 F11.999 N10 P2 Ru -","- C120 H136 F47.996 N40 P8 Ru4 -","4","1","","Dinda, Joydev; Liatard, Sébastien; Chauvin, Jérôme; Jouvenot, Damien; Loiseau, Frédérique","Electronic and geometrical manipulation of the excited state of bis-terdentate homo- and heteroleptic ruthenium complexes.","Dalton transactions (Cambridge, England : 2003)","2011","40","14","3683","3688","10.1039/c0dt01197e","","","0.71073","MoKα","","0.0474","0.0474","","0.0481","","0.0481","","","1.795","","","1.795","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7015753","11.193","0.002","9.569","0.0019","15.559","0.005","90","","123.63","0.02","90","","1387.5","0.7","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C29 H25 Dy N6 O9 -","- C29 H25 Dy N6 O9 -","- C58 H50 Dy2 N12 O18 -","2","0.5","","Chen, Gong-Jun; Gao, Chun-Yan; Tian, Jin-Lei; Tang, Jinkui; Gu, Wen; Liu, Xin; Yan, Shi-Ping; Liao, Dai-Zheng; Cheng, Peng","Coordination-perturbed single-molecule magnet behaviour of mononuclear dysprosium complexes.","Dalton transactions (Cambridge, England : 2003)","2011","40","20","5579","5583","10.1039/c1dt10050e","","","0.71073","MoKα","","0.0328","0.031","","","0.1027","0.1034","","","","","","1.318","","","","has coordinates","179861","2020-10-21","18:00:00",""
"7015985","10.31542","0.00015","16.59529","0.00019","20.2361","0.0003","90","","102.451","0.0014","90","","3382.69","0.08","173","","173","","","","","","","","","9","P 1 2/c 1","-P 2yc","13","","","","- C60 H60 Ag2 Au Cl2 F9 N6 O9 S5 -","- C60 H60 Ag2 Au Cl2 F9 N6 O9 S5 -","- C120 H120 Ag4 Au2 Cl4 F18 N12 O18 S10 -","2","0.5","","Chia, Eugene Y.; Naeem, Saira; Delaude, Lionel; White, Andrew J. P.; Wilton-Ely, James D E T","Gold(i) complexes bearing mixed-donor ligands derived from N-heterocyclic carbenes.","Dalton transactions (Cambridge, England : 2003)","2011","40","25","6645","6658","10.1039/c0dt01613f","","","1.54184","CuKα","","0.0563","0.0524","","","0.1501","0.1531","","","","","","1.105","","","","has coordinates,has disorder","179863","2020-10-21","18:00:00",""
"7016646","38.578","0.002","15.6651","0.0011","30.6281","0.0019","90","","95.483","0.006","90","","18425","2","100","2","100","2","","","","","","","","9","P 1 2/c 1","-P 2yc","13","","","","- C142 H141 Cl2 Co N6 Na2 O37.5 P3 S8 -","- C142 H122 Cl2 Co N6 Na O37.5 P3 S8 -","- C568 H488 Cl8 Co4 N24 Na4 O150 P12 S32 -","4","1","","Ling, Irene; Alias, Yatimah; Sobolev, Alexandre N.; Skelton, Brian W.; Raston, Colin L.","Site specific Co(iii) sarcophagine binding in multi-component phosphonium and p-sulfonatocalix[4]arene systems.","Dalton transactions (Cambridge, England : 2003)","2011","40","40","10337","10344","10.1039/c1dt10550g","","","1.54178","CuKα","","0.2324","0.1191","","","0.2998","0.3355","","","","","","0.742","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7016899","20.854","0.004","13.895","0.003","17.276","0.004","90","","92.23","0.03","90","","5002.2","1.9","160","2","160","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","[Fe(II)(NCSe)2(DDE)2]","[Fe(II)(NCSe)2(DDE)2]","","- C44 H56 Fe N18 Se2 -","- C44 H56 Fe N18 Se2 -","- C176 H224 Fe4 N72 Se8 -","4","1","","Ross, Tamsyn M.; Moubaraki, Boujemaa; Wallwork, Kia S.; Batten, Stuart R.; Murray, Keith S.","A temperature-dependent order-disorder and crystallographic phase transition in a 0D Fe(ii) spin crossover compound and its non-spin crossover Co(ii) isomorph.","Dalton transactions (Cambridge, England : 2003)","2011","40","39","10147","10155","10.1039/c1dt10961h","","","0.71073","MoKα","","0.0786","0.0432","","","0.0954","0.1087","","","","","","0.868","","","","has coordinates","179872","2020-10-21","18:00:00",""
"7016900","20.566","0.001","13.756","0.002","17.18","0.001","90","","92.445","0.003","90","","4855.9","0.8","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","[Fe(II)(NCBH3)2(DDE)2]","[Fe(II)(NCBH3)2(DDE)2]","","- C44 H62 B2 Fe N18 -","- C44 H62 B2 Fe N18 -","- C176 H248 B8 Fe4 N72 -","4","1","","Ross, Tamsyn M.; Moubaraki, Boujemaa; Wallwork, Kia S.; Batten, Stuart R.; Murray, Keith S.","A temperature-dependent order-disorder and crystallographic phase transition in a 0D Fe(ii) spin crossover compound and its non-spin crossover Co(ii) isomorph.","Dalton transactions (Cambridge, England : 2003)","2011","40","39","10147","10155","10.1039/c1dt10961h","","","0.77502","Synchrotron","","0.0653","0.0587","","","0.1523","0.157","","","","","","1.041","","","","has coordinates","179873","2020-10-21","18:00:00",""
"7016902","20.995","0.004","13.655","0.003","17.347","0.004","90","","91.91","0.03","90","","4970.4","1.8","173","1","173","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","[Co(II)(NCSe)2(DDE)2]","[Co(II)(NCSe)2(DDE)2]","","- C44 H56 Co N18 Se2 -","- C44 H56 Co N18 Se2 -","- C176 H224 Co4 N72 Se8 -","4","1","","Ross, Tamsyn M.; Moubaraki, Boujemaa; Wallwork, Kia S.; Batten, Stuart R.; Murray, Keith S.","A temperature-dependent order-disorder and crystallographic phase transition in a 0D Fe(ii) spin crossover compound and its non-spin crossover Co(ii) isomorph.","Dalton transactions (Cambridge, England : 2003)","2011","40","39","10147","10155","10.1039/c1dt10961h","","","0.71073","MoKα","","0.33","0.0966","","","0.1817","0.2851","","","","","","0.936","","","","has coordinates","179873","2020-10-21","18:00:00",""
"7017318","11.6298","0.0005","8.6881","0.0003","13.7113","0.0006","90","","107.915","0.002","90","","1318.23","0.09","123","","123","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C28 H20 Cu F6 N4 O2 P -","- C28 H20 Cu F6 N4 O2 P -","- C56 H40 Cu2 F12 N8 O4 P2 -","2","0.5","","Bozic-Weber, Biljana; Constable, Edwin C.; Housecroft, Catherine E.; Kopecky, Peter; Neuburger, Markus; Zampese, Jennifer A.","The intramolecular aryl embrace: from light emission to light absorption.","Dalton transactions (Cambridge, England : 2003)","2011","40","46","12584","12594","10.1039/c1dt11052g","","","0.71073","MoKα","","0.047","0.0394","","0.0613","0.0354","0.0336","","","","","","0.9996","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7017344","24.522","0.002","8.6258","0.0008","21.669","0.002","90","","113.291","0.002","90","","4210","0.7","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C43 H47 I3 N3 P -","- C43 H47 I3 N3 P -","- C172 H188 I12 N12 P4 -","4","1","","Martin, Caleb D.; Ragogna, Paul J.","Substitution matters: isolating phosphorus diiminopyridine complexes.","Dalton transactions (Cambridge, England : 2003)","2011","40","44","11976","11980","10.1039/c1dt11111f","","","0.71073","MoKα","","0.1037","0.0707","","","0.1572","0.1703","","","","","","1.149","","","","has coordinates","179877","2020-10-21","18:00:00",""
"7017748","7.2299","0.0008","11.3987","0.0012","12.7792","0.0012","90","","117.793","0.005","90","","931.66","0.17","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H18 Cu N10 O6 -","- C14 H18 Cu N10 O6 -","- C28 H36 Cu2 N20 O12 -","2","0.5","","Caballero, Ana B.; Rodríguez-Diéguez, Antonio; Vidal, Isaac; Dobado, José A; Castillo, Oscar; Lezama, Luis; Salas, Juan M.","Insights on the binding ability of a new adenine analog: 7-amine-1,2,4-triazolo[1,5-a]pyrimidine. Synthesis and magnetic study of the first copper(ii) complexes.","Dalton transactions (Cambridge, England : 2003)","2012","41","6","1755","1764","10.1039/c1dt11385b","","","0.71073","MoKα","","0.1285","0.0729","","","0.1593","0.1872","","","","","","1.055","","","","has coordinates","179881","2020-10-21","18:00:00",""
"7017848","11.6827","0.0008","9.4837","0.0005","12.5641","0.0009","90","","101.481","0.007","90","","1364.19","0.16","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C18 H40 Cl N4 O6 Ru2 -","- C18 H40 Cl N4 O6 Ru2 -","- C36 H80 Cl2 N8 O12 Ru4 -","2","0.5","","Villalobos, Leslie; Cao, Zhi; Fanwick, Phillip E.; Ren, Tong","Diruthenium(II,III) tetramidates as a new class of oxygenation catalysts.","Dalton transactions (Cambridge, England : 2003)","2012","41","2","644","650","10.1039/c1dt11530h","","","1.54184","CU-Kα","","0.049","0.047","","","0.135","0.138","","","","","","1.129","","","","has coordinates","288189","2023-12-08","15:49:02",""
"7018093","10.715","0.002","11.039","0.002","24.188","0.005","90","","105.41","0.03","90","","2758.2","1","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C28 H20 N6 O8 Zn -","- C28 H13 N6 O8 Zn -","- C112 H52 N24 O32 Zn4 -","4","1","","Li, Baiyan; Yang, Fen; Zhang, Yiming; Li, Guanghua; Zhou, Qi; Hua, Jia; Shi, Zhan; Feng, Shouhua","Design and construction of coordination polymers based on 2,2'-dinitro-4,4'-biphenyldicarboxylate and semi-rigid N-donor ligands: diverse structures and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2012","41","9","2677","2684","10.1039/c1dt11654a","","","0.71073","MoKα","","0.0549","0.0353","","","0.0885","0.1005","","","","","","1.074","","","","has coordinates,has disorder","179884","2020-10-21","18:00:00",""
"7018184","12.2087","0.0004","18.8106","0.0005","22.2153","0.0007","90","","105.222","0.003","90","","4922.8","0.3","100","","100","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C85.53 H111.12 K Mn4 O30.53 S8 -","- C85.5306 H111.122 K Mn4 O30.5306 S8 -","- C171.061 H222.245 K2 Mn8 O61.0612 S16 -","2","0.5","","Lamouchi, Meriem; Jeanneau, Erwann; Pillonnet, Anne; Brioude, Arnaud; Martini, Matteo; Stéphan, Olivier; Meganem, Faouzi; Novitchi, Ghenadie; Luneau, Dominique; Desroches, Cédric","Tetranuclear manganese(ii) complexes of sulfonylcalix[4]arene macrocycles: synthesis, structure, spectroscopic and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2012","41","9","2707","2713","10.1039/c2dt11786j","","","0.7107","MoKα","","0.0757","0.0616","","0.1197","0.1016","0.1197","","","","","","1.0487","","","","has coordinates,has disorder","179885","2020-10-21","18:00:00",""
"7018701","9.674","0.005","11.078","0.005","16.972","0.005","90","","115.427","0.018","90","","1642.7","1.3","120","2","120","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C28 H16 Bi Li5 N4 O18 -","- C28 H13 Bi Li5 N4 O18 -","- C56 H26 Bi2 Li10 N8 O36 -","2","0.5","","Thirumurugan, A.; Li, Wei; Cheetham, Anthony K.","Bismuth 2,6-pyridinedicarboxylates: Assembly of molecular units into coordination polymers, CO(2) sorption and photoluminescence.","Dalton transactions (Cambridge, England : 2003)","2012","41","14","4126","4134","10.1039/c2dt12330d","","","1.5418","CuKα","","0.0294","0.0285","","","0.0777","0.0783","","","","","","1.081","","","","has coordinates,has disorder","179891","2020-10-21","18:00:00",""
"7018953","15.4308","0.0005","16.6886","0.0006","14.3795","0.0006","90","","94.631","0.003","90","","3690.9","0.2","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C36 H24 Cl4 N8 O Pd3 -","- C36 H24 Cl3.99 N8 O Pd3 -","- C144 H96 Cl15.96 N32 O4 Pd12 -","4","1","","Yang, Fu-Ming; Chen, Po-Yuan; Lee, Chun-Chin; Liu, Yi-Hung; Peng, Shie-Ming; Chou, Pi-Tai; Liu, Shiuh-Tzung","A water soluble and air-stable tripalladium cluster","Dalton Transactions","2012","41","19","5782","","10.1039/c2dt30079f","","","0.71073","MoKα","","0.0681","0.0419","","","0.1492","0.1563","","","","","","1.007","","","","has coordinates,has disorder","179893","2020-10-21","18:00:00",""
"7019051","15.2447","0.0012","7.7411","0.0007","45.632","0.004","90","","91.899","0.006","90","","5382.1","0.8","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C20 H18 Fe O2 Si -","- C20 H18 Fe O2 Si -","- C240 H216 Fe12 O24 Si12 -","12","3","","Sänger, Inge; Kückmann, Theresa I; Dornhaus, Franz; Bolte, Michael; Wagner, Matthias; Lerner, Hans-Wolfram","The inverse sandwich complex [(K(18-crown-6))(2)Cp][CpFe(CO)(2)] - unpredictable redox reactions of [CpFe(CO)(2)]I with the silanides Na[SiRtBu(2)] (R = Me, tBu) and the isoelectronic phosphanyl borohydride K[PtBu(2)BH(3)].","Dalton transactions (Cambridge, England : 2003)","2012","41","22","6671","6676","10.1039/c2dt00031h","","","0.71073","MoKα","","0.2237","0.1613","","","0.3508","0.3785","","","","","","1.064","","","","has coordinates","179894","2020-10-21","18:00:00",""
"7019333","32.9404","0.0006","18.709","0.0003","28.3771","0.0005","90","","111.947","0.002","90","","16220.9","0.5","150","","150","","","","","","","","Kevin Mason","7","P 1 2/c 1","-P 2yc","13","","","","- C151 H208 B5 F20 Mn6 N27 O20 -","- C125 H181 B4.5 F18 Mn6 N23 O19.5 -","- C500 H724 B18 F72 Mn24 N92 O78 -","4","1","","Mason, Kevin; Chang, John; Prescimone, Alessandro; Garlatti, Elena; Carretta, Stefano; Tasker, Peter A.; Brechin, Euan K.","Linking [M(III)(3)] triangles with ""double-headed"" phenolic oximes.","Dalton transactions (Cambridge, England : 2003)","2012","41","29","8777","8785","10.1039/c2dt30189j","","","1.5418","CuKα","","0.1694","0.1377","","0.1743","0.1548","0.1548","","","","","","1.097","","","","has coordinates,has disorder","179897","2020-10-21","18:00:00",""
"7020365","15.246","0.003","6.8008","0.0009","8.0856","0.0013","90","","92.234","0.014","90","","837.7","0.2","180","2","180","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C12 H20 N2 O11 Sr -","- C12 H20 N2 O11 Sr -","- C24 H40 N4 O22 Sr2 -","2","0.5","","Dokorou, Vassiliki N.; Milios, Constantinos J.; Tsipis, Athanassios C.; Haukka, Matti; Weidler, Peter G.; Powell, Annie K.; Kostakis, George E.","Pseudopeptidic ligands: exploring the self-assembly of isophthaloylbisglycine (H2IBG) and divalent metal ions.","Dalton transactions (Cambridge, England : 2003)","2012","41","40","12501","12513","10.1039/c2dt31383a","","","0.71073","MoKα","","0.0895","0.0601","","","0.1558","0.1666","","","","","","0.971","","","","has coordinates","179907","2020-10-21","18:00:00",""
"7020367","15.211","0.003","6.8469","0.0014","8.1434","0.0016","90","","92.16","0.03","90","","847.5","0.3","180","2","180","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C12 H20 Cu N2 O11 -","- C12 H20 Cu N2 O11 -","- C24 H40 Cu2 N4 O22 -","2","0.5","","Dokorou, Vassiliki N.; Milios, Constantinos J.; Tsipis, Athanassios C.; Haukka, Matti; Weidler, Peter G.; Powell, Annie K.; Kostakis, George E.","Pseudopeptidic ligands: exploring the self-assembly of isophthaloylbisglycine (H2IBG) and divalent metal ions.","Dalton transactions (Cambridge, England : 2003)","2012","41","40","12501","12513","10.1039/c2dt31383a","","","0.71073","MoKα","","0.12","0.0741","","","0.1803","0.2099","","","","","","1.058","","","","has coordinates","179907","2020-10-21","18:00:00",""
"7021204","25.4796","0.0032","6.8649","0.0007","8.9741","0.0011","90","","99.204","0.007","90","","1549.5","0.3","100","2","100","2","","","","","","","synthesis as described","3","P 1 2/c 1","-P 2yc","13","","","","- C21 H14 N4 -","- C21 H14 N4 -","- C84 H56 N16 -","4","1","","Das, Sudipta; Sahana, Animesh; Banerjee, Arnab; Lohar, Sisir; Safin, Damir A.; Babashkina, Maria G.; Bolte, Michael; Garcia, Yann; Hauli, Ipsit; Mukhopadhyay, Subhra Kanti; Das, Debasis","Ratiometric fluorescence sensing and intracellular imaging of Al(3+) ions driven by an intramolecular excimer formation of a pyrimidine-pyrene scaffold.","Dalton transactions (Cambridge, England : 2003)","2013","42","14","4757","4763","10.1039/c3dt32908a","","x-ray","0.7107","MoKα","","0.0501","0.0378","","","0.1101","0.1277","","","","","","1.084","","","","has coordinates","179917","2020-10-21","18:00:00",""
"7021221","8.8702","0.0002","9.2216","0.0003","13.7007","0.0003","90","","107.309","0.002","90","","1069.93","0.05","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","catena-Poly-(bis(mu2-hexamathylenetetraamine)-tetra(mu2- thicyanato)-di(methanol)dicadium(ii))","catena-Poly-(bis(μ2-hexamathylenetetraamine)- tetra(μ2-thicyanato)-di(methanol)dicadium(II))","","- C6 H10 Cd N4 O S2 -","- C6 H10 Cd N4 O S2 -","- C24 H40 Cd4 N16 O4 S8 -","4","1","","Barszcz, Barbara; Masternak, Joanna; Sawka-Dobrowolska, Wanda","Assembling novel Cd(ii) complexes with multidentate nitrogen donor ligands obtained in situ from the system: zerovalent copper, cadmium oxide, 1-hydroxymethyl-3,5-dimethylpyrazole and ammonium thiocyanate.","Dalton transactions (Cambridge, England : 2003)","2013","42","17","5960","5963","10.1039/c3dt32987a","","","0.71073","MoKα","","0.0192","0.016","","","0.0437","0.0446","","","","","","0.959","","","","has coordinates","179917","2020-10-21","18:00:00",""
"7021694","18.3243","0.0003","23.0931","0.0003","23.8096","0.0004","90","","130.337","0.001","90","","7680","0.2","160","2","160","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C143 H108 F18 Lu2 N28 O18 S6 -","- C133 H97.5 F9 Lu2 N24.5 O9 S3 -","- C266 H195 F18 Lu4 N49 O18 S6 -","2","0.5","","Ryan, Patrick E.; Guénée, Laure; Piguet, Claude","Monitoring helical twists and effective molarities in dinuclear triple-stranded lanthanide helicates.","Dalton transactions (Cambridge, England : 2003)","2013","42","31","11047","11055","10.1039/c3dt50941a","","","1.54184","CuKα","","0.0723","0.0595","","","0.1831","0.1993","","","","","","1.218","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7021708","15.915","0.018","9.941","0.007","16.361","0.013","90","","110.84","0.08","90","","2419","4","150","","150","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C48 H48 Br3 F6 N4 P Te2 -","- C48 H48 Br3 F6 N4 P Te2 -","- C96 H96 Br6 F12 N8 P2 Te4 -","2","0.5","","Beckmann, Jens; Bolsinger, Jens; Duthie, Andrew; Finke, Pamela","Diarylhalotelluronium(iv) cations [(8-Me2NC10H6)2TeX](+) (X = Cl, Br, I) stabilized by intramolecularly coordinating N-donor substituents.","Dalton transactions (Cambridge, England : 2003)","2013","42","34","12193","12202","10.1039/c3dt51011e","","","0.71073","MoKα","","0.1625","0.0628","","","0.108","0.133","","","","","","0.846","","","","has coordinates","179922","2020-10-21","18:00:00",""
"7022295","21.781","0.003","13.119","0.002","16.471","0.003","90","","106.61","0.002","90","","4510.1","1.2","291","2","291","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C82 H70 B6 Cu4 F24 N18 O3 -","- C82 H70 B6 Cu4 F24 N18 O3 -","- C164 H140 B12 Cu8 F48 N36 O6 -","2","0.5","","Xu, Feng; Tao, Tao; Zhang, Kun; Wang, Xiao-Xu; Huang, Wei; You, Xiao-Zeng","C-C bond cleavage in acetonitrile by copper(II)-bipyridine complexes and in situ formation of cyano-bridged mixed-valent copper complexes.","Dalton transactions (Cambridge, England : 2003)","2013","42","10","3631","3645","10.1039/c2dt32281a","","","0.71073","MoKα","","0.0967","0.0478","","","0.1095","0.1201","","","","","","0.834","","","","has coordinates,has disorder","179927","2020-10-21","18:00:00",""
"7022301","10.4565","0.0015","14.39","0.002","7.5675","0.0011","90","","97.177","0.002","90","","1129.8","0.3","291","2","291","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C24 H16 Cu F6 N4 P -","- C24 H16 Cu F6 N4 P -","- C48 H32 Cu2 F12 N8 P2 -","2","0.5","","Xu, Feng; Tao, Tao; Zhang, Kun; Wang, Xiao-Xu; Huang, Wei; You, Xiao-Zeng","C-C bond cleavage in acetonitrile by copper(II)-bipyridine complexes and in situ formation of cyano-bridged mixed-valent copper complexes.","Dalton transactions (Cambridge, England : 2003)","2013","42","10","3631","3645","10.1039/c2dt32281a","","","0.71073","MoKα","","0.0908","0.0416","","","0.0746","0.0842","","","","","","0.818","","","","has coordinates","179928","2020-10-21","18:00:00",""
"7022350","11.788","0.003","8.531","0.002","13.945","0.004","90","","101.17","0.004","90","","1375.8","0.6","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C19 H26 N2 O14 Pd4 -","- C19 H26 N2 O14 Pd4 -","- C38 H52 N4 O28 Pd8 -","2","0.5","","Shishilov, Oleg N.; Akhmadullina, Nailya S.; Rezinkova, Yaroslavna N.; Podobedov, Roman E.; Churakov, Andrei V.; Efimenko, Inessa A.","Reactivity of polynuclear palladium carboxylate complexes towards acetonitrile: synthesis and X-ray study of Pd2(C6H4-o-C(=NH)CH3)2(CH3CO2)2 and Pd5(CH3C(=N)OC(=N)CH3)(NO)(NO2)x(RCO2)7-x.","Dalton transactions (Cambridge, England : 2003)","2013","42","10","3712","3720","10.1039/c2dt32407e","","","0.71073","MoKα","","0.0819","0.0564","","","0.1378","0.1477","","","","","","1.037","","","","has coordinates,has disorder","179928","2020-10-21","18:00:00",""
"7022424","15.792","0.004","11.677","0.006","21.775","0.004","90","","104.04","0.01","90","","3895","2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C34 H44 Cl Co2 N4 O10 -","- C34 H44 Cl Co2 N4 O10 -","- C136 H176 Cl4 Co8 N16 O40 -","4","1","","Majumder, Samit; Mondal, Suraj; Lemoine, Pascale; Mohanta, Sasankasekhar","Dinuclear mixed-valence Co(III)Co(II) complexes derived from a macrocyclic ligand: unique example of a Co(III)Co(II) complex showing catecholase activity.","Dalton transactions (Cambridge, England : 2003)","2013","42","13","4561","4569","10.1039/c2dt32629a","","","0.71073","MoKα","","0.1652","0.0502","","","0.1228","0.1534","","","","","","0.98","","","","has coordinates,has disorder","179929","2020-10-21","18:00:00",""
"7024477","11.9078","0.0002","9.9474","0.0001","17.729","0.0003","90","","102.361","0.002","90","","2051.35","0.06","105","2","105","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C38 H40 Fe N12 O7 S2 -","- C38 H26 Fe N12 S2 -","- C76 H52 Fe2 N24 S4 -","2","0.5","","Yang, Feng-Lei; Li, Bao; Hanajima, Taro; Einaga, Yasuaki; Huang, Rong-Bin; Zheng, Lan-Sun; Tao, Jun","An iron(II) incomplete spin-crossover compound: pressure effects and Mössbauer spectroscopy study.","Dalton transactions (Cambridge, England : 2003)","2010","39","9","2288","2292","10.1039/b917518k","","","1.54178","CuKα","","0.0736","0.0641","","","0.1803","0.189","","","","","","1.12","","","","has coordinates","179949","2020-10-21","18:00:00",""
"7024562","14.415","0.002","7.7905","0.0011","17.9381","0.0018","90","","120.395","0.008","90","","1737.6","0.4","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C30 H42 Cl2 N2 O4 S2 Zn -","- C30 H42 Cl2 N2 O4 S2 Zn -","- C60 H84 Cl4 N4 O8 S4 Zn2 -","2","0.5","","Casas, J. S.; Castellano, E. E.; Couce, M. D.; García-Vega, M; Sánchez, A; Sánchez-González, A; Sordo, J.; Varela, J. M.; Vázquez López, E M","Chemical and in vitro study of the potential of 3-(aryl)-2-sulfanylpropenoic acids and their Zn(II) complexes as protective agents against cadmium toxicity.","Dalton transactions (Cambridge, England : 2003)","2010","39","16","3931","3943","10.1039/b918361b","","","0.71073","MoKα","","0.1375","0.0548","","","0.0906","0.1084","","","","","","0.875","","","","has coordinates","179950","2020-10-21","18:00:00",""
"7024571","16.0345","0.0013","10.4349","0.0006","20.4898","0.0015","90","","105.409","0.003","90","","3305.1","0.4","150","2","150","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C52 H60 Ag2 B2 Cl8 F8 N8 O4 -","- C52 H60 Ag2 B2 Cl8 F8 N8 O4 -","- C104 H120 Ag4 B4 Cl16 F16 N16 O8 -","2","0.5","","Yue, Nancy L. S.; Jennings, Michael C.; Puddephatt, Richard J.","Dynamic ring-opening polymerization of silver(I) complexes with bis(amidopyridine) ligands.","Dalton transactions (Cambridge, England : 2003)","2010","39","5","1273","1281","10.1039/b918615h","","","0.71073","MoKα","","0.2298","0.1077","","","0.2917","0.3674","","","","","","1.041","","","","has coordinates,has disorder","179950","2020-10-21","18:00:00",""
"7024587","18.8355","0.0018","14.9833","0.0014","49.076","0.005","90","","91.906","0.001","90","","13842","2","250","2","250","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C242 H184 Ir16 O36 P12 -","- C242 H184 Ir16 O36 P12 -","- C484 H368 Ir32 O72 P24 -","2","0.5","","Peli, Giulia; Daghetta, Matteo; Macchi, Piero; Sironi, Angelo; Garlaschelli, Luigi","Four tetrairidium carbonyl clusters linked by six diphosphino ligands: synthesis and X-ray structure of [{Ir(4)(CO)(9)}(4)(dppmb)(6)] (dppmb = 1,4-bis(diphenylphosphinomethyl)benzene.","Dalton transactions (Cambridge, England : 2003)","2010","39","5","1188","1190","10.1039/b918770g","","x-ray","0.71069","MoKα","","0.1846","0.0775","","","0.1751","0.2177","","","","","","1.032","","","","has coordinates","179950","2020-10-21","18:00:00",""
"7024755","7.8169","0.0011","9.095","0.0007","13.1775","0.0015","90","","106.175","0.013","90","","899.77","0.19","140","2","140","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C12 H12 Au Cl2 F6 N2 O2 P -","- C12 H12 Au Cl2 F6 N2 O2 P -","- C24 H24 Au2 Cl4 F12 N4 O4 P2 -","2","0.5","","Casini, Angela; Diawara, Mariam Celine; Scopelliti, Rosario; Zakeeruddin, Shaik Mohammed; Grätzel, Michael; Dyson, Paul J.","Synthesis, characterisation and biological properties of gold(III) compounds with modified bipyridine and bipyridylamine ligands.","Dalton transactions (Cambridge, England : 2003)","2010","39","9","2239","2245","10.1039/b921019a","","","0.71073","MoKα","","0.0775","0.0767","","","0.2114","0.2118","","","","","","1.23","","","","has coordinates","179952","2020-10-21","18:00:00",""
"7024930","9.753","0.003","12.751","0.002","14.174","0.004","90","","109.41","0.01","90","","1662.5","0.7","294","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C27 H21 Mn3 Na O23 -","- C27 H11 Mn3 Na O23 -","- C54 H22 Mn6 Na2 O46 -","2","0.5","","Nadeem, Muhammad Arif; Craig, Donald J.; Bircher, Roland; Stride, John A.","Magneto-structural correlations of a three-dimensional Mn based metal-organic framework.","Dalton transactions (Cambridge, England : 2003)","2010","39","18","4358","4362","10.1039/b922750d","","x-ray","0.71073","MoKα","","","0.038","","","","0.059","","","","","","1.91","","","","has coordinates","179954","2020-10-21","18:00:00",""
"7025118","17.2541","0.0007","10.5472","0.0005","23.849","0.0008","90","","124.434","0.002","90","","3579.6","0.3","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C72 H45 F12 Fe2 N13 O12 S4 -","- C72 H45 F12 Fe2 N13 O12 S4 -","- C144 H90 F24 Fe4 N26 O24 S8 -","2","0.5","","Madhu, Vedichi; Ekambaram, Balaraman; Shimon, Linda J. W.; Diskin, Yael; Leitus, Gregory; Neumann, Ronny","Structural diversity in manganese, iron and cobalt complexes of the ditopic 1,2-bis(2,2'-bipyridyl-6-yl)ethyne ligand and observation of epoxidation and catalase activity of manganese compounds.","Dalton transactions (Cambridge, England : 2003)","2010","39","31","7266","7275","10.1039/b925129d","","","0.71073","MoKα","","0.1152","0.0563","","","0.1231","0.1558","","","","","","1.008","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7025351","16.7916","0.0004","11.0807","0.0003","26.443","0.0007","90","","128.189","0.002","90","","3867","0.2","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C38 H32 F6 N6 O3 P Re -","- C38 H32 F6 N6 O3 P Re -","- C152 H128 F24 N24 O12 P4 Re4 -","4","1","","Ko, Chi-Chiu; Ng, Chi-On; Feng, Hua; Chu, Wing-Kin","Synthesis, characterisation and photophysical studies of leucotriarylmethanes-containing ligands and their rhenium(I) tricarbonyl diimine complexes.","Dalton transactions (Cambridge, England : 2003)","2010","39","28","6475","6482","10.1039/b927167h","","","0.71073","MoKα","","0.071","0.0371","","","0.0776","0.0819","","","","","","0.846","","","","has coordinates","179959","2020-10-21","18:00:00",""
"7025390","13.772","0.004","11.538","0.003","23.107","0.007","90","","94.385","0.005","90","","3661","1.8","93","2","93","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C55 H74 Cl4 Hg5 N12 O16 S6 -","- C55 H66 Cl4 Hg5 N12 O16 S6 -","- C110 H132 Cl8 Hg10 N24 O32 S12 -","2","0.5","","Viehweg, Julie A.; Stamps, Sarah M.; Dertinger, Jennifer J.; Green, Robert L.; Harris, Katherine E.; Butcher, Raymond J.; Andriole, Erica J.; Poutsma, J. C.; Berry, Steven M.; Bebout, Deborah C.","A synthetic model of Hg(II) sequestration.","Dalton transactions (Cambridge, England : 2003)","2010","39","13","3174","3176","10.1039/c000002g","","","0.71073","MoKα","","0.071","0.0349","","","0.0478","0.0529","","","","","","0.833","","","","has coordinates","179959","2020-10-21","18:00:00",""
"7025491","12.647","0.0015","20.723","0.003","10.6438","0.0014","90","","110.525","0.007","90","","2612.5","0.6","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C57 H71 N4 O4 Zr -","- C57 H64 N4 O4 Zr -","- C114 H128 N8 O8 Zr2 -","2","0.5","","Hu, Minggang; Wang, Mei; Zhu, Hongjun; Zhang, Lu; Zhang, Hui; Sun, Licheng","Preparation and structures of enantiomeric dinuclear zirconium and hafnium complexes containing two homochiral N atoms, and their catalytic property for polymerization of rac-lactide.","Dalton transactions (Cambridge, England : 2003)","2010","39","18","4440","4446","10.1039/c001148g","","","0.71073","MoKα","","0.0612","0.0469","","","0.1264","0.1352","","","","","","1.058","","","","has coordinates,has disorder","179960","2020-10-21","18:00:00",""
"7025520","4.1332","0.0003","8.2724","0.0004","20.919","0.0014","90","","95.291","0.006","90","","712.2","0.08","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C3 H12 Ag2 Br2 N6 S3 -","- C3 H12 Ag2 Br2 N6 S3 -","- C6 H24 Ag4 Br4 N12 S6 -","2","0.5","","Bowmaker, Graham A.; Pakawatchai, Chaveng; Saithong, Saowanit; Skelton, Brian W.; White, Allan H.","Structural and spectroscopic studies of some adducts of silver(I) halides with thiourea and N-ethyl substituted thioureas.","Dalton transactions (Cambridge, England : 2003)","2010","39","18","4391","4404","10.1039/c001398f","","","0.71073","MoKα","","0.0574","0.0423","","","0.0933","0.0962","","","","","","0.986","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7025664","13.124","0.0011","11.4567","0.0009","16.0054","0.0013","90","","90.626","0.001","90","","2406.4","0.3","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H36 Co3 N8 O20 -","- C48 H36 Co3 N8 O20 -","- C96 H72 Co6 N16 O40 -","2","0.5","","Ma, Lu-Fang; Meng, Qing-Lei; Wang, Li-Ya; Liu, Bin; Liang, Fu-Pei","Multi-dimensional transition-metal coordination polymers with 5-nitro-1,2,3-benzenetricarboxylic acid exhibiting ferro-/antiferromagnetic interactions.","Dalton transactions (Cambridge, England : 2003)","2010","39","35","8210","8218","10.1039/c002581j","","","0.71073","MoKα","","0.0347","0.0322","","","0.0914","0.0939","","","","","","1.02","","","","has coordinates","179962","2020-10-21","18:00:00",""
"7026356","18.9503","0.0019","7.1992","0.0007","23.5351","0.0017","90","","123.836","0.005","90","","2667","0.4","291","2","291","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C51 H28 Co2 F18 O13 -","- C51 H28 Co2 F18 O13 -","- C102 H56 Co4 F36 O26 -","2","0.5","","Ji, Changchun; Huang, Liangfang; Li, Jing; Zheng, Hegen; Li, Yizhi; Guo, Zijian","Solvothermal syntheses, structures, and physical properties of four new coordination compounds constructed from a bent dicarboxylate ligand.","Dalton transactions (Cambridge, England : 2003)","2010","39","35","8240","8247","10.1039/c0dt00352b","","","0.71073","MoKα","","0.1012","0.0636","","","0.1339","0.1447","","","","","","1.002","","","","has coordinates","179969","2020-10-21","18:00:00",""
"7026403","10.222","0.0018","8.1615","0.001","18.248","0.003","90","","105.75","0.02","90","","1465.2","0.4","243","2","243","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C28 H38 N6 O2 Si -","- C28 H38 N6 O2 Si -","- C56 H76 N12 O4 Si2 -","2","0.5","","Junold, Konstantin; Burschka, Christian; Bertermann, Rüdiger; Tacke, Reinhold","Novel neutral hexacoordinate silicon(IV) complexes with two bidentate monoanionic benzamidinato ligands.","Dalton transactions (Cambridge, England : 2003)","2010","39","39","9401","9413","10.1039/c0dt00391c","","","0.71073","MoKα","","0.0626","0.0454","","","0.1236","0.1332","","","","","","1.069","","","","has coordinates","179970","2020-10-21","18:00:00",""
"7026981","15.798","0.001","11.148","0.001","17.643","0.001","90","","100.79","0.01","90","","3052.3","0.4","298","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H44 I2 N2 Na2 O9 -","- C10 H23 I N Na O4.5 -","- C40 H92 I4 N4 Na4 O18 -","4","1","","Kılıç, Zeynel; Yıldız, Mustafa; Hökelek, Tuncer; Erdoǧan, Baki","Substituted diazacrown ethers. Synthesis, spectral characterization and single-crystal structures of C20H42N2O8(NaI)2·H2O and C20H42N2O8(KI)2·H2O","Journal of the Chemical Society, Dalton Transactions","1998","","21","3635","","10.1039/a804119i","","","0.71073","MoKα","","","0.032","","","0.047","","","","","1.61","1.61","","","","","has coordinates","282214","2023-04-03","16:35:42",""
"7027030","14.0189","0.0012","9.6264","0.0015","15.7007","0.0006","90","","90.005","0.005","90","","2118.8","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C15 H7 Ir O11 Ru3 -","- C15 H7 Ir O11 Ru3 -","- C60 H28 Ir4 O44 Ru12 -","4","1","","Ferrand, Vincent; Süss-Fink, Georg; Neels, Antonia; Stoeckli-Evans, Helen","Triruthenium‒iridium clusters containing alkyne ligands: synthesis, structure, and catalytic implications of [(μ-H)IrRu3(CO)11(μ3-η2-PhCCPh)] and [IrRu3(CO)10(μ4-η2-PhCCPh)(μ-η2-PhCCHPh)]","Journal of the Chemical Society, Dalton Transactions","1998","","22","3825","","10.1039/a805852k","","","0.71073","MoKα","","0.0443","0.0359","","","0.0824","0.0876","","","","","","1.129","","","","has coordinates","179976","2020-10-21","18:00:00",""
"7028079","9.653","0.012","14.164","0.014","18.277","0.015","90","","94.93","0.09","90","","2490","4","173","2","173","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C36 H86 Cu Li N2 O6 Si4 -","- C38 H86 Cu Li N2 O4 Si4 -","- C76 H172 Cu2 Li2 N4 O8 Si8 -","2","0.5","","Hitchcock, Peter B.; Lappert, Michael F.; Layh, Marcus","Synthesis and molecular structures of copper(I) 1-azaallyls","Journal of the Chemical Society, Dalton Transactions","1998","","10","1619","","10.1039/a801232f","","","0.71073","MoKα","","0.1953","0.0978","","0.3233","0.2235","","","","1.045","1.205","1.205","","","","","has coordinates,has disorder","179986","2020-10-21","18:00:00",""
"7028402","15.179","0.004","4.2189","0.001","16.682","0.003","90","","117.679","0.017","90","","946","0.4","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H14 Br2 N4 Pb -","- C14 H14 Br2 N4 Pb -","- C28 H28 Br4 N8 Pb2 -","2","0.5","","Hashemi, Lida; Morsali, Ali; Joo, Sang Woo","Mechanochemical solid state anion-exchange of lead(II) coordination polymers via an intermediate coordination polymer; new precursors for the preparation of PbBr2/Pb3O2Br2, PbBr(OH) and PbO nanoparticles.","Dalton transactions (Cambridge, England : 2003)","2014","43","4","1489","1492","10.1039/c3dt51533h","","","0.71073","MoKα","","0.053","0.0466","","","0.1077","0.1235","","","","","","1.216","","","","has coordinates","179990","2020-10-21","18:00:00",""
"7028437","17.7605","0.0003","8.0655","0.0001","14.5295","0.0002","90","","91.469","0.001","90","","2080.63","0.05","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C21 H14 N5 O4 Re -","- C21 H14 N5 O4 Re -","- C84 H56 N20 O16 Re4 -","4","1","","Sarkar, Rupa; Mondal, Pallab; Rajak, Kajal Krishna","Synthesis, structure and spectroscopic properties of Re(i) complexes incorporating 5-arylazo-8-hydroxyquinoline: a density functional theory/time-dependent density functional theory investigation.","Dalton transactions (Cambridge, England : 2003)","2014","43","7","2859","2877","10.1039/c3dt52630e","","","0.71073","MoKα","","0.0569","0.0334","","","0.0707","0.0896","","","","","","1.069","","","","has coordinates","179990","2020-10-21","18:00:00",""
"7028561","10.86","0.0004","10.047","0.0003","17.0342","0.0005","90","","103.865","0.0019","90","","1804.45","0.1","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C28 H24 B2 Bi Cl N8 S4 -","- C28 H24 B2 Bi Cl N8 S4 -","- C56 H48 B4 Bi2 Cl2 N16 S8 -","2","0.5","","Imran, Muhammad; Neumann, Beate; Stammler, Hans-Georg; Monkowius, Uwe; Ertl, Martin; Mitzel, Norbert W.","Borate-based ligands with two soft heterocycle/thione groups and their sodium and bismuth complexes.","Dalton transactions (Cambridge, England : 2003)","2014","43","3","1267","1278","10.1039/c3dt52607k","","","0.71073","MoKα","","0.0676","0.0599","","","0.1513","0.1553","","","","","","1.075","","","","has coordinates","179991","2020-10-21","18:00:00",""
"7028681","8.6389","0.0011","5.0436","0.0006","12.3817","0.0016","90","","99.551","0.012","90","","532.01","0.12","130","0.1","130","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C2 H10 Br2 N4 O S2 -","- C2 H10 Br2 N4 O S2 -","- C4 H20 Br4 N8 O2 S4 -","2","0.5","","Biesiada, M.; Kourkoumelis, N.; Kubicki, M.; Owczarzak, A. M.; Balas, V.; Hadjikakou, S. K.","Fundamental chemistry of iodine. The reaction of di-iodine towards thiourea and its methyl-derivative: formation of aminothiazoles and aminothiadiazoles through dicationic disulfides.","Dalton transactions (Cambridge, England : 2003)","2014","43","12","4790","4806","10.1039/c3dt53302f","","","1.5418","CuKα","","0.0406","0.0396","","","0.121","0.1221","","","","","","1.185","","","","has coordinates","179992","2020-10-21","18:00:00",""
"7028695","10.1059","0.0003","10.4411","0.0003","15.6091","0.0005","90","","100.699","0.003","90","","1618.39","0.09","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C21 H13 B F2 N2 -","- C21 H13 B F2 N2 -","- C84 H52 B4 F8 N8 -","4","1","","Misra, Rajneesh; Dhokale, Bhausaheb; Jadhav, Thaksen; Mobin, Shaikh M.","The quenching of fluorescence as an indicator of donor-strength in meso arylethynyl BODIPYs.","Dalton transactions (Cambridge, England : 2003)","2014","43","12","4854","4861","10.1039/c3dt53056f","","","1.5418","CuKα","","0.0519","0.0427","","","0.1244","0.1387","","","","","","1.09","","","","has coordinates","179992","2020-10-21","18:00:00",""
"7028828","24.574","0.004","11.2196","0.0015","20.89","0.003","90","","110.473","0.003","90","","5395.8","1.4","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C100 H116 Cl20 Co2 N12 -","- C100 H116 Cl20 Co2 N12 -","- C200 H232 Cl40 Co4 N24 -","2","0.5","","Dey, Soumyajit; Rath, Sankar Prasad","Syn-anti conformational switching in an ethane-bridged Co(II)bisporphyrin induced by external stimuli: effects of inter-macrocyclic interactions, axial ligation and chemical and electrochemical oxidations.","Dalton transactions (Cambridge, England : 2003)","2014","43","5","2301","2314","10.1039/c3dt52784k","","","0.71073","MoKα","","0.0952","0.0616","","","0.1466","0.1683","","","","","","0.995","","","","has coordinates","179994","2020-10-21","18:00:00",""
"7028924","15.7907","0.0003","13.8468","0.0003","17.3811","0.0003","90","","123.105","0.001","90","","3183.48","0.11","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C36 H30 F5 N P2 Si -","- C36 H30 F5 N P2 Si -","- C144 H120 F20 N4 P8 Si4 -","4","1","","Bolli, Christoph; Gellhaar, Jorit; Jenne, Carsten; Keßler, Mathias; Scherer, Harald; Seeger, Helene; Uzun, Rabiya","Bis(triphenyl-λ(5)-phosphanylidene)ammonium fluoride: a reactive fluoride source to access the hypervalent silicates [MenSiF5-n](-) (n = 0-3).","Dalton transactions (Cambridge, England : 2003)","2014","43","11","4326","4334","10.1039/c3dt52617h","","","0.71073","MoKα","","0.064","0.0448","","","0.0923","0.0994","","","","","","1.085","","","","has coordinates","179995","2020-10-21","18:00:00",""
"7029148","19.089","0.005","15.026","0.005","21.23","0.005","90","0.005","95.527","0.005","90","0.005","6061","3","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C54 H39 Cl2 N11 O8 Ru -","- C54 H39 Cl2 N11 O8 Ru -","- C216 H156 Cl8 N44 O32 Ru4 -","4","1","","Das, Shyamal; Karmakar, Srikanta; Mardanya, Sourav; Baitalik, Sujoy","Synthesis, structural characterization, and multichannel anion and cation sensing studies of a bifunctional Ru(ii) polypyridyl-imidazole based receptor.","Dalton transactions (Cambridge, England : 2003)","2014","43","9","3767","3782","10.1039/c3dt52424h","","","0.71073","MoKα","","0.1137","0.082","","","0.2152","0.2312","","","","","","1.018","","","","has coordinates","179997","2020-10-21","18:00:00",""
"7029450","12.856","0.003","11.081","0.003","27.351","0.006","90","","114.913","0.009","90","","3533.8","1.5","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C78 H62 Co3 N8 O14 -","- C78 H62 Co3 N8 O14 -","- C156 H124 Co6 N16 O28 -","2","0.5","","Cui, Lin; Yang, Guo-Ping; Wu, Wei-Ping; Miao, Hui-Hui; Shi, Qi-Zhen; Wang, Yao-Yu","Solvents and auxiliary ligands co-regulate three antiferromagnetic Co(ii) MOFs based on a semi-rigid carboxylate ligand.","Dalton transactions (Cambridge, England : 2003)","2014","43","15","5823","5830","10.1039/c3dt53342e","","","0.71073","MoKα","","0.1668","0.0706","","","0.1597","0.2246","","","","","","1.018","","","","has coordinates","180000","2020-10-21","18:00:00",""
"7029647","3.9498","0.0008","11.228","0.0006","5.542","0.0009","90","","134.56","0.03","90","","175.12","0.1","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","Gd4 O3 F6","","","- F6 Gd4 O3 -","- F6 Gd4 O3 -","- F6 Gd4 O3 -","1","0.25","","Grzyb, Tomasz; Wiglusz, Rafal J.; Nagirnyi, Vitali; Kotlov, Aleksei; Lis, Stefan","Revised crystal structure and luminescent properties of gadolinium oxyfluoride Gd4O3F6 doped with Eu(3+) ions.","Dalton transactions (Cambridge, England : 2003)","2014","43","18","6925","6934","10.1039/c4dt00338a","","","","","","0.0226879","","","0.0329143","","","","","0.0236171","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7031262","32.556","0.003","9.5372","0.001","21.679","0.002","90","","107.558","0.002","90","","6417.6","1.1","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","4-[1,3-di-<i>tert</i>-butyl-4-(4,4-dimethylpiperazin-4-ium-1- yl)-2,4-diselanylidene-1,3,2λ^5^,4λ^5^-diazadiphosphedin-2- yl]-1,1-dimethylpiperazin-1-ium iodide hydrate","","- C20 H47 I2 N6 O0.5 P2 Se2 -","- C20 H47 I2 N6 O0.5 P2 Se2 -","- C160 H376 I16 N48 O4 P16 Se16 -","8","2","","Balakrishna, Maravanji S.; Suresh, Devarajan; Ananthnag, Guddekoppa S.; Mague, Joel T.","Quaternization and oxidation reactions of cyclodiphosphazane derivatives and their copper(i) and gold(i) complexes.","Dalton transactions (Cambridge, England : 2003)","2014","43","23","8835","8848","10.1039/c4dt00801d","","","0.71073","MoKα","","0.0652","0.0494","","","0.0987","0.1038","","","","","","1.151","","","","has coordinates","194155","2020-10-21","18:00:00",""
"7031431","13.7756","0.0006","10.2495","0.0005","33.6122","0.0017","90","","91.672","0.004","90","","4743.8","0.4","150","2","150","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C96 H118 B2 Cl6 Cu F6 N4 P3 -","- C96 H118 B2 Cl6 Cu F6 N4 P3 -","- C192 H236 B4 Cl12 Cu2 F12 N8 P6 -","2","0.5","","Davies, Laura H.; Harrington, Ross W.; Clegg, William; Higham, Lee J.","(B)R2BodPR2: highly fluorescent alternatives to PPh3 and PhPCy2.","Dalton transactions (Cambridge, England : 2003)","2014","43","36","13485","13499","10.1039/c4dt00704b","","","0.71073","MoKα","","0.1101","0.0827","","","0.2032","0.2228","","","","","","1.072","","","","has coordinates,has disorder","180020","2020-10-21","18:00:00",""
"7031434","22.626","0.002","10.2574","0.0008","20.8126","0.0019","90","","111.403","0.01","90","","4497.2","0.7","150","2","150","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C98 H102 B2 Cu N4 O2 P2 -","- C98 H102 B2 Cu N4 O2 P2 -","- C196 H204 B4 Cu2 N8 O4 P4 -","2","0.5","","Davies, Laura H.; Harrington, Ross W.; Clegg, William; Higham, Lee J.","(B)R2BodPR2: highly fluorescent alternatives to PPh3 and PhPCy2.","Dalton transactions (Cambridge, England : 2003)","2014","43","36","13485","13499","10.1039/c4dt00704b","","","0.71073","MoKα","","0.1409","0.0803","","","0.1884","0.2213","","","","","","1.033","","","","has coordinates,has disorder","180020","2020-10-21","18:00:00",""
"7031603","16.3754","0.0008","7.4218","0.0004","23.9485","0.001","90","","116.683","0.003","90","","2600.6","0.2","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C52 H28 Co2 F12 N4 O8 S -","- C52 H28 Co2 F12 N4 O8 S -","- C104 H56 Co4 F24 N8 O16 S2 -","2","0.5","","Shi, Zhi-Qiang; Guo, Zi-Jian; Zheng, He-Gen","Syntheses, crystal structures, and optical properties of five metal complexes constructed from a V-shaped thiophene-containing ligand and different dicarboxylate ligands.","Dalton transactions (Cambridge, England : 2003)","2014","43","35","13250","13258","10.1039/c4dt01400f","","","0.71073","MoKα","","0.0357","0.0319","","","0.0991","0.1026","","","","","","1.003","","","","has coordinates","180022","2020-10-21","18:00:00",""
"7031632","11.139","0.002","9.972","0.002","16.079","0.003","90","","96.81","0.03","90","","1773.4","0.6","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C44 H29 Bi F4 O6 -","- C44 H29 Bi F4 O6 -","- C88 H58 Bi2 F8 O12 -","2","0.5","","Ong, Yih Ching; Blair, Victoria L.; Kedzierski, Lukasz; Andrews, Philip C.","Stability and toxicity of heteroleptic organometallic Bi(v) complexes towards Leishmania major.","Dalton transactions (Cambridge, England : 2003)","2014","43","34","12904","","10.1039/c4dt00957f","","","0.71073","synchrotron","","0.0505","0.0495","","","0.1405","0.1434","","","","","","1.039","","","","has coordinates,has disorder","180022","2020-10-21","18:00:00",""
"7031743","12.946","0.002","13.68","0.002","19.492","0.004","90","","114.307","0.002","90","","3146","0.9","291","2","291","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C52 H48 Cl8 Cu2 N12 O4 -","- C52 H48 Cl8 Cu2 N12 O4 -","- C104 H96 Cl16 Cu4 N24 O8 -","2","0.5","","Dai, Yuan; Wang, Yin-Ge; Geng, Jiao; Peng, Yu-Xin; Huang, Wei","Dinuclear Cu(ii) complexes based on two flexible Schiff-base ligands and one unusual in situ formed diphenolate 2,6-piperidin-4-one derivative.","Dalton transactions (Cambridge, England : 2003)","2014","43","37","13831","13834","10.1039/c4dt01014k","","","0.71073","MoKα","","0.0687","0.055","","","0.1533","0.1647","","","","","","1.07","","","","has coordinates","180023","2020-10-21","18:00:00",""
"7031744","12.949","0.01","14.283","0.012","19.337","0.012","90","","114.18","0.04","90","","3263","4","291","2","291","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C52 H48 Br8 Cu2 N12 O4 -","- C52 H48 Br8 Cu2 N12 O4 -","- C104 H96 Br16 Cu4 N24 O8 -","2","0.5","","Dai, Yuan; Wang, Yin-Ge; Geng, Jiao; Peng, Yu-Xin; Huang, Wei","Dinuclear Cu(ii) complexes based on two flexible Schiff-base ligands and one unusual in situ formed diphenolate 2,6-piperidin-4-one derivative.","Dalton transactions (Cambridge, England : 2003)","2014","43","37","13831","13834","10.1039/c4dt01014k","","","0.71073","MoKα","","0.1841","0.0939","","","0.2058","0.2451","","","","","","1.06","","","","has coordinates","180023","2020-10-21","18:00:00",""
"7031789","4.2609","0.0002","6.5644","0.0004","11.3523","0.0007","90","","90.511","0.002","90","","317.51","0.03","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- F Mo2 O7 Y -","- F Mo2 O7 Y -","- F2 Mo4 O14 Y2 -","2","0.5","","Hartenbach, Ingo; Höppe, Henning A; Kazmierczak, Karolina; Schleid, Thomas","Synthesis, crystal structure and spectroscopic properties of a novel yttrium(iii) fluoride dimolybdate(vi): YFMo2O7.","Dalton transactions (Cambridge, England : 2003)","2014","43","37","14016","14021","10.1039/c4dt01066c","","","0.71073","MoKα","","0.021","0.0209","","","0.0527","0.0527","","","","","","1.088","","","","has coordinates","180023","2020-10-21","18:00:00",""
"7032128","14.6053","0.0006","5.98157","0.00017","15.2271","0.0006","90","","118.214","0.005","90","","1172.23","0.09","100","0.1","100","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C6 H12 Cl2 N4 Zn -","- C6 H12 Cl2 N4 Zn -","- C24 H48 Cl8 N16 Zn4 -","4","1","","Smirnov, Andrey S.; Butukhanova, Ekaterina S.; Bokach, Nadezhda A.; Starova, Galina L.; Gurzhiy, Vladislav V.; Kuznetsov, Maxim L.; Kukushkin, Vadim Yu","Novel (cyanamide)Zn(II) complexes and zinc(ii)-mediated hydration of the cyanamide ligands.","Dalton transactions (Cambridge, England : 2003)","2014","43","42","15798","15811","10.1039/c4dt01812e","","","1.5418","CuKα","","0.0278","0.0256","","","0.0668","0.0682","","","","","","1.098","","","","has coordinates","180027","2020-10-21","18:00:00",""
"7032129","14.8739","0.001","6.1147","0.0003","15.5444","0.0009","90","","117.993","0.008","90","","1248.35","0.16","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C6 H12 Br2 N4 Zn -","- C6 H12 Br2 N4 Zn -","- C24 H48 Br8 N16 Zn4 -","4","1","","Smirnov, Andrey S.; Butukhanova, Ekaterina S.; Bokach, Nadezhda A.; Starova, Galina L.; Gurzhiy, Vladislav V.; Kuznetsov, Maxim L.; Kukushkin, Vadim Yu","Novel (cyanamide)Zn(II) complexes and zinc(ii)-mediated hydration of the cyanamide ligands.","Dalton transactions (Cambridge, England : 2003)","2014","43","42","15798","15811","10.1039/c4dt01812e","","","0.7107","MoKα","","0.057","0.049","","","0.1055","0.1081","","","","","","1.331","","","","has coordinates","180027","2020-10-21","18:00:00",""
"7032611","9.3047","0.0009","9.5898","0.0009","32.815","0.003","90","","95.167","0.009","90","","2916.2","0.5","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C36 H38 Co2 Mo6 N28 O28 P2 -","- C36 H38 Co2 Mo6 N28 O28 P2 -","- C72 H76 Co4 Mo12 N56 O56 P4 -","2","0.5","","Gong, Yun; Yang, Yong Xi; Zhang, Miao Miao; Gao, Xiao Lin; Yin, Jun Li; Lin, Jian Hua","A polyoxometalate-based complex with visible-light photochromism as the electrocatalyst for generating hydrogen from water.","Dalton transactions (Cambridge, England : 2003)","2014","43","44","16928","16936","10.1039/c4dt01685h","","","0.71073","MoKα","","0.1042","0.0619","","","0.1207","0.1431","","","","","","1.038","","","","has coordinates,has disorder","180032","2020-10-21","18:00:00",""
"7032719","19.693","0.004","16.245","0.003","26.761","0.008","90","","132.8","0.018","90","","6282","3","113","2","113","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C68 H60 F Mo12 N12 O54 P Zn2 -","- C68 H60 F Mo12 N12 O54 P Zn2 -","- C136 H120 F2 Mo24 N24 O108 P2 Zn4 -","2","0.5","","Liu, Jian-Jun; Wang, Yao; Hong, Yu-Jian; Lin, Mei-Jin; Huang, Chang-Cang; Dai, Wen-Xin","A photochromic naphthalene diimide coordination network sensitized by polyoxometalates.","Dalton transactions (Cambridge, England : 2003)","2014","43","48","17908","17911","10.1039/c4dt02641a","","","0.71073","MoKα","","0.1089","0.0914","","","0.2212","0.2318","","","","","","1.094","","","","has coordinates","180033","2020-10-21","18:00:00",""
"7032730","13.1681","0.0006","15.7367","0.0007","13.2976","0.0006","90","","91.788","0.002","90","","2754.2","0.2","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C28 H38 N5 Na O2 -","- C28 H38 N5 Na O2 -","- C112 H152 N20 Na4 O8 -","4","1","","Travieso-Puente, Raquel; Chang, Mu-Chieh; Otten, Edwin","Alkali metal salts of formazanate ligands: diverse coordination modes as a result of the nitrogen-rich [NNCNN] ligand backbone.","Dalton transactions (Cambridge, England : 2003)","2014","43","48","18035","18041","10.1039/c4dt02578d","","","0.71073","MoKα","","0.05","0.041","","","0.1068","0.1136","","","","","","1.033","","","","has coordinates","180033","2020-10-21","18:00:00",""
"7032751","16.2736","0.0016","13.5024","0.0013","17.6132","0.0017","90","","113.296","0.001","90","","3554.7","0.6","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C40 H38 N2 O6 Ru -","- C40 H38 N2 O6 Ru -","- C160 H152 N8 O24 Ru4 -","4","1","","Cesari, C.; Conti, S.; Zacchini, S.; Zanotti, V.; Cassani, M. C.; Mazzoni, R.","Sterically driven synthesis of ruthenium and ruthenium-silver N-heterocyclic carbene complexes.","Dalton transactions (Cambridge, England : 2003)","2014","43","46","17240","17243","10.1039/c4dt02747g","","","0.71073","MoKα","","0.0616","0.0417","","","0.1127","0.1284","","","","","","1.035","","","","has coordinates,has disorder","180033","2020-10-21","18:00:00",""
"7033279","10.266","0.002","13.899","0.003","16.102","0.003","90","","101.31","0.03","90","","2252.9","0.8","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C52 H40.5 Cd2 N4 O12.25 -","- C52 H40.5 Cd2 N4 O12.25 -","- C104 H81 Cd4 N8 O24.5 -","2","0.5","","Liu, Lei-Lei; Yu, Cai-Xia; Ma, Feng-Ji; Li, Ya-Ru; Han, Jing-Jing; Lin, Lu; Ma, Lu-Fang","Structural diversity and photocatalytic properties of Cd(II) coordination polymers constructed by a flexible V-shaped bipyridyl benzene ligand and dicarboxylate derivatives.","Dalton transactions (Cambridge, England : 2003)","2015","44","4","1636","1645","10.1039/c4dt03271c","","","0.71073","MoKα","","0.0355","0.0263","","","0.0573","0.0645","","","","","","1.055","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7033458","54.872","0.006","4.9603","0.0005","7.1628","0.0007","90","","90.368","0.002","90","","1949.5","0.3","200","2","200","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C18 H34 O4 Pb -","- C18 H34 O4 Pb -","- C72 H136 O16 Pb4 -","4","1","","Catalano, Jaclyn; Murphy, Anna; Yao, Yao; Yap, Glenn P. A.; Zumbulyadis, Nicholas; Centeno, Silvia A.; Dybowski, Cecil","Coordination geometry of lead carboxylates - spectroscopic and crystallographic evidence.","Dalton transactions (Cambridge, England : 2003)","2015","44","5","2340","2347","10.1039/c4dt03075c","","","0.71073","MoKα","","0.0939","0.0839","","","0.1648","0.1681","","","","","","1.311","","","","has coordinates","180040","2020-10-21","18:00:00",""
"7033631","23.551","0.019","13.683","0.011","27.38","0.02","90","","99.212","0.014","90","","8709","12","150","2","150","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","[V2(PS3)2(mu-Se2)(mu-Se)][PPh4]2","","","- C91 H72 N3 O0.25 P4 S6 Se3 V2 -","- C91 H72 N3 O0.25 P4 S6 Se3 V2 -","- C364 H288 N12 O P16 S24 Se12 V8 -","4","1","","Wu, Hong-Ming; Chang, Ya-Ho; Tsai, Yi-Fang; Hsu, Kuei-Fang; Lee, Gene-Hsiang; Hsu, Hua-Fen","Non-oxido divanadium(iv) and divanadium(v) thiolate complexes with a new type of chalcogenide bridging motif.","Dalton transactions (Cambridge, England : 2003)","2015","44","10","4468","4473","10.1039/c4dt03934c","","","0.71073","MoKα","","0.1348","0.0578","","","0.132","0.184","","","","","","1.035","","","","has coordinates","180042","2020-10-21","18:00:00",""
"7033742","11.4364","0.0009","12.8183","0.001","9.0313","0.0007","90","","100.463","0.002","90","","1301.93","0.18","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C25 H17 F12 N5 O2 -","- C25 H17 F12 N5 O2 -","- C50 H34 F24 N10 O4 -","2","0.5","","Olivari, Martina; Montis, Riccardo; Karagiannidis, Louise E.; Horton, Peter N.; Mapp, Lucy K.; Coles, Simon J.; Light, Mark E.; Gale, Philip A.; Caltagirone, Claudia","Anion complexation, transport and structural studies of a series of bis-methylurea compounds.","Dalton transactions (Cambridge, England : 2003)","2015","44","5","2138","2149","10.1039/c4dt02893g","","","0.71075","MoKα","","0.0465","0.0381","","","0.0974","0.1025","","","","","","1.037","","","","has coordinates,has disorder","180043","2020-10-21","18:00:00",""
"7033778","15.9","0.003","9.21","0.0018","16.379","0.003","90","","94.82","0.03","90","","2390","0.8","100","","100","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C22 H34 N8 O2 -","- C22 H34 N8 O2 -","- C88 H136 N32 O8 -","4","1","","Bindewald, Elvira; Lorenz, Roxana; Hübner, Olaf; Brox, Dominik; Herten, Dirk-Peter; Kaifer, Elisabeth; Himmel, Hans-Jörg","Tetraguanidino-functionalized phenazine and fluorene dyes: synthesis, optical properties and metal coordination.","Dalton transactions (Cambridge, England : 2003)","2015","44","7","3467","3485","10.1039/c4dt03572k","","","0.71073","MoKα","","0.1055","0.091","","","0.2642","0.2687","","","","","","1.095","","","","has coordinates","180043","2020-10-21","18:00:00",""
"7033806","14.1335","0.0009","3.9687","0.0003","17.0383","0.0012","90","","117.486","0.004","90","","847.83","0.11","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C12 H10 Cd Cl2 N6 S2 -","- C12 H10 Cd Cl2 N6 S2 -","- C24 H20 Cd2 Cl4 N12 S4 -","2","0.5","","Guo, Bing; Zhang, Xiao; Wang, Yan-Ning; Huang, Jing-Jing; Yu, Jie-Hui; Xu, Ji-Qing","New 1-D and 3-D thiocyanatocadmates modified by various amine molecules and Cl(-)/CH3COO(-) ions: synthesis, structural characterization, thermal behavior and photoluminescence properties.","Dalton transactions (Cambridge, England : 2003)","2015","44","11","5095","5105","10.1039/c4dt03799e","","","0.71073","MoKα","","0.0202","0.0192","","","0.0546","0.0553","","","","","","1.171","","","","has coordinates","180044","2020-10-21","18:00:00",""
"7034125","12.006","0.002","7.4721","0.0015","16.822","0.006","90","","117.21","0.02","90","","1342.1","0.6","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C28 H22 I2 N4 O4 -","- C28 H22 I2 N4 O4 -","- C56 H44 I4 N8 O8 -","2","0.5","","Liu, Jian-Jun; Guan, Ying-Fang; Jiao, Chen; Lin, Mei-Jin; Huang, Chang-Cang; Dai, Wen-Xin","A panchromatic hybrid crystal of iodoplumbate nanowires and J-aggregated naphthalene diimides with long-lived charge-separated states.","Dalton transactions (Cambridge, England : 2003)","2015","44","13","5957","5960","10.1039/c4dt03785e","","","0.71073","MoKα","","0.0606","0.0535","","","0.1329","0.1386","","","","","","1.074","","","","has coordinates","180047","2020-10-21","18:00:00",""
"7034289","16.2799","0.0008","7.2214","0.0004","24.2716","0.001","90","","116.419","0.003","90","","2555.5","0.2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C104 H58 Co4 F24 N8 O19 -","- C104 H58 Co4 F24 N8 O19 -","- C104 H58 Co4 F24 N8 O19 -","1","0.25","","Wang, Ting; Zhang, Chuanlei; Ju, Zemin; Zheng, Hegen","Solvent-induced synthesis of cobalt(ii) coordination polymers based on a rigid ligand and flexible carboxylic acid ligands: syntheses, structures and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2015","44","15","6926","6935","10.1039/c5dt00578g","","","0.71073","MoKα","","0.0343","0.0321","","","0.0998","0.102","","","","","","1.023","","","","has coordinates","180048","2020-10-21","18:00:00",""
"7034337","16.8744","0.0006","14.2505","0.0006","23.1944","0.0013","90","","114.678","0.004","90","","5068.1","0.4","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C102 H150 Li2 N16 O6 -","- C102 H150 Li2 N16 O6 -","- C204 H300 Li4 N32 O12 -","2","0.5","","Naktode, Kishor; Bhattacharjee, Jayeeta; Nayek, Hari Pada; Panda, Tarun K.","Imidazol-2-ylidene-N'-phenylureate ligands in alkali and alkaline earth metal coordination spheres - heterocubane core to polymeric structural motif formation.","Dalton transactions (Cambridge, England : 2003)","2015","44","16","7458","7469","10.1039/c5dt00490j","","","1.54184","CuKα","","0.1014","0.0826","","","0.2408","0.241","","","","","","1.075","","","","has coordinates","180049","2020-10-21","18:00:00",""
"7034368","13.2453","0.0009","11.7477","0.0008","15.6869","0.0008","90","","119.71","0.004","90","","2120","0.2","185","2","185","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","cis-bis(6-t-butyl-2-(diphenylphosphanyl)phenolato-O,P)-nickel","","- C51 H52 N0 Ni O2 P2 -","- C51 H52 Ni O2 P2 -","- C102 H104 Ni2 O4 P4 -","2","0.5","","Zhang, Yan-Ping; Li, Wei-Wei; Li, Bai-Xiang; Mu, Hong-Liang; Li, Yue-Sheng","Well-defined phosphino-phenolate neutral nickel(ii) catalysts for efficient (co)polymerization of norbornene and ethylene.","Dalton transactions (Cambridge, England : 2003)","2015","44","16","7382","7394","10.1039/c5dt00074b","","","0.71073","MoKα","","0.0542","0.0404","","","0.0936","0.1007","","","","","","1.024","","","","has coordinates","180049","2020-10-21","18:00:00",""
"7034570","11.8051","0.0015","14.1508","0.0016","7.6915","0.0005","90","","91.038","0.009","90","","1284.7","0.2","150","","150","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","3","","- C18 H22 Br Ca N4 O6 -","- C18 H22 Br Ca N4 O6 -","- C36 H44 Br2 Ca2 N8 O12 -","2","0.5","","Suresh, Paladugu; Naga Babu, Chatla; Sampath, Natarajan; Prabusankar, Ganesan","Photoluminescent calcium azolium carboxylates with diversified calcium coordination geometry and thermal stability.","Dalton transactions (Cambridge, England : 2003)","2015","44","16","7338","7346","10.1039/c5dt00480b","","","1.54184","CuKα","","0.0963","0.0697","","","0.1975","0.2293","","","","","","0.952","","","","has coordinates,has disorder","180051","2020-10-21","18:00:00",""
"7034721","18.4902","0.0004","11.6717","0.0002","15.5756","0.0002","90","","110.188","0.002","90","","3154.9","0.1","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C29 H49 B F4 N6 Ru -","- C29 H49 B F4 N6 Ru -","- C116 H196 B4 F16 N24 Ru4 -","4","1","","Glöge, Thomas; Jess, Kristof; Bannenberg, Thomas; Jones, Peter G.; Langenscheidt-Dabringhausen, Nadine; Salzer, Albrecht; Tamm, Matthias","16-Electron pentadienyl- and cyclopentadienyl-ruthenium half-sandwich complexes with bis(imidazol-2-imine) ligands and their use in catalytic transfer hydrogenation.","Dalton transactions (Cambridge, England : 2003)","2015","44","26","11717","11724","10.1039/c5dt01080b","","","0.71073","MoKα","","0.0408","0.026","","","0.0532","0.0546","","","","","","0.888","","","","has coordinates","180053","2020-10-21","18:00:00",""
"7034977","7.7158","0.0008","7.7397","0.0008","25.946","0.003","90","","98.273","0.002","90","","1533.3","0.3","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C12 H9 Cl2 N2 O5.5 Zn -","- C12 H9 Cl2 N2 O5.5 Zn -","- C48 H36 Cl8 N8 O22 Zn4 -","4","1","","Li, Cheng-Peng; Chen, Jing; Mu, Yu-Hai; Du, Miao","Exceptional sensitivity to the synthetic approach and halogen substituent for Zn(ii) coordination assemblies with 5-halonicotinic acids.","Dalton transactions (Cambridge, England : 2003)","2015","44","24","11109","11118","10.1039/c5dt00420a","","","0.71073","MoKα","","0.0554","0.0413","","","0.1047","0.1112","","","","","","1.069","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7034980","15.3861","0.0015","6.8845","0.0007","29.387","0.003","90","","90.112","0.002","90","","3112.8","0.5","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C24 H22 Br4 N4 O12 Zn -","- C24 H22 Br4 N4 O12 Zn -","- C96 H88 Br16 N16 O48 Zn4 -","4","1","","Li, Cheng-Peng; Chen, Jing; Mu, Yu-Hai; Du, Miao","Exceptional sensitivity to the synthetic approach and halogen substituent for Zn(ii) coordination assemblies with 5-halonicotinic acids.","Dalton transactions (Cambridge, England : 2003)","2015","44","24","11109","11118","10.1039/c5dt00420a","","","0.71073","MoKα","","0.1012","0.0431","","","0.091","0.1086","","","","","","1.01","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7034981","7.782","0.005","7.787","0.005","26.565","0.017","90","","96.944","0.013","90","","1598","1.8","296","2","296.15","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C12 H8.3 Br2 N2 O5.15 Zn -","- C12 H7.6 Br2 N2 O5.15 Zn -","- C48 H30.4 Br8 N8 O20.6 Zn4 -","4","1","","Li, Cheng-Peng; Chen, Jing; Mu, Yu-Hai; Du, Miao","Exceptional sensitivity to the synthetic approach and halogen substituent for Zn(ii) coordination assemblies with 5-halonicotinic acids.","Dalton transactions (Cambridge, England : 2003)","2015","44","24","11109","11118","10.1039/c5dt00420a","","","0.71073","MoKα","","0.1467","0.1101","","","0.2363","0.2508","","","","","","1.095","","","","has coordinates,has disorder","176429","2020-10-21","18:00:00",""
"7035510","30.722","0.005","10.9071","0.0018","15.974","0.003","90","","100.161","0.002","90","","5268.7","1.6","293","2","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C20 H20 N4 -","- C20 H20 N4 -","- C200 H200 N40 -","10","2.5","","Yu, Changjiang; Hao, Erhong; Li, Tingting; Wang, Jun; Sheng, Wanle; Wei, Yun; Mu, Xiaolong; Jiao, Lijuan","Dipyrrolylquinoxaline difluoroborates with intense red solid-state fluorescence.","Dalton transactions (Cambridge, England : 2003)","2015","44","31","13897","13905","10.1039/c5dt02012c","","","0.71073","MoKα","","0.1551","0.0933","","","0.2764","0.3024","","","","","","1.015","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7035954","12.28","0.004","11.817","0.004","15.788","0.005","90","","108.274","0.008","90","","2175.5","1.2","120","2","120","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C36 H36 B2 F8 Fe2 N8 O10 -","- C36 H32 B2 F8 Fe2 N8 O10 -","- C72 H64 B4 F16 Fe4 N16 O20 -","2","0.5","","Adhikary, Amit; Jena, Himanshu Sekhar; Konar, Sanjit","A family of Fe(3+) based double-stranded helicates showing a magnetocaloric effect, and Rhodamine B dye and DNA binding activities.","Dalton transactions (Cambridge, England : 2003)","2015","44","35","15531","15543","10.1039/c5dt01569c","","","1.54178","CuKα","","0.0935","0.0794","","","0.2064","0.2136","","","","","","1.162","","","","has coordinates","161335","2020-10-21","18:00:00",""
"7035980","28.203","0.003","15.868","0.002","25.367","0.003","90","","115.652","0.002","90","","10233","2","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C75 H54 Cl12 Cu3 N32 O12 -","- C75 H54 Cl12 Cu3 N32 O12 -","- C300 H216 Cl48 Cu12 N128 O48 -","4","1","","Maxwell, Lindley; Gómez-Coca, Silvia; Weyhermüller, Thomas; Panyella, David; Ruiz, Eliseo","A trinuclear Cu(II) complex with functionalized s-heptazine N-ligands: molecular chemistry from a g-C3N4 fragment.","Dalton transactions (Cambridge, England : 2003)","2015","44","36","15761","15763","10.1039/c5dt02485d","","","0.71073","MoKα","","0.1105","0.0743","","","0.1902","0.2145","","","","","","1.062","","","","has coordinates","161385","2020-10-21","18:00:00",""
"7036016","16.509","0.002","11.1843","0.0017","27.176","0.004","90","","122.487","0.01","90","","4232.6","1.1","298","","298","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C74 H82 Fe4 Mn4 N14 O26 -","- C74 H82 Fe4 Mn4 N14 O26 -","- C148 H164 Fe8 Mn8 N28 O52 -","2","0.5","","Nesterova, Oksana V.; Chygorin, Eduard N.; Kokozay, Vladimir N.; Omelchenko, Irina V.; Shishkin, Oleg V.; Boča, Roman; Pombeiro, Armando J. L.","A self-assembled octanuclear complex bearing the uncommon close-packed {Fe4Mn4(μ4-O)4(μ-O)4} molecular core.","Dalton transactions (Cambridge, England : 2003)","2015","44","33","14918","14924","10.1039/c5dt02076j","","x-ray","0.71073","MoKα","","0.1519","0.0714","","","0.1448","0.1703","","","","","","0.921","","","","has coordinates","161845","2020-10-21","18:00:00",""
"7036112","9.52546","0.00014","5.08862","0.00021","8.0901","0.00081","90","","90.8678","0.0057","90","","392.09","0.04","300","","300","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Cs Eu Mo2 O8 -","- Cs Eu Mo2 O8 -","- Cs2 Eu2 Mo4 O16 -","2","0.5","","Pinglu Shi; Zhiguo Xia; Molokeev Maxim; Victor Atuchin","Crystal Chemistry and Luminescent Properties of Red-Emitting CsGd1-xEux(MoO4)2 Solid-Solution Phosphors","Dalton Transactions","2014","43","25","9669","9676","10.1039/C4DT00339J","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.28","1.768","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"7036113","9.52564","0.00017","5.08836","0.00018","8.08806","0.00088","90","","90.9525","0.005","90","","391.97","0.05","300","","300","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- Cs2 Eu1.6 Gd0.4 Mo4 O16 -","- Cs2 Eu1.6 Gd0.4 Mo4 O16 -","- Cs2 Eu1.6 Gd0.4 Mo4 O16 -","1","0.25","","Pinglu Shi; Zhiguo Xia; Molokeev Maxim; Victor Atuchin","Crystal Chemistry and Luminescent Properties of Red-Emitting CsGd1-xEux(MoO4)2 Solid-Solution Phosphors","Dalton Transactions","2014","43","25","9669","9676","10.1039/C4DT00339J","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","0.92","1.644","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"7036114","9.5247","0.00014","5.08624","0.00023","8.0769","0.0012","90","","91.0231","0.0063","90","","391.22","0.06","300","","300","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- Cs2 Eu1.2 Gd0.8 Mo4 O16 -","- Cs2 Eu1.2 Gd0.8 Mo4 O16 -","- Cs2 Eu1.2 Gd0.8 Mo4 O16 -","1","0.25","","Pinglu Shi; Zhiguo Xia; Molokeev Maxim; Victor Atuchin","Crystal Chemistry and Luminescent Properties of Red-Emitting CsGd1-xEux(MoO4)2 Solid-Solution Phosphors","Dalton Transactions","2014","43","25","9669","9676","10.1039/C4DT00339J","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.379","1.769","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"7036115","9.52642","0.00021","5.08366","0.00023","8.07016","0.0008","90","","91.0845","0.006","90","","390.76","0.04","300","","300","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- Cs2 Eu0.8 Gd1.2 Mo4 O16 -","- Cs2 Eu0.8 Gd1.2 Mo4 O16 -","- Cs2 Eu0.8 Gd1.2 Mo4 O16 -","1","0.25","","Pinglu Shi; Zhiguo Xia; Molokeev Maxim; Victor Atuchin","Crystal Chemistry and Luminescent Properties of Red-Emitting CsGd1-xEux(MoO4)2 Solid-Solution Phosphors","Dalton Transactions","2014","43","25","9669","9676","10.1039/C4DT00339J","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.19","1.703","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"7036116","9.52609","0.00015","5.08097","0.00018","8.06233","0.00064","90","","91.1539","0.0055","90","","390.15","0.03","300","","300","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- Cs2 Eu0.4 Gd1.6 Mo4 O16 -","- Cs2 Eu0.4 Gd1.6 Mo4 O16 -","- Cs2 Eu0.4 Gd1.6 Mo4 O16 -","1","0.25","","Pinglu Shi; Zhiguo Xia; Molokeev Maxim; Victor Atuchin","Crystal Chemistry and Luminescent Properties of Red-Emitting CsGd1-xEux(MoO4)2 Solid-Solution Phosphors","Dalton Transactions","2014","43","25","9669","9676","10.1039/C4DT00339J","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","0.82","1.564","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"7036117","9.52748","0.00019","5.08068","0.00017","8.05913","0.00052","90","","91.192","0.0052","90","","390.03","0.03","300","","300","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- Cs2 Eu0.1 Gd1.9 Mo4 O16 -","- Cs2 Eu0.1 Gd1.9 Mo4 O16 -","- Cs2 Eu0.1 Gd1.9 Mo4 O16 -","1","0.25","","Pinglu Shi; Zhiguo Xia; Molokeev Maxim; Victor Atuchin","Crystal Chemistry and Luminescent Properties of Red-Emitting CsGd1-xEux(MoO4)2 Solid-Solution Phosphors","Dalton Transactions","2014","43","25","9669","9676","10.1039/C4DT00339J","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.24","1.691","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"7036118","9.52885","0.0002","5.0823","0.00023","8.05626","0.00072","90","","91.2458","0.0058","90","","390.06","0.04","300","","300","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Cs Gd Mo2 O8 -","- Cs Gd Mo2 O8 -","- Cs2 Gd2 Mo4 O16 -","2","0.5","","Pinglu Shi; Zhiguo Xia; Molokeev Maxim; Victor Atuchin","Crystal Chemistry and Luminescent Properties of Red-Emitting CsGd1-xEux(MoO4)2 Solid-Solution Phosphors","Dalton Transactions","2014","43","25","9669","9676","10.1039/C4DT00339J","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.39","1.888","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"7036550","14.466","0.0009","11.4063","0.0008","12.973","0.001","90","","96.727","0.005","90","","2125.9","0.3","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C18 H10 Cl2 N4 O6 Re2 -","- C18 H10 Cl2 N4 O6 Re2 -","- C72 H40 Cl8 N16 O24 Re8 -","4","1","","Hasheminasab, A.; Rhoda, H. M.; Crandall, L. A.; Ayers, J. T.; Nemykin, V. N.; Herrick, R. S.; Ziegler, C. J.","Hydrazine-mediated strongly coupled Re(CO)3 dimers.","Dalton transactions (Cambridge, England : 2003)","2015","44","39","17268","17277","10.1039/c5dt02821c","","","1.54178","CuKα","","0.0703","0.0577","","","0.1507","0.163","","","","","","1.016","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7036995","15.9322","0.0009","12.3743","0.0007","16.8816","0.0009","90","","117.435","0.001","90","","2953.9","0.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C27 H42 N3 Nd Si2 -","- C27 H42 N3 Nd Si2 -","- C108 H168 N12 Nd4 Si8 -","4","1","","Feng, Zhijun; Wei, Yun; Zhou, Shuangliu; Zhang, Guangchao; Zhu, Xiancui; Guo, Liping; Wang, Shaowu; Mu, Xiaolong","Reactivity of functionalized indoles with rare-earth metal amides. Synthesis, characterization and catalytic activity of rare-earth metal complexes incorporating indolyl ligands.","Dalton transactions (Cambridge, England : 2003)","2015","44","47","20502","20513","10.1039/c5dt03214h","","","0.71073","MoKα","","0.0483","0.0276","","","0.0598","0.0666","","","","","","1.048","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7037095","15.2083","0.0005","9.1886","0.0003","27.5808","0.0008","90","","93.94","0.003","90","","3845.1","0.2","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C38 H48 Cd2 N4 O10 -","- C38 H48 Cd2 N4 O10 -","- C152 H192 Cd8 N16 O40 -","4","1","","Yang, Jin-Xia; Zhai, Ji-Quan; Zhang, Xin; Qin, Ye-Yan; Yao, Yuan-Gen","Tuning different kinds of entangled metal-organic frameworks by modifying the spacer group of aliphatic dicarboxylate ligands and the reactant ratio.","Dalton transactions (Cambridge, England : 2003)","2015","45","2","711","723","10.1039/c5dt03731j","","","0.71073","MoKα","","0.046","0.0309","","","0.0671","0.0747","","","","","","1.018","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7037167","13.574","0.0014","9.1261","0.0011","22.833","0.003","90","","102.45","0.01","90","","2762","0.6","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C50 H45 Cl2 Mn2 N5 O4 -","- C48 H42 Cl2 Mn2 N4 O4 -","- C96 H84 Cl4 Mn4 N8 O8 -","2","0.5","","Yang, Wenxue; Zhao, Ke-Qing; Wang, Bi-Qin; Redshaw, Carl; Elsegood, Mark R. J.; Zhao, Jiang-Lin; Yamato, Takehiko","Manganese coordination chemistry of bis(imino)phenoxide derived [2 + 2] Schiff-base macrocyclic ligands.","Dalton transactions (Cambridge, England : 2003)","2015","45","1","226","236","10.1039/c5dt03453a","","","0.71073","MoKα","","0.0838","0.053","","","0.1052","0.1179","","","","","","0.921","","","","has coordinates,has disorder","176110","2020-10-21","18:00:00",""
"7037286","13.7879","0.0004","8.6473","0.0002","22.5638","0.0006","90","","95.0326","0.0012","90","","2679.87","0.12","180","2","180","2","","","","","","","","9","P 1 2/c 1","-P 2yc","13","","","","- C23 H26 Cl F3 Fe N3 O4 P S -","- C23 H26 Cl F3 Fe N3 O4 P S -","- C92 H104 Cl4 F12 Fe4 N12 O16 P4 S4 -","4","1","","Hanf, Schirin; García-Rodríguez, Raúl; Bond, Andrew D.; Hey-Hawkins, Evamarie; Wright, Dominic S.","Sterically-constrained tripodal phosphorus-bridged tris-pyridyl ligands.","Dalton transactions (Cambridge, England : 2003)","2015","45","1","276","283","10.1039/c5dt04155d","","","1.54178","CuKα","","0.0424","0.0359","","","0.0889","0.0935","","","","","","1.06","","","","has coordinates,has disorder","176114","2020-10-21","18:00:00",""
"7037544","19.851","0.004","6.3428","0.0013","8.0146","0.0017","90","","99.773","0.003","90","","994.5","0.4","296","2","296","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C22 H20 Co O7 -","- C22 H20 Co O7 -","- C44 H40 Co2 O14 -","2","0.5","","Liu, Zhong-Yi; Xia, Yan-Fei; Jiao, Jiao; Yang, En-Cui; Zhao, Xiao-Jun","Two water-bridged cobalt(ii) chains with isomeric naphthoate spacers: from metamagnetic to single-chain magnetic behaviour.","Dalton transactions (Cambridge, England : 2003)","2015","44","46","19927","19934","10.1039/c5dt03297k","","","0.71073","MoKα","","0.0326","0.0287","","","0.0718","0.074","","","","","","1.062","","","","has coordinates","170864","2020-10-21","18:00:00",""
"7037965","16.2237","0.0005","15.7371","0.0004","21.8522","0.0007","90","","109","0.002","90","","5275.2","0.3","100","","100","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C22 H22 Cl2 F6 Ir N2 O0.5 -","- C22 H22 Cl2 F6 Ir N2 O0.5 -","- C176 H176 Cl16 F48 Ir8 N16 O4 -","8","2","","Sasayama, A. F.; Moore, C. E.; Kubiak, C. P.","Electronic effects on the catalytic disproportionation of formic acid to methanol by [Cp*Ir(III)(R-bpy)Cl]Cl complexes.","Dalton transactions (Cambridge, England : 2003)","2016","45","6","2436","2439","10.1039/c5dt04606h","","x-ray","0.71073","MoKα","","0.0509","0.0338","","","0.0712","0.0788","","","","","","1.02","","","","has coordinates","177817","2020-10-21","18:00:00",""
"7038056","13.8887","0.0003","11.736","0.0003","24.6902","0.0007","90","","103.731","0.003","90","","3909.43","0.18","253","2","253","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C70 H116 La2 N6 O6 Si4 -","- C70 H116 La2 N6 O6 Si4 -","- C140 H232 La4 N12 O12 Si8 -","2","0.5","","Zhao, Bei; Xiao, Yang; Yuan, Dan; Lu, Chengrong; Yao, Yingming","Synthesis and characterization of bridged bis(amidato) rare earth metal amides and their applications in C-N bond formation reactions.","Dalton transactions (Cambridge, England : 2003)","2016","45","9","3880","3887","10.1039/c5dt04217h","","","0.71073","MoKα","","0.0542","0.0412","","","0.1089","0.1167","","","","","","1.083","","","","has coordinates","177852","2020-10-21","18:00:00",""
"7038167","43.7247","0.0005","12.93615","0.00017","8.49651","0.00012","90","","94.3334","0.0012","90","","4792.14","0.11","200","","200","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","complex-Pr","","- C36 H36 O12 Pr -","- C36 H36 O12.002 Pr -","- C144 H144 O48.008 Pr4 -","4","1","","Liu, Xiaobin; Lin, Huan; Xiao, Zhenyu; Fan, Weidong; Huang, Ao; Wang, Rongming; Zhang, Liangliang; Sun, Daofeng","Multifunctional lanthanide-organic frameworks for fluorescent sensing, gas separation and catalysis.","Dalton transactions (Cambridge, England : 2003)","2016","45","9","3743","3749","10.1039/c5dt04339e","","","0.71","MoKα","","0.0727","0.0694","","","0.1844","0.1866","","","","","","1.053","","","","has coordinates,has disorder","177866","2020-10-21","18:00:00",""
"7038289","16.9811","0.0004","11.3326","0.0003","20.1037","0.0006","90","","105.433","0.001","90","","3729.26","0.17","200","2","200","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","bis(4-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(pyridin-2-yl)-6-methylpyrimidine)-iron(ii) bis(tetrafluoroborate) ethanol hydrate","","- C32 H38 B2 F8 Fe N10 O2 -","- C32 H36 B2 F8 Fe N10 O2 -","- C128 H144 B8 F32 Fe4 N40 O8 -","4","1","","Bushuev, Mark B.; Pishchur, Denis P.; Logvinenko, Vladimir A.; Gatilov, Yuri V.; Korolkov, Ilya V.; Shundrina, Inna K.; Nikolaenkova, Elena B.; Krivopalov, Viktor P.","A mononuclear iron(ii) complex: cooperativity, kinetics and activation energy of the solvent-dependent spin transition.","Dalton transactions (Cambridge, England : 2003)","2015","45","1","107","120","10.1039/c5dt03750f","","","0.71073","MoKα","","0.0672","0.0513","","","0.1528","0.1744","","","","","","0.943","","","","has coordinates,has disorder","175854","2020-10-21","18:00:00",""
"7038397","22.748","0.006","10.942","0.003","21.315","0.005","90","","108.438","0.006","90","","5033","2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C52 H33 Dy F9 N2 O6 -","- C52 H33 Dy F9 N2 O6 -","- C208 H132 Dy4 F36 N8 O24 -","4","1","","Zhang, Sheng; Ke, Hongshan; Shi, Quan; Zhang, Jangwei; Yang, Qi; Wei, Qing; Xie, Gang; Wang, Wenyuan; Yang, Desuo; Chen, Sanping","Dysprosium(iii) complexes with a square-antiprism configuration featuring mononuclear single-molecule magnetic behaviours based on different β-diketonate ligands and auxiliary ligands.","Dalton transactions (Cambridge, England : 2003)","2016","45","12","5310","5320","10.1039/c6dt00219f","","","0.71073","MoKα","","0.1265","0.059","","","0.1358","0.1741","","","","","","1.036","","","","has coordinates","181669","2020-10-21","18:00:00",""
"7038617","17.778","0.004","8.5035","0.0017","17.534","0.004","90","","96.61","0.03","90","","2633.1","1","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C24 H32 Cl Mn N4 O8 -","- C24 H32 Cl Mn N4 O8 -","- C96 H128 Cl4 Mn4 N16 O32 -","4","1","","Wang, Shi; Xu, Wu-Tan; He, Wen-Rui; Takaishi, Shinya; Li, Yong-Hua; Yamashita, Masahiro; Huang, Wei","Structural insights into the counterion effects on the manganese(iii) spin crossover system with hexadentate Schiff-base ligands.","Dalton transactions (Cambridge, England : 2003)","2016","45","13","5676","5688","10.1039/c5dt04824a","","","0.71073","MoKα","","0.1171","0.0985","","","0.2071","0.2181","","","","","","1.126","","","","has coordinates","181646","2020-10-21","18:00:00",""
"7038618","17.925","0.004","8.5661","0.0017","17.723","0.004","90","","96.05","0.03","90","","2706.2","1","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C24 H32 Cl Mn N4 O8 -","- C24 H32 Cl Mn N4 O8 -","- C96 H128 Cl4 Mn4 N16 O32 -","4","1","","Wang, Shi; Xu, Wu-Tan; He, Wen-Rui; Takaishi, Shinya; Li, Yong-Hua; Yamashita, Masahiro; Huang, Wei","Structural insights into the counterion effects on the manganese(iii) spin crossover system with hexadentate Schiff-base ligands.","Dalton transactions (Cambridge, England : 2003)","2016","45","13","5676","5688","10.1039/c5dt04824a","","","0.71073","MoKα","","0.1151","0.0798","","","0.2196","0.2544","","","","","","1.097","","","","has coordinates","181646","2020-10-21","18:00:00",""
"7038666","24.8983","0.0005","12.6591","0.0002","44.0778","0.0011","90","","104.574","0.002","90","","13445.9","0.5","99.9","0.5","99.9","0.5","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C47 H82 Ce Cl4 Co2 I2 O20 P6 -","- C47 H82 Ce Cl4 Co2 I2 O20 P6 -","- C376 H656 Ce8 Cl32 Co16 I16 O160 P48 -","8","2","","Au-Yeung, Ka-Chun; So, Yat-Ming; Wang, Guo-Cang; Sung, Herman H.-Y.; Williams, Ian D.; Leung, Wa-Hung","Iodosylbenzene and iodylbenzene adducts of cerium(iv) complexes bearing chelating oxygen ligands.","Dalton transactions (Cambridge, England : 2003)","2016","45","13","5434","5438","10.1039/c6dt00267f","","x-ray","0.71073","MoKα","","0.1086","0.0582","","","0.1058","0.1259","","","","","","1.003","","","","has coordinates,has disorder","181635","2020-10-21","18:00:00",""
"7038762","9.054","0.004","11.097","0.005","11.481","0.005","90","","113.25","0.03","90","","1059.8","0.8","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C17 H20 Cu N2 O8 P2 -","- C17 H20 Cu N2 O8 P2 -","- C34 H40 Cu2 N4 O16 P4 -","2","0.5","","Hou, Xiaomin; Tang, Si-Fu","Speciation of metal phosphonates with the assistance of weak interactions.","Dalton transactions (Cambridge, England : 2003)","2016","45","17","7349","7359","10.1039/c6dt00643d","","","0.71073","MoKα","","0.0594","0.0377","","","0.0813","0.0888","","","","","","1.048","","","","has coordinates,has disorder","182737","2020-10-21","18:00:00",""
"7038824","24.5626","0.0002","6.7022","0.0001","31.2584","0.0003","90","","95.08","","90","","5125.65","0.1","100","2","100.05","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","ditBuBrSalphNi","N-(3,5-ditert-Butylsalicyliden)-N'-(5-pinacolboronylsalicyliden)-phenylendiaminatonickel(II)","","- C28 H29 Br N2 Ni O2 -","- C28 H29 Br N2 Ni O2 -","- C224 H232 Br8 N16 Ni8 O16 -","8","2","","Bugenhagen, B. E. C.; Prosenc, M. H.","Direct C-C coupling of two Ni-salphen complexes to yield dinickel-disalphen complexes with symmetric and non-symmetric substitution-patterns.","Dalton transactions (Cambridge, England : 2003)","2016","45","17","7460","7468","10.1039/c5dt04612b","","","0.71073","MoKα","","0.0483","0.0316","","","0.0776","0.0847","","","","","","1.016","","","","has coordinates","182755","2020-10-21","18:00:00",""
"7038978","14.052","0.0015","9.0526","0.001","26.357","0.003","90","","98.553","0.002","90","","3315.5","0.6","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C17 H1.96 B F6.04 O18.96 Tc5 -","- C17 H1.97 B F6.03 O18.97 Tc5 -","- C68 H7.88 B4 F24.12 O75.88 Tc20 -","4","1","","Stepanova, E. S.; Gurzhiy, V. V.; Tyupina, M. Yu; Miroslavov, A. E.; Sidorenko, G. V.; Lumpov, A. A.","Does [TcF(CO)5] exist? The crystal and molecular structure of [Tc(CO)3(OH)0.49F0.51]4·[Tc(CO)5(BF4)].","Dalton transactions (Cambridge, England : 2003)","2016","45","20","8428","8432","10.1039/c6dt00958a","","","0.71","MoKα","","0.0343","0.0282","","","0.0691","0.071","","","","","","1.032","","","","has coordinates","185426","2020-10-21","18:00:00",""
"7039123","12.0101","0.0005","5.6681","0.0002","20.4103","0.0008","90","","90.425","0.004","90","","1389.38","0.09","150.87","0.1","150.87","0.1","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C8 H24 F1.33 Mn2 N2.67 O12 S2.67 -","- C8 H24 F1.33333 Mn2 N2.66667 O12 S2.66667 -","- C24 H72 F4 Mn6 N8 O36 S8 -","3","0.75","","Marshall, Kayleigh L.; Wang, Qianlong; Sullivan, Hannah S. I.; Weller, Mark T.","Synthesis and structural characterisation of transition metal fluoride sulfates.","Dalton transactions (Cambridge, England : 2003)","2016","45","21","8854","8861","10.1039/c6dt00582a","","","1.54184","CuKα","","0.0294","0.0256","","","0.0591","0.0604","","","","","","1.003","","","","has coordinates","185451","2020-10-21","18:00:00",""
"7039289","26.3261","0.0013","10.5969","0.0004","26.0751","0.0011","90","","105.305","0.002","90","","7016.3","0.5","100","2","100","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C19 H22 Al N O2 -","- C19 H22 Al N O2 -","- C304 H352 Al16 N16 O32 -","16","4","","Sumrit, Pattarawut; Chuawong, Pitak; Nanok, Tanin; Duangthongyou, Tanwawan; Hormnirun, Pimpa","Aluminum complexes containing salicylbenzoxazole ligands and their application in the ring-opening polymerization of rac-lactide and ε-caprolactone.","Dalton transactions (Cambridge, England : 2003)","2016","45","22","9250","9266","10.1039/c6dt00990e","","","0.71073","MoKα","","0.097","0.0512","","","0.1201","0.1431","","","","","","1.031","","","","has coordinates","185305","2020-10-21","18:00:00",""
"7039346","9.4536","0.0003","9.3089","0.0003","18.4419","0.0007","90","","91.025","0.002","90","","1622.68","0.1","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C26 H44 Cl N9 Ni O4 -","- C26 H44 Cl N9 Ni O4 -","- C52 H88 Cl2 N18 Ni2 O8 -","2","0.5","","Ghosh, Somnath; Deka, Hemanta; Dangat, Yuvraj B.; Saha, Soumen; Gogoi, Kuldeep; Vanka, Kumar; Mondal, Biplab","Reductive nitrosylation of nickel(ii) complex by nitric oxide followed by nitrous oxide release.","Dalton transactions (Cambridge, England : 2003)","2016","45","25","10200","10208","10.1039/c6dt00826g","","","0.71073","MoKα","","0.0668","0.0599","","","0.1572","0.1596","","","","","","1.069","","","","has coordinates","185371","2020-10-21","18:00:00",""
"7039460","16.847","0.003","16.642","0.003","24.017","0.005","90","","101.64","0.03","90","","6595","2","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C42 H28 La3 N21 O29 -","- C42 H28 La3 N21 O29 -","- C168 H112 La12 N84 O116 -","4","1","","Zhao, Qiang; Liu, Xiu-Ming; Li, Huan-Rong; Zhang, Ying-Hui; Bu, Xian-He","High-performance fluorescence sensing of lanthanum ions (La(3+)) by a polydentate pyridyl-based quinoxaline derivative.","Dalton transactions (Cambridge, England : 2003)","2016","45","26","10836","10841","10.1039/c6dt01161f","","","0.71073","MoKα","","0.1287","0.0833","","","0.1813","0.2018","","","","","","1.085","","","","has coordinates,has disorder","185346","2020-10-21","18:00:00",""
"7039575","14.2041","0.0006","10.6502","0.0004","16.5585","0.0006","90","","95.337","0.004","90","","2494.05","0.17","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C44 H64 Cl2 Co N4 O5 -","- C44 H64 Cl2 Co N4 O5 -","- C88 H128 Cl4 Co2 N8 O10 -","2","0.5","","Deka, Hemanta; Ghosh, Somnath; Saha, Soumen; Gogoi, Kuldeep; Mondal, Biplab","Effect of ligand denticity on the nitric oxide reactivity of cobalt(ii) complexes.","Dalton transactions (Cambridge, England : 2003)","2016","45","27","10979","10988","10.1039/c6dt01169a","","","0.71073","MoKα","","0.0832","0.0654","","","0.2062","0.2232","","","","","","1.154","","","","has coordinates","185403","2020-10-21","18:00:00",""
"7039702","15.2606","0.0007","6.7476","0.0003","19.2173","0.0009","90","","96.6167","0.0018","90","","1965.67","0.16","100","2","100","2","","","","","","","synthetical product","5","P 1 2/c 1","-P 2yc","13","bis(2,4-di-tert-butyl-6-[(E)-(3-(methoxy)propylimino)methyl]-pheno-lato-N,O)-dioxo-molybdenum(VI)","bis(2,4-di-tert-butyl-6-[(E)-(3-(methoxy)propylimino)methyl]-pheno-lato-N,O)-dioxo-molybdenum(VI)","","- C38 H60 Mo N2 O6 -","- C38 H60 Mo N2 O6 -","- C76 H120 Mo2 N4 O12 -","2","0.5","","Zwettler, Niklas; Judmaier, Martina E.; Strohmeier, Lara; Belaj, Ferdinand; Mösch-Zanetti, Nadia C","Oxygen activation and catalytic aerobic oxidation by Mo(iv)/(vi) complexes with functionalized iminophenolate ligands.","Dalton transactions (Cambridge, England : 2003)","2016","45","37","14549","14560","10.1039/c6dt01692h","","","0.71073","MoKα","","0.0368","0.0313","","","0.0746","0.0772","","","","","","1.066","","","","has coordinates,has disorder","187142","2020-10-21","18:00:00",""
"7039802","12.8439","0.0017","9.3329","0.0013","14.231","0.002","90","","115.225","0.002","90","","1543.2","0.4","296","2","296.15","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H21 Co5 N8 O19.5 S2 -","- C20 H18 Co5 N8 O19.5 S2 -","- C40 H36 Co10 N16 O39 S4 -","2","0.5","","Zhang, Chao; Liu, Zhong-Yi; Liu, Ning; Zhao, Hong; Yang, En-Cui; Zhao, Xiao-Jun","Different magnetic responses observed in Co, Co and Co-based MOFs.","Dalton transactions (Cambridge, England : 2003)","2016","45","29","11864","11875","10.1039/c6dt01587e","","","0.71073","MoKα","","0.0498","0.0333","","","0.0789","0.0846","","","","","","1.01","","","","has coordinates,has disorder","185489","2020-10-21","18:00:00",""
"7039803","12.8726","0.0008","9.2286","0.0006","14.0554","0.0008","90","","116.119","0.001","90","","1499.22","0.16","173","2","173.15","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H18.6 Co5 N6 O19.3 S2 -","- C20 H18 Co5 N6 O19.3 S2 -","- C40 H36 Co10 N12 O38.6 S4 -","2","0.5","","Zhang, Chao; Liu, Zhong-Yi; Liu, Ning; Zhao, Hong; Yang, En-Cui; Zhao, Xiao-Jun","Different magnetic responses observed in Co, Co and Co-based MOFs.","Dalton transactions (Cambridge, England : 2003)","2016","45","29","11864","11875","10.1039/c6dt01587e","","","0.71073","MoKα","","0.0325","0.0275","","","0.0626","0.0651","","","","","","1.036","","","","has coordinates,has disorder","185489","2020-10-21","18:00:00",""
"7040005","12.3901","0.0005","13.1679","0.0005","10.0278","0.0004","90","","94.152","0.004","90","","1631.76","0.11","110.01","0.1","110.01","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C8 H21 B10 Br N2 -","- C8 H21 B10 Br N2 -","- C32 H84 B40 Br4 N8 -","4","1","","Holmes, Jordan; Pask, Christopher M.; Willans, Charlotte E.","Chelating N-heterocyclic carbene-carboranes offer flexible ligand coordination to Ir(III), Rh(III) and Ru(II): effect of ligand cyclometallation in catalytic transfer hydrogenation.","Dalton transactions (Cambridge, England : 2003)","2016","45","40","15818","15827","10.1039/c6dt02079h","","x-ray","0.71073","MoKα","","0.0639","0.0461","","","0.0965","0.1062","","","","","","1.042","","","","has coordinates","188208","2020-10-21","18:00:00",""
"7040533","11","0.009","7.808","0.003","19.367","0.005","90","","104.43","0.02","90","","1610.9","1.5","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C31 H36 Cl4 N4 Pd2 -","- C31 H36 Cl4 N4 Pd2 -","- C62 H72 Cl8 N8 Pd4 -","2","0.5","","Rosar, V.; Dedeic, D.; Nobile, T.; Fini, F.; Balducci, G.; Alessio, E.; Carfagna, C.; Milani, B.","Palladium complexes with simple iminopyridines as catalysts for polyketone synthesis.","Dalton transactions (Cambridge, England : 2003)","2016","45","37","14609","14619","10.1039/c6dt02992b","","","0.7","synchrotron","","0.0217","0.0216","","","0.0578","0.0579","","","","","","1.215","","","","has coordinates","187149","2020-10-21","18:00:00",""
"7040914","18.1803","0.0009","12.7701","0.0005","15.0641","0.0008","90","","114.425","0.003","90","","3184.3","0.3","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C30 H24 N2 O8 Re2 S2 -","- C30 H24 N2 O8 Re2 S2 -","- C120 H96 N8 O32 Re8 S8 -","4","1","","Beltrán, Tomás F; Zaragoza, Guillermo; Delaude, Lionel","Synthesis, characterization, and gas-phase fragmentation of rhenium-carbonyl complexes bearing imidazol(in)ium-2-dithiocarboxylate ligands.","Dalton transactions (Cambridge, England : 2003)","2016","45","45","18346","18355","10.1039/c6dt03428d","","x-ray","0.7107","MoKα","","0.0313","0.0274","","","0.0637","0.0658","","","","","","1.08","","","","has coordinates","190152","2020-10-21","18:00:00",""
"7040938","28.4563","0.0005","8.6547","0.0002","16.6461","0.0004","90","","91.822","0.002","90","","4097.54","0.15","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C24 H33 Fe N -","- C24 H33 Fe N -","- C192 H264 Fe8 N8 -","8","2","","Roemer, Max; Skelton, Brian W.; Piggott, Matthew J.; Koutsantonis, George A.","1,1'-Diacetyloctamethylferrocene: an overlooked and overdue synthon leading to the facile synthesis of an octamethylferrocenophane.","Dalton transactions (Cambridge, England : 2003)","2016","45","47","18817","18821","10.1039/c6dt03820d","","x-ray","1.54184","CuKα","","0.0889","0.0578","","","0.1378","0.158","","","","","","1.043","","","","has coordinates,has disorder","190205","2020-10-21","18:00:00",""
"7041046","10.6251","0.0002","5.4088","0.0001","20.367","0.0003","90","","102.906","0.002","90","","1140.9","0.04","113","2","113.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C20 H38 N4 O2 Zn -","- C20 H38 N4 O2 Zn -","- C40 H76 N8 O4 Zn2 -","2","0.5","","O' Donoghue, Richard; Peeters, Daniel; Rogalla, Detlef; Becker, Hans-Werner; Rechmann, Julian; Henke, Sebastian; Winter, Manuela; Devi, Anjana","Systematic molecular engineering of Zn-ketoiminates for application as precursors in atomic layer depositions of zinc oxide.","Dalton transactions (Cambridge, England : 2003)","2016","45","47","19012","19023","10.1039/c6dt03571j","","","0.71073","MoKα","","0.0234","0.0222","","","0.0557","0.0563","","","","","","1.144","","","","has coordinates","190217","2020-10-21","18:00:00",""
"7041077","8.1737","0.0005","15.0092","0.001","37.574","0.002","90","","101.828","0.002","90","","4511.7","0.5","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C36 H43 Eu N7 O16 -","- C36 H43 Eu N7 O16 -","- C144 H172 Eu4 N28 O64 -","4","1","","Wang, Dongbo; Tan, Qinghua; Liu, Jingjuan; Liu, Zhiliang","A stable europium metal-organic framework as a dual-functional luminescent sensor for quantitatively detecting temperature and humidity.","Dalton transactions (Cambridge, England : 2003)","2016","45","46","18450","18454","10.1039/c6dt03812c","","","0.71073","MoKα","","0.1218","0.064","","","0.1437","0.1671","","","","","","1.033","","","","has coordinates","190102","2020-10-21","18:00:00",""
"7041223","21.6458","0.0009","18.2186","0.001","19.9733","0.0011","90","","112.479","0.002","90","","7278.1","0.7","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C353 H241 Cl3 N16 O20 Ti4 -","- C353 H232 Cl3 N16 O20 Ti4 -","- C353 H232 Cl3 N16 O20 Ti4 -","1","0.25","","Khalil, Georges; Orvain, Christophe; Fang, Lu; Barloy, Laurent; Chaumont, Alain; Gaiddon, Christian; Henry, Marc; Kyritsakas, Nathalie; Mobian, Pierre","Monomeric Ti(iv)-based complexes incorporating luminescent nitrogen ligands: synthesis, structural characterization, emission spectroscopy and cytotoxic activities.","Dalton transactions (Cambridge, England : 2003)","2016","45","47","19072","19085","10.1039/c6dt03477b","","","0.71073","MoKα","","0.1491","0.0912","","","0.2751","0.3117","","","","","","1.051","","","","has coordinates","190199","2020-10-21","18:00:00",""
"7041607","32.127","0.007","15.117","0.004","26.528","0.007","90","","92.984","0.004","90","","12866","6","93","","93","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C81 H96 Al3 N6 O59 P W12 -","- C81 H84 Al3 N6 O59 P W12 -","- C324 H336 Al12 N24 O236 P4 W48 -","4","1","","Kawahara, Ryosuke; Osuga, Ryota; Kondo, Junko N.; Mizuno, Noritaka; Uchida, Sayaka","Synergetic effect in heterogeneous acid catalysis by a porous ionic crystal based on Al(iii)-salphen and polyoxometalate.","Dalton transactions (Cambridge, England : 2003)","2017","46","10","3105","3109","10.1039/c6dt04552a","","","0.71075","MoKα","","0.1043","0.0782","","","0.1896","0.2066","","","","","","1.094","","","","has coordinates","195063","2020-10-21","18:00:00",""
"7042320","10.0074","0.0012","16.2272","0.0019","16.3038","0.0019","90","","103.748","0.002","90","","2571.8","0.5","90","2","90","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C81.3 H25.3 I4.23 N2 -","- C81.304 H25.304 I4.232 N2 -","- C162.608 H50.608 I8.464 N4 -","2","0.5","","Aghabali, Amineh; Jun, Sharon; Olmstead, Marilyn M.; Balch, Alan L.","Piperazine-functionalized C60 and diiodine or iodine monochloride as components in forming supramolecular assemblies.","Dalton transactions (Cambridge, England : 2003)","2017","46","11","3710","3715","10.1039/c7dt00026j","","","0.71073","MoKα","","0.0568","0.0485","","","0.1267","0.1338","","","","","","1.063","","","","has coordinates,has disorder","195106","2020-10-21","18:00:00",""
"7042508","6.752","0.0004","5.0649","0.0004","14.1529","0.0009","90","","92.18","0.006","90","","483.65","0.06","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","disilver 1,1-dinitramino-5,5-bitetrazolate","disilver 1,1-dinitramino-5,5-bitetrazolate","","- C2 Ag2 N12 O4 -","- C2 Ag2 N12 O4 -","- C4 Ag4 N24 O8 -","2","0.5","","Szimhardt, Norbert; Bölter, Marc F; Born, Maximilian; Klapötke, Thomas M; Stierstorfer, Jörg","Metal salts and complexes of 1,1'-dinitramino-5,5'-bitetrazole.","Dalton transactions (Cambridge, England : 2003)","2017","46","15","5033","5040","10.1039/c7dt00536a","","x-ray","0.71073","MoKα","","0.0456","0.0333","","","0.071","0.0779","","","","","","1.053","","","","has coordinates","196459","2020-10-21","18:00:00",""
"7042557","5.677","0.005","9.524","0.007","5.485","0.004","90","","109.47","0.014","90","","279.6","0.4","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Co Na4 O6 Te -","- Co Na4 O6 Te -","- Co2 Na8 O12 Te2 -","2","0.5","","He, Zhangzhen; Guo, Wenbin; Cui, Meiyan; Tang, Yingying","Synthesis and magnetic properties of new tellurate compounds Na4MTeO6 (M = Co and Ni) with a ferromagnetic spin-chain structure.","Dalton transactions (Cambridge, England : 2003)","2017","46","15","5076","5081","10.1039/c6dt04750e","","","0.71073","MoKα","","0.0243","0.0222","","","0.0489","0.0493","","","","","","0.971","","","","has coordinates","196457","2020-10-21","18:00:00",""
"7042855","10.519","0.0005","7.2737","0.0006","10.4185","0.0005","90","","115.558","0.004","90","","719.14","0.08","180","2","180","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","1,1-dichlorosilacyclopentane","","- C4 H8 Cl2 Si -","- C4 H8 Cl2 Si -","- C16 H32 Cl8 Si4 -","4","1","","Wagler, Jörg; Gericke, Robert","Molecular structures of various alkyldichlorosilanes in the solid state","Dalton Trans.","2017","","","","","10.1039/C7DT00300E","","","0.71073","MoKα","","0.0376","0.0368","","","0.0966","0.0973","","","","","","1.132","","","","has coordinates","195902","2020-10-21","18:00:00",""
"7042929","14.29325","0.00019","14.06348","0.00014","14.8511","0.0002","90","","117.396","0.0017","90","","2650.46","0.07","120","","120","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C24 H26 Cl4 Cr2 N4 O2 -","- C24 H26 Cl4 Cr2 N4 O2 -","- C96 H104 Cl16 Cr8 N16 O8 -","4","1","","Brechin, Euan K.; Fraser, Hector; Nichol, Gary Stephen; Velmurugan, Gunasekaran; Rajaraman, Gopalan","Magneto-structural correlations in a family of dialkoxo bridged chromium dimers","Dalton Trans.","2017","","","","","10.1039/C7DT01197K","","x-ray","1.54178","CuKα","","0.0455","0.0428","","","0.1198","0.1227","","","","","","1.038","","","","has coordinates","196569","2020-10-21","18:00:00",""
"7043328","14.061","0.0008","8.927","0.0003","19.162","0.0009","90","","129.338","0.002","90","","1860.28","0.16","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C42 H52 N6 O2 Zn -","- C42 H52 N6 O2 Zn -","- C84 H104 N12 O4 Zn2 -","2","0.5","","Leszczyński, Michał Krzysztof; Justyniak, Iwona; Zelga, Karolina; Lewinski, Janusz","From ethylzinc guanidinate to [Zn10O4]-supertetrahedron","Dalton Trans.","2017","","","","","10.1039/C7DT01619K","","","0.71073","MoKα","","0.0632","0.0518","","","0.1181","0.1255","","","","","","1.074","","","","has coordinates","197837","2020-10-21","18:00:00",""
"7043400","13.6901","0.0003","8.6914","0.0002","27.0435","0.0005","90","","92.465","0.001","90","","3214.82","0.12","133","2","133","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H72 Li4 N4 Si8 -","- C24 H72 Li4 N4 Si8 -","- C48 H144 Li8 N8 Si16 -","2","0.5","","Westerhausen, Matthias; Koch, Alexander; Görls, Helmar; Krieck, Sven","Coordination Behavior of Bidentate Bis(carbenes) at Alkali Metal Bis(trimethylsilyl)amides","Dalton Trans.","2017","","","","","10.1039/C7DT01538K","","","0.71073","MoKα","","0.0879","0.0849","","","0.2487","0.2515","","","","","","1.115","","","","has coordinates","198105","2020-10-21","18:00:00",""
"7043708","9.9","0.005","15.969","0.005","7.269","0.005","90","","106.527","0.005","90","","1101.7","1","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C14 H14 Cd N6 O6 S -","- C14 H14 Cd N6 O6 S -","- C28 H28 Cd2 N12 O12 S2 -","2","0.5","","Chand, Santanu; Elahi, Syed Meheboob; Pal, Arun; Das, Madhab C.","A new set of Cd(ii)-coordination polymers with mixed ligands of dicarboxylate and pyridyl substituted diaminotriazine: selective sorption towards CO2 and cationic dyes","Dalton Trans.","2017","","","","","10.1039/C7DT01657C","","","0.71069","MoKα","","0.0391","0.0294","","","0.0722","0.0749","","","","","","1.062","","","","has coordinates","198815","2020-10-21","18:00:00",""
"7044468","8.0717","0.0003","16.6471","0.0006","19.9993","0.0007","90","","109.831","0.003","90","","2527.95","0.17","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C59 H38 Eu2 N6 O14 -","- C59 H38 Eu2 N6 O14 -","- C118 H76 Eu4 N12 O28 -","2","0.5","","Qin, Jian-Hua; Wang, Huarui; Han, Min-Le; chang, Xin-Hong; ma, lufang","pH-stable Eu- and Tb-organic-frameworks mediated by ionic liquid for aqueous-phase detection of 2,4,6-trinitrophenol (TNP)","Dalton Trans.","2017","","","","","10.1039/C7DT03433D","","","0.71073","MoKα","","0.0399","0.0294","","","0.0586","0.0633","","","","","","1.027","","","","has coordinates","202013","2020-10-21","18:00:00",""
"7044469","8.0636","0.0008","16.5777","0.0017","20.0148","0.0019","90","","110.015","0.003","90","","2513.9","0.4","296","2","296.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C59 H38 N6 O14 Tb2 -","- C59 H38 N6 O14 Tb2 -","- C118 H76 N12 O28 Tb4 -","2","0.5","","Qin, Jian-Hua; Wang, Huarui; Han, Min-Le; chang, Xin-Hong; ma, lufang","pH-stable Eu- and Tb-organic-frameworks mediated by ionic liquid for aqueous-phase detection of 2,4,6-trinitrophenol (TNP)","Dalton Trans.","2017","","","","","10.1039/C7DT03433D","","","0.71073","MoKα","","0.0515","0.0433","","","0.091","0.0938","","","","","","1.194","","","","has coordinates","202013","2020-10-21","18:00:00",""
"7044606","15.7907","0.00012","14.73004","0.00009","22.03564","0.00018","90","","100.299","0.0008","90","","5042.86","0.07","100","0.1","100","0.1","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C54 H42 Cl F7 O6 P3 S2 -","- C54 H42 Cl F7 O6 P3 S2 -","- C216 H168 Cl4 F28 O24 P12 S8 -","4","1","","Yogendra, S.; Hennersdorf, F.; Bauzá, A.; Frontera, A.; Fischer, R.; Weigand, J. J.","Donor‒acceptor interactions in tri(phosphonio)methanide dications [(Ph3P)2CP(X)Ph2]2+ (X = H, Me, CN, NCS, OH, Cl, OTf, F)","Dalton Transactions","2017","","","","","10.1039/C7DT03271D","","x-ray","1.54184","CuKα","","0.0604","0.0545","","","0.1865","0.1937","","","","","","1.161","","","","has coordinates,has disorder","202508","2020-10-21","18:00:00",""
"7044853","6.87202","0.00014","10.24603","0.00032","9.73888","0.00021","90","","128.918","0.002","90","","533.52","0.03","","","298","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","CAU-15 revised","CAU-15 revised","- C8 Al2 O8.71 -","- C8 Al2 O8.7102 -","- C16 Al4 O17.4204 -","2","0.5","","Heidenreich, Niclas; Lieb, Alexandra; Stock, Norbert; Reinsch, Helge","Green synthesis of a new layered aluminium citraconate: crystal structures, intercalation behaviour towards H<sub>2</sub>O and in situ PXRD studies of its crystallisation.","Dalton transactions (Cambridge, England : 2003)","2018","47","1","215","223","10.1039/c7dt04221c","","","1.5406","","","","","","","","","","","","","","","","","","has coordinates","229384","2020-10-21","18:00:00",""
"7045307","9.7372","0.001","6.7953","0.0007","22.715","0.003","90","","98.023","0.002","90","","1488.3","0.3","130","","130","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C9 H22 B10 O -","- C9 H22 B10 O -","- C36 H88 B40 O4 -","4","1","","Cui, Chun-Xiao; Ren, Shikuo; Qiu, Zaozao; Xie, Zuowei","Synthesis of carborane-fused carbo- and heterocycles via zirconacyclopentane intermediates.","Dalton transactions (Cambridge, England : 2003)","2018","47","7","2453","2459","10.1039/c7dt04751g","","","0.71073","MoKα","","0.0733","0.0598","","","0.1574","0.1666","","","","","","1.083","","","","has coordinates","229781","2020-10-21","18:00:00",""
"7045447","11.491","0.002","10.2132","0.0018","12.425","0.003","90","","121.58","0.008","90","","1242.3","0.4","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- B7 K9 La3 Li3 O21 -","- B7 K9 La3 Li3 O21 -","- B14 K18 La6 Li6 O42 -","2","0.5","","Ma, Ruru; Yang, Yun; Hu, Cong; Dong, Xiaoyu; Yang, Zhihua; Pan, Shilie","LiCs<sub>2</sub>La(BO<sub>3</sub>)<sub>2</sub> and Li<sub>3</sub>K<sub>9</sub>La<sub>3</sub>(BO<sub>3</sub>)<sub>7</sub>: new mixed alkali metal lanthanum borates with three-dimensional open frameworks and short cut-off edges.","Dalton transactions (Cambridge, England : 2003)","2018","47","10","3512","3520","10.1039/c7dt04830k","","","0.71073","MoKα","","0.0228","0.0197","","","0.0461","0.0478","","","","","","1.052","","","","has coordinates","229243","2020-10-21","18:00:00",""
"7045829","52.668","0.003","18.1007","0.0006","32.7146","0.0017","90","","106.632","0.006","90","","29883","3","150","","150","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C100 H132 Eu4 N16 O40 -","- C100 H132 Eu4 N16 O40 -","- C800 H1056 Eu32 N128 O320 -","8","2","","Junker, Anne Kathrine R.; Hill, Leila R.; Thompson, Amber L.; Faulkner, Stephen; Sørensen, Thomas Just","Shining light on the antenna chromophore in lanthanide based dyes.","Dalton transactions (Cambridge, England : 2003)","2018","47","14","4794","4803","10.1039/C7DT04788F","","","1.54184","CuKα","","0.2314","0.1773","","0.279","0.2135","0.1812","","","","","","1.1332","","","","has coordinates","229763","2020-10-21","18:00:00",""
"7045910","10.852","0.0008","6.7781","0.0007","16.9837","0.0014","90","","107.081","0.009","90","","1194.15","0.19","295","2","295","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C22 H24 Co N10 -","- C22 H24 Co N10 -","- C44 H48 Co2 N20 -","2","0.5","","Switlicka, A.; Machura, B.; Kruszynski, R.; Cano, J.; Toma, L. M.; Lloret, F.; Julve, M.","The influence of pseudohalide ligands on the SIM behaviour of four-coordinate benzylimidazole-containing cobalt(ii) complexes.","Dalton transactions (Cambridge, England : 2003)","2018","47","16","5831","5842","10.1039/c7dt04735e","","","0.71073","MoKα","","0.0612","0.0418","","","0.1026","0.1109","","","","","","1.079","","","","has coordinates","229615","2020-10-21","18:00:00",""
"7046162","13.6373","0.0009","15.8049","0.0011","16.0311","0.0013","90","","108.194","0.008","90","","3282.5","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C35 H25 N5 O10 Zn2 -","- C35 H25 N5 O10 Zn2 -","- C140 H100 N20 O40 Zn8 -","4","1","","Gu, Jin-Zhong; Cai, Yan; Qian, Zi-Yue; Wen, Min; Shi, Zi-Fa; Lv, Dong-Yu; Kirillov, Alexander M.","A new series of Co, Ni, Zn, and Cd metal-organic architectures driven by an unsymmetrical biphenyl-tricarboxylic acid: hydrothermal assembly, structural features and properties.","Dalton transactions (Cambridge, England : 2003)","2018","47","22","7431","7444","10.1039/c8dt01299g","","","0.71073","MoKα","","0.1285","0.0751","","","0.1551","0.2019","","","","","","1.062","","","","has coordinates","229256","2020-10-21","18:00:00",""
"7046463","15.709","0.003","9.8734","0.0016","21.052","0.004","90","","107.544","0.004","90","","3113.3","1","113","2","113.3","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C52 H48 N4 O17 Sm2 -","- C52 H48 N4 O17 Sm2 -","- C104 H96 N8 O34 Sm4 -","2","0.5","","Li, Hui; Liu, Hong-Bin; Tao, Xiao-Min; Su, Jian; Ning, Ping-Fan; Xu, Xiu-Fang; Zhou, Yu; Gu, Wen; Liu, Xin","Novel single component tri-rare-earth emitting MOF for warm white light LEDs.","Dalton transactions (Cambridge, England : 2003)","2018","47","25","8427","8433","10.1039/c8dt01477a","","","0.71073","MoKα","","0.0421","0.035","","","0.1156","0.1224","","","","","","1.021","","","","has coordinates","229667","2020-10-21","18:00:00",""
"7046464","15.7583","0.0013","9.7867","0.001","20.955","0.0018","90","","108.1","0.003","90","","3071.8","0.5","113","2","113.3","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C52 H48 Dy2 N4 O17 -","- C52 H48 Dy2 N4 O17 -","- C104 H96 Dy4 N8 O34 -","2","0.5","","Li, Hui; Liu, Hong-Bin; Tao, Xiao-Min; Su, Jian; Ning, Ping-Fan; Xu, Xiu-Fang; Zhou, Yu; Gu, Wen; Liu, Xin","Novel single component tri-rare-earth emitting MOF for warm white light LEDs.","Dalton transactions (Cambridge, England : 2003)","2018","47","25","8427","8433","10.1039/c8dt01477a","","","0.71073","MoKα","","0.0326","0.0298","","","0.088","0.0896","","","","","","1.091","","","","has coordinates","229667","2020-10-21","18:00:00",""
"7046465","15.7666","0.0014","9.7926","0.0008","20.9867","0.0019","90","","107.985","0.002","90","","3081.9","0.5","113","2","113.3","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C52 H48 N4 O17 Tb2 -","- C52 H48 N4 O17 Tb2 -","- C104 H96 N8 O34 Tb4 -","2","0.5","","Li, Hui; Liu, Hong-Bin; Tao, Xiao-Min; Su, Jian; Ning, Ping-Fan; Xu, Xiu-Fang; Zhou, Yu; Gu, Wen; Liu, Xin","Novel single component tri-rare-earth emitting MOF for warm white light LEDs.","Dalton transactions (Cambridge, England : 2003)","2018","47","25","8427","8433","10.1039/c8dt01477a","","","0.71073","MoKα","","0.0326","0.0298","","","0.088","0.0896","","","","","","1.09","","","","has coordinates","229667","2020-10-21","18:00:00",""
"7046527","19.114","0.003","8.8747","0.0015","20.401","0.003","90","","117.105","0.004","90","","3080.6","0.8","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C5 H11 Cs O -","- C5 H11 Cs O -","- C80 H176 Cs16 O16 -","16","4","","Kaiser, Maximillian; Klett, Jan","The hetero-cubane structures of the heavy alkali metal tert-amyloxides [MOCMe<sub>2</sub>Et]<sub>4</sub> (M = K, Rb, Cs).","Dalton transactions (Cambridge, England : 2003)","2018","47","36","12582","12586","10.1039/c8dt01545g","","","0.71073","MoKα","","0.0965","0.0695","","","0.209","0.2364","","","","","","1.151","","","","has coordinates,has disorder","229926","2020-10-21","18:00:00",""
"7046910","23.978","0.0005","18.693","0.0002","23.8266","0.0004","90","","97.097","0.002","90","","10597.8","0.3","150","0.1","150","0.1","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C50.25 H48.5 B2 Cl2.5 N8 P2 Rh2 -","- C50.25 H48.5 B2 Cl2.5 N8 P2 Rh2 -","- C402 H388 B16 Cl20 N64 P16 Rh16 -","8","2","","Barnett, Harrison J.; Burt, Liam K.; Hill, Anthony F.","Simple generation of a dirhodium μ-carbido complex via thiocarbonyl reduction.","Dalton transactions (Cambridge, England : 2003)","2018","47","29","9570","9574","10.1039/c8dt02524j","","x-ray","0.71073","MoKα","","0.1103","0.0865","","","0.2064","0.2265","","","","","","1.116","","","","has coordinates,has disorder","229165","2020-10-21","18:00:00",""
"7047176","21.69","0.004","12.031","0.002","13.804","0.003","90","","99.9","0.03","90","","3548.5","1.2","153","2","153","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C52 H40 Cu5 I7 N4 O14 Tb -","- C52 H40 Cu5 I7 N4 O14 Tb -","- C104 H80 Cu10 I14 N8 O28 Tb2 -","2","0.5","","Liu, Jian-Jun; Xiang, Zheng; Guan, Ying-Fang; Huang, Chang-Cang; Lin, Mei-Jin","Two novel donor-acceptor hybrid heterostructures with enhanced visible-light photocatalytic properties.","Dalton transactions (Cambridge, England : 2003)","2018","47","35","12041","12045","10.1039/c8dt02675k","","","0.71073","MoKα","","0.0777","0.0663","","","0.2038","0.214","","","","","","1.108","","","","has coordinates","229951","2020-10-21","18:00:00",""
"7047328","11.9218","0.0012","9.8442","0.001","12.5378","0.0012","90","","101.924","0.003","90","","1439.7","0.2","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","Tetrabutylammonium uranyl oxyfluoride","","","- C16 H36 F7 N O7 U3 -","- C16 H36 F7 N O7 U3 -","- C32 H72 F14 N2 O14 U6 -","2","0.5","","Yue, Zenghui; Lin, Jian; Silver, Mark Andrew; Han, Ling; Li, Xiaoyun; Zhou, Jing; Guo, Xiaojing; Bao, Hong-liang; Huang, Yuying; Wang, Jian-Qiang","Anionic Uranyl Oxyfluorides as a Bifunctional Platform for Highly Selective Ion-Exchange and Photocatalytic Degradation of Organic Dyes","Dalton Transactions","2018","","","","","10.1039/C8DT02309C","","","0.71073","MoKα","","0.0571","0.0342","","","0.0656","0.0709","","","","","","1.069","","","","has coordinates","210040","2020-10-21","18:00:00",""
"7047437","12.292","0.004","20.108","0.007","19.807","0.007","90","0.006","104.488","0.006","90","","4740","3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H18 Cd N5 O4 -","- C24 H18 Cd N5 O4 -","- C96 H72 Cd4 N20 O16 -","4","1","","Zhang, Da-Shuai; Zhang, Yong-Zheng; Gao, Jun; Liu, Hui-Ling; Hu, Hui; Geng, Long-Long; Zhang, Xiuling; Li, Yun-Wu","Structure modulation from unstable to stable MOFs by regulating secondary N-donor ligands.","Dalton transactions (Cambridge, England : 2003)","2018","47","39","14025","14032","10.1039/c8dt02858c","","","0.71069","MoKα","","0.0982","0.0569","","","0.1592","0.186","","","","","","0.956","","","","has coordinates","229489","2020-10-21","18:00:00",""
"7047510","17.2544","0.0003","11.7447","0.0002","15.364","0.0002","90","","104.355","0.001","90","","3016.27","0.08","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C62 H58 B4 N18 O Sc2 -","- C62 H58 B4 N18 O Sc2 -","- C124 H116 B8 N36 O2 Sc4 -","2","0.5","","Beh, Daniel W.; Piers, Warren E.; Del Rosal, Iker; Maron, Laurent; Gelfand, Benjamin S.; Gendy, Chris; Lin, Jian-Bin","Scandium alkyl and hydride complexes supported by a pentadentate diborate ligand: reactions with CO<sub>2</sub> and N<sub>2</sub>O.","Dalton transactions (Cambridge, England : 2003)","2018","47","38","13680","13688","10.1039/c8dt03313g","","","1.54178","CuKα","","0.0554","0.0471","","","0.1291","0.1355","","","","","","1.059","","","","has coordinates","230010","2020-10-21","18:00:00",""
"7047985","14.77","0.003","11.093","0.002","15.89","0.003","90","","108","0.03","90","","2476.1","0.9","293","2","293.15","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C48 H36 Cu3 I3 N12 O6 -","- C48 H36 Cu3 I3 N12 O6 -","- C96 H72 Cu6 I6 N24 O12 -","2","0.5","","Guo, Xiaoqing; Huang, Chao; Yang, Haiyan; Shao, Zhichao; Gao, Kuan; Qin, Na; Li, Gaoxiang; Wu, Jie; Hou, Hongwei","Cu(i) coordination polymers (CPs) as tandem catalysts for three-component sequential click/alkynylation cycloaddition reaction with regiocontrol.","Dalton transactions (Cambridge, England : 2003)","2018","47","47","16895","16901","10.1039/c8dt04067b","","","0.71073","MoKα","","0.075","0.0681","","","0.1491","0.1536","","","","","","1.193","","","","has coordinates,has disorder","229683","2020-10-21","18:00:00",""
"7048039","11.325","0.0002","13.8008","0.0003","12.4291","0.0002","90","","92.485","0.0019","90","","1940.77","0.06","173","2","173","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C36 H40 Cu F6 Fe2 N4 O3 P -","- C36 H40 Cu F6 Fe2 N4 O3 P -","- C72 H80 Cu2 F12 Fe4 N8 O6 P2 -","2","0.5","","Wilkinson, Luke A.; Yue, Thomas T. C.; Massey, Emma; White, Andrew J. P.; Long, Nicholas J.","Cyanoferrocenes as redox-active metalloligands for coordination-driven self-assembly.","Dalton transactions (Cambridge, England : 2003)","2018","48","1","72","78","10.1039/c8dt04215b","","","1.54184","CuKα","","0.0788","0.05","","","0.1163","0.135","","","","","","1.038","","","","has coordinates,has disorder","223946","2020-10-21","18:00:00",""
"7048550","19.3201","0.0005","13.2499","0.0003","13.8392","0.0004","90","","97.12","0.001","90","","3515.37","0.16","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C56 H58 Cd4 N16 O29 S4 -","- C56 H58 Cd4 N16 O29 S4 -","- C112 H116 Cd8 N32 O58 S8 -","2","0.5","","Gogia, Alisha; Mandal, Sanjay K.","A rational design and green synthesis of 3D metal organic frameworks containing a rigid heterocyclic nitrogen-rich dicarboxylate: structural diversity, CO<sub>2</sub> sorption and selective sensing of 2,4,6-TNP in water.","Dalton transactions (Cambridge, England : 2003)","2019","48","7","2388","2398","10.1039/c8dt04474k","","","0.71073","MoKα","","0.0276","0.025","","","0.0619","0.0634","","","","","","1.038","","","","has coordinates","224302","2020-10-21","18:00:00",""
"7048888","13.79","0.003","10.428","0.002","18.95","0.005","90","","111.077","0.004","90","","2542.7","1","183","","183","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C34 H70 Fe O4 Si8 -","- C34 H70 Fe O4 Si8 -","- C68 H140 Fe2 O8 Si16 -","2","0.5","","Arata, Shogo; Sunada, Yusuke","An isolable iron(ii) bis(supersilyl) complex as an effective catalyst for reduction reactions.","Dalton transactions (Cambridge, England : 2003)","2019","48","9","2891","2895","10.1039/c9dt00116f","","","0.71075","MoKα","","0.0634","0.0513","","","0.1352","0.1458","","","","","","1.071","","","","has coordinates","224328","2020-10-21","18:00:00",""
"7049136","43.219","0.009","15.561","0.003","26.67","0.005","90","","102.72","0.03","90","","17496","6","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C184 H244 Cu2 F12 N10 O11 P2 -","- C184 H244 Cu2 F12 N10 O11 P2 -","- C736 H976 Cu8 F48 N40 O44 P8 -","4","1","","Nicholls, Thomas P.; Caporale, Chiara; Massi, Massimiliano; Gardiner, Michael G.; Bissember, Alex C.","Synthesis and characterisation of homoleptic 2,9-diaryl-1,10-phenanthroline copper(i) complexes: influencing selectivity in photoredox-catalysed atom-transfer radical addition reactions.","Dalton transactions (Cambridge, England : 2003)","2019","48","21","7290","7301","10.1039/c8dt04116d","","","0.71073","synchrotron","","0.1164","0.0721","","","0.201","0.2416","","","","","","1.056","","","","has coordinates,has disorder","224458","2020-10-21","18:00:00",""
"7049466","16.2187","0.0006","5.9701","0.0002","22.2623","0.0012","90","","121.786","0.003","90","","1832.3","0.15","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C19 H17 Cl2 N O3 Ru -","- C19 H17 Cl2 N O3 Ru -","- C76 H68 Cl8 N4 O12 Ru4 -","4","1","","Meng, Ting; Qin, Qi-Pin; Chen, Zi-Lu; Zou, Hua-Hong; Wang, Kai; Liang, Fu-Pei","Discovery of high in vitro and in vivo antitumor activities of organometallic ruthenium(ii)-arene complexes with 5,7-dihalogenated-2-methyl-8-quinolinol.","Dalton transactions (Cambridge, England : 2003)","2019","48","16","5352","5360","10.1039/c9dt00866g","","x-ray","0.71073","MoKα","","0.0847","0.0578","","","0.1244","0.1383","","","","","","1.098","","","","has coordinates","224196","2020-10-21","18:00:00",""
"7049530","13.845","0.0002","14.9545","0.0002","31.694","0.0004","90","","96.521","0.001","90","","6519.63","0.15","120.01","0.1","120.01","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C80 H106.67 B4 O4 U1.33 -","- C80 H106.667 B4 O4 U1.33333 -","- C240 H320 B12 O12 U4 -","3","0.75","","Arnold, Polly L.; Puig-Urrea, Laura; Wells, Jordann A. L.; Yuan, Dan; Cruickshank, Faye L.; Young, Rowan D.","Applications of boroxide ligands in supporting small molecule activation by U(iii) and U(iv) complexes.","Dalton transactions (Cambridge, England : 2003)","2019","48","15","4894","4905","10.1039/c8dt05051a","","x-ray","0.71073","MoKα","","0.0573","0.0411","","","0.0711","0.0752","","","","","","1.043","","","","has coordinates","224395","2020-10-21","18:00:00",""
"7050393","15.0967","0.0003","9.246","0.0002","12.5568","0.0003","90","","97.112","0.001","90","","1739.24","0.07","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","caesium hexa-bromo-monocarbadodecaborane","","","- C H6 B11 Br6 Cs -","- C H6 B11 Br6 Cs -","- C4 H24 B44 Br24 Cs4 -","4","1","","Andreas Franken; Neil J. Bullen; Tomáš Jelínek; Mark Thornton-Pett; Simon J. Teat; William Clegg; John D. Kennedy; Michaele J. Hardie","Structural chemistry of halogenated monocarbaboranes: the extended structures of Cs[1-HCB9H4Br5], Cs[1-HCB11H5Cl6] and Cs[1-HCB11H5Br6]","New J. Chem.","2004","28","12","1499","1505","10.1039/b410929e","","","0.71073","MoKα","","0.0448","0.0376","","","0.0917","0.0958","","","","","","1.034","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050554","10.116","0.002","11.562","0.002","16.084","0.003","90","","102.99","0.03","90","","1833.1","0.6","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18.5 H15 Mn N2 O5 -","- C18.5 H12 Mn N2 O5.005 -","- C74 H48 Mn4 N8 O20.02 -","4","1","","Ma, Chengbing; Chen, Changneng; Liu, Qiutian; Liao, Daizheng; Li, Licun; Sun, Licheng","Structural transformation mediated by o-, m-, and p-phthalates from two to three dimensions for manganese/phthalate/4,4'-bpy complexes (4,4'-bpy = 4,4'-bipyridine)","New Journal of Chemistry","2003","27","5","890","","10.1039/b301076g","","","0.71073","MoKα","","","0.0631","","","0.1783","0.196","","","","","","1.016","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050856","20.331","0.002","9.3818","0.001","20.68","0.002","90","","109.252","0.006","90","","3723.9","0.7","183","2","183","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H60 Al5 Cl O9 -","- C24 H60 Al5 Cl O9 -","- C96 H240 Al20 Cl4 O36 -","4","1","","Carmalt, Claire J.; Mileham, John D.; White, Andrew J. P.; Williams, David J.","Pentanuclear alkoxyaluminium hydrides","New Journal of Chemistry","2002","26","7","902","","10.1039/b201773n","","","1.54178","CuKα","","0.0817","0.0658","","0.2093","0.1841","","","","1.062","1.096","1.096","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050970","17.474","0.002","5.27","0.002","22.478","0.003","90","","110.42","0.01","90","","1939.9","0.8","296","","296","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","5-Methyl-1,3-cyclohexanedionate, 2,6-diaminopyridinium, 5-methyl-1,3-cyclohexanedione enol","","- C19 H27 N3 O4 -","- C19 H27 N3 O4 -","- C76 H108 N12 O16 -","4","1","","Bertolasi, Valerio; Pretto, Loretta; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone","Hydrogen-bonded supramolecular structures in co-crystals of ??- or ??-diketone enols with 2,6-diaminopyridine or 2,4-diaminopyrimidine","New Journal of Chemistry","2002","26","11","1559","","10.1039/b205705k","","","0.71073","MoKα","","0.1412","0.0622","","","0.145","0.1739","","","","","","1.011","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7051097","13.7985","0.0015","7.0222","0.0005","23.996","0.002","90","","92.546","0.012","90","","2322.8","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","F2PDT-TTF, TCNQF4","","","- C21 H6 F6 N4 S6 -","- C21 H6 F6 N4 S6 -","- C84 H24 F24 N16 S24 -","4","1","","Dautel, O. J.; Fourmigue, M.","","New Journal of Chemistry","2001","","","","","10.1039/b010099o","","","","","","","0.0449","","","0.1057","","","","","","","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051112","30.715","0.0005","13.796","0.0003","33.555","0.0008","90","","92.799","0.0006","90","","14201.8","0.5","110","2","110","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C142 H145 N10 Na5 O38 Zn2 -","- C130 H92 N10 Na5 O26 Zn2 -","- C520 H368 N40 Na20 O104 Zn8 -","4","1","","Diskin-Posner, Yael; Goldberg, I.","","New Journal of Chemistry","2001","","","","","10.1039/b100580b","","","","","","","","","","","","","","","","","","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051402","19.629","0.001","12.494","0.001","22.413","0.002","90","","95.96","0.007","90","","5467","0.7","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","[RuH(dcpe)2]PF6","","","- C52 H97 F6 P5 Ru -","- C52 H96 F6 P5 Ru -","- C208 H384 F24 P20 Ru4 -","4","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a808860h","","","","","","","0.0457","","","0.0993","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051504","12.41","0.002","12.8779","0.0014","13.066","0.002","90","","90.428","0.014","90","","2088","0.5","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C20 H26 B2 Cl2 N2 -","- C20 H26 B2 Cl2 N2 -","- C80 H104 B8 Cl8 N8 -","4","1","","Anderson, Kirsty M.; Lesley, M. J. Gerald; Norman, Nicholas C.; Orpen, A. Guy; Starbuck, Johnathan","The Platinum Catalysed Diboration of Alkynes Using 1,2- B~2~Cl~2~(NMe~2~)~2~: Formation of 1-Azonia-2-Borata-5-Borole Derivatives","New Journal of Chemistry","1999","","","","","10.1039/a907255a","","","","","","","","","","","","","","","","","","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051533","13.0454","0.0005","5.0255","0.001","13.777","0.002","90","","96.005","0.009","90","","898.3","0.2","173","","","","","","","","","","Local laboratory","6","P 1 2/c 1","-P 2yc","13","","","","- C18 H14 Cl2 Hg N4 O2 -","- C18 H14 Cl2 Hg N4 O2 -","- C36 H28 Cl4 Hg2 N8 O4 -","2","0.5","","Pansanel, Jérôme; Jouaiti, Abdelaziz; Ferlay, Sylvie; Wais Hosseini, Mir; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: generation of 2-D molecular networks by combination of coordination and hydrogen bonds","New Journal of Chemistry","2006","30","1","71","","10.1039/b512569n","","","0.71073","MoKα","","0.0484","0.0328","","","0.0784","0.0912","","","","","","1.081","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051565","11.5557","0.0004","5.5221","0.0002","22.651","0.0009","90","","120.567","0.0015","90","","1244.54","0.08","173","","173","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C30 H20 N6 S2 -","- C30 H20 N6 S2 -","- C60 H40 N12 S4 -","2","0.5","","Constable, Edwin C.; Hermann, B. A.; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Scherer, Lukas J.","2,2′:6′,2″-Terpyridine-4′(1′H)-thione: a missing link in metallosupramolecular chemistry","New Journal of Chemistry","2005","29","11","1475","","10.1039/b510792j","","","0.71073","MoKα","","0.1003","0.0485","","0.0746","0.0465","0.0465","","","","","","1.0807","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051828","23.5279","0.0014","15.423","0.001","14.9208","0.0008","90","","100.695","0.002","90","","5320.3","0.5","213","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C30 H30 Cr2 N2 O14 Ti -","- C30 H30 Cr2 N2 O14 Ti -","- C180 H180 Cr12 N12 O84 Ti6 -","6","1.5","","Nogai, Stefan D.; Schuster, Oliver; Bruce, Jocelyn; Raubenheimer, Helgard G.","Titanoxycarbene complexes of Ti(iv) with O- and N-donor ligands","New Journal of Chemistry","2008","32","3","540","","10.1039/b715075j","","","0.71073","MoKα","","0.0513","0.0402","","","0.0985","0.1051","","","","","","1.059","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051829","23.5197","0.0015","15.4154","0.001","14.9223","0.0009","90","","100.704","0.001","90","","5316.2","0.6","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C30 H30 N2 O14 Ti W2 -","- C30 H30 N2 O14 Ti W2 -","- C180 H180 N12 O84 Ti6 W12 -","6","1.5","","Nogai, Stefan D.; Schuster, Oliver; Bruce, Jocelyn; Raubenheimer, Helgard G.","Titanoxycarbene complexes of Ti(iv) with O- and N-donor ligands","New Journal of Chemistry","2008","32","3","540","","10.1039/b715075j","","","0.71073","MoKα","","0.049","0.038","","","0.0899","0.0955","","","","","","1.046","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7052512","14.5462","0.0002","8.8913","0.0002","12.2784","0.0003","90","","97.01","0.001","90","","1576.15","0.06","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","caesium hexa-chloro-monocarbadodecaborane","","","- C H6 B11 Cl6 Cs -","- C H6 B11 Cl6 Cs -","- C4 H24 B44 Cl24 Cs4 -","4","1","","Andreas Franken; Neil J. Bullen; Tomáš Jelínek; Mark Thornton-Pett; Simon J. Teat; William Clegg; John D. Kennedy; Michaele J. Hardie","Structural chemistry of halogenated monocarbaboranes: the extended structures of Cs[1-HCB9H4Br5], Cs[1-HCB11H5Cl6] and Cs[1-HCB11H5Br6]","New J. Chem.","2004","28","12","1499","1505","10.1039/b410929e","","","0.71073","MoKα","","0.0413","0.0377","","","0.0983","0.1019","","","","","","1.086","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052570","12.8437","0.0014","8.3562","0.0009","25.59","0.003","90","","90.944","0.002","90","","2746.1","0.5","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C10 H6 Ag F3 N4 O4 S -","- C10 H6 Ag F3 N4 O4 S -","- C80 H48 Ag8 F24 N32 O32 S8 -","8","2","","Wan, Chong-Qing; Mak, Thomas C. W.","Supramolecular frameworks constructed from angular-shaped sulfonyldipyrazine and various silver(i) salts","New Journal of Chemistry","2011","35","2","319","","10.1039/c0nj00631a","","","0.71073","MoKα","","0.1157","0.0595","","","0.1542","0.1883","","","","","","1.054","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052647","12.4549","0.0007","12.6214","0.0007","26.4841","0.0015","90","","91.527","0.001","90","","4161.8","0.4","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C88 H77 Co4 N15 O9 -","- C88 H77 Co4 N15 O9 -","- C176 H154 Co8 N30 O18 -","2","0.5","","Craig, Gavin A.; Costa, José Sánchez; Aguilà, David; Barrios, Leoní A.; Roubeau, Olivier; Teat, Simon J.; Aromí, Guillem","Molecular [Co(iii)Co(ii)] ×2 assemblies of a new bis-phenol/pyrazolyl ligand","New Journal of Chemistry","2011","35","6","1202","","10.1039/c0nj00861c","","","0.7749","synchrotron","","0.0921","0.0643","","","0.19","0.2114","","","","","","1.061","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7053085","17.251","0.003","12.4954","0.0019","28.007","0.004","90","","97.612","0.003","90","","5983.9","1.6","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C104.9 H160.8 Cl5.8 N19 O20 P2 S2 -","- C104 H148 Cl4 N19 O20 P2 S2 -","- C208 H296 Cl8 N38 O40 P4 S4 -","2","0.5","","Zhang, Yanlei; Zhang, Rui; Zhao, Yanxia; Ji, Liguo; Jia, Chuandong; Wu, Biao","Anion binding of tris-(thio)urea ligands","New Journal of Chemistry","2013","37","8","2266","","10.1039/c3nj00401e","","","0.71073","MoKα","","0.1157","0.0845","","","0.2508","0.2771","","","","","","1.083","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053701","19.7663","0.0015","11.8837","0.0008","15.7559","0.0014","90","","106.807","0.004","90","","3542.9","0.5","120","2","120","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C42 H41.5 N6.5 O -","- C42 H41.5 N6.5 O -","- C168 H166 N26 O4 -","4","1","","Dehaen, Wim; Gale, Philip A.; García-Garrido, Sergio E.; Kostermans, Maarten; Light, Mark E.","Anion recognition by N-confused calix[4]pyrrole-α-carbaldehyde and its Knoevenagel reaction derivatives","New Journal of Chemistry","2007","31","5","691","","10.1039/b616467f","","","0.71073","MoKα","","0.2209","0.0907","","","0.2159","0.2756","","","","","","1.011","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054136","10.267","0.005","13.751","0.006","29.045","0.013","90","","95.637","0.003","90","","4081","3","113","2","113","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C37.35 H26.01 Cl3 Fe Mn N8.67 O4.5 -","- C37.34 H23 Cl3 Fe Mn N8.67 O4.5 -","- C149.36 H92 Cl12 Fe4 Mn4 N34.68 O18 -","4","1","","Kou, Hui-Zhong; Ni, Zhong-Hai; Liu, Cai-Ming; Zhang, De-Qing; Cui, Ai-Li","Cyanide-bridged 1D Mn(iii)‒Fe(iii) bimetallic complexes: synthesis, crystal structure and magnetic properties","New Journal of Chemistry","2009","33","11","2296","","10.1039/b9nj00316a","","","0.7107","MoKα","","0.0931","0.0775","","","0.2129","0.2284","","","","","","1.079","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054963","13.7313","0.0019","10.4349","0.0014","18.476","0.0019","90","","130.704","0.007","90","","2006.9","0.5","291","2","291","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C42 H30 N6 O9 S2 Zn2 -","- C42 H30 N6 O9 S2 Zn2 -","- C84 H60 N12 O18 S4 Zn4 -","2","0.5","","Yin, Wen-Yu; Huang, Zuo-Long; Tang, Xiao-Yan; Wang, Jun; Cheng, Hong-Jian; Ma, Yun-Sheng; Yuan, Rong-Xin; Liu, Dong","Structural diversification and photocatalytic properties of zinc(ii) polymers modified by auxiliary N-containing ligands","New J. Chem.","2015","39","9","7130","","10.1039/C5NJ01005E","","","0.71073","MoKα","","0.0799","0.0702","","","0.1795","0.1874","","","","","","1.166","","","","has coordinates,has disorder","155210","2020-10-21","18:00:00",""
"7055005","25.45","0.005","11.928","0.005","25.835","0.005","90","","116.777","0.005","90","","7002","4","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C63 H73 Cd2.5 N9 Na O19 -","- C60 H65.95 Cd2.5 N8 Na O18 -","- C240 H263.8 Cd10 N32 Na4 O72 -","4","1","","Hu, Xiao-Li; Qin, Chao; Wang, Xin-Long; Shao, Kui-Zhan; Su, Zhong-Min","Cluster-based metal‒organic frameworks as sensitive and selective luminescent probes for sensing nitro explosives","New J. Chem.","2015","39","10","7858","","10.1039/C5NJ01237F","","","0.71069","MoKα","","0.224","0.0979","","","0.244","0.3129","","","","","","1.006","","","","has coordinates,has disorder","176429","2020-10-21","18:00:00",""
"7055033","9.791","0.001","4.442","0.001","20.883","0.003","90","","90.96","0.01","90","","908.1","0.3","200","2","200","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","compound-5","","- C13 H14 Ag N3 O3 Se2 -","- C13 H14 Ag N3 O3 Se2 -","- C26 H28 Ag2 N6 O6 Se4 -","2","0.5","","Cargnelutti, Roberta; da Silva, Felipe Dornelles; Abram, Ulrich; Lang, Ernesto Schulz","Metal complexes with bis(2-pyridyl)diselenoethers: structural chemistry and catalysis","New J. Chem.","2015","39","10","7948","","10.1039/C5NJ01400J","","","0.71073","MoKα","","0.0878","0.0572","","","0.1522","0.166","","","","","","0.947","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7055204","17.202","0.005","17.211","0.005","18.875","0.006","90","","114.062","0.004","90","","5103","3","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C23 H14 N4 O5 Zn -","- C23 H14 N4 O5 Zn -","- C92 H56 N16 O20 Zn4 -","4","1","","Yao, Wan-Ting; Luo, Ming-Biao; Feng, Xue-Feng; Meng, Pan-Pan; Gong, Le-Le; Luo, Feng","Construction of structural diversity and fine-tuned porosity in acylamide MOFs by a synthetic approach","New J. Chem.","2016","40","3","2021","","10.1039/C5NJ02634B","","","0.71073","MoKα","","0.0982","0.0586","","","0.1357","0.1536","","","","","","0.832","","","","has coordinates","181776","2020-10-21","18:00:00",""
"7055805","8.9621","0.0012","10.9006","0.0015","17.225","0.002","90","","97.285","0.002","90","","1669.2","0.4","293","2","293","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","dichloro(1,5-bis(p-tolyl)-3,7-bis(pyridine-2-yl)-1,5-diaza-3,7-diphosphacyclooctane)gold(I) dimethylsulfoxyde solvate","","- C60 H72 Au4 Cl4 N8 O2 P4 S2 -","- C60 H72 Au4 Cl4 N8 O2 P4 S2 -","- C60 H72 Au4 Cl4 N8 O2 P4 S2 -","1","0.25","","Shamsutdinova, Nataliya; Strelnik, Igor D.; Musina, Elvira I.; Gerasimova, Tatiana; Katsyuba, Sergey; Babaev, Vasily; Krivolapov, Dmitry; Litvinov, Igor; Mustafina, Asiya; Karasik, Andrey A.; Sinyashin, Oleg Geroldovich","“Host-guest” binding of luminescent dinuclear Au(I) complex based on cyclic diphosphine with organic substrates as a reason for luminescence tuneability","New J. Chem.","2016","","","","","10.1039/C6NJ02277D","","","0.71073","MoKα","","0.0461","0.0353","","","0.0867","0.0918","","","","","","1.076","","","","has coordinates,has disorder","186925","2020-10-21","18:00:00",""
"7055809","25.1513","0.0011","8.2531","0.0004","33.3853","0.0015","90","","109.333","0.001","90","","6539.2","0.5","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","copper(I) thiocyanate complex of tris(2pyridyl)phosphine oxide","","- C64 H48 Cu4 N16 O4 P4 S4 -","- C64 H48 Cu4 N16 O4 P4 S4 -","- C256 H192 Cu16 N64 O16 P16 S16 -","4","1","","Artem’ev, Alexander V.; Doronina, Evgeniya P.; Rakhmanova, Marianna I.; Sutyrina, Anastasiya O.; Bagryanskaya, Irina Yu.; Tolstoy, Peter M.; Gushchin, Artem L.; Mazur, Anton S.; Gusarova, Nina K.; Trofimov, Boris A.","Luminescent CuI thiocyanate complexes based on tris(2-pyridyl)phosphine and its oxide: from mono-, di- and trinuclear species to coordination polymers","New J. Chem.","2016","40","12","10028","","10.1039/C6NJ02087A","","","0.71073","MoKα","","0.0548","0.0375","","","0.0751","0.0806","","","","","","1.061","","","","has coordinates","190238","2020-10-21","18:00:00",""
"7055897","11.807","0.009","9.928","0.009","23.44","0.02","90","","97.668","0.015","90","","2723","4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C35 H34 Co N6 O6 -","- C29 H25 Co N3 O6 -","- C116 H100 Co4 N12 O24 -","4","1","","Li, Huijun; Wang, Yuan; He, Yaling; Xu, Zhouqing; Zhao, Xiaolei; Han, Yi","Synthesis of several novel coordination complexes: ion exchange, magnetic and photocatalytic studies","New J. Chem.","2017","41","3","1046","","10.1039/C6NJ02863B","","","0.71073","MoKα","","0.0783","0.0465","","","0.1042","0.1158","","","","","","1.066","","","","has coordinates,has disorder","191706","2020-10-21","18:00:00",""
"7056025","23.2179","0.0007","14.1211","0.0004","30.9402","0.0008","90","","98.284","0.002","90","","10038.3","0.5","296","2","296","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C40 H110 Cu Mo36 N24 O163 P12 Sr5 -","- C40 H110 Cu1.12 Mo36 N24 O163 P12 Sr4.88 -","- C80 H220 Cu2.24 Mo72 N48 O326 P24 Sr9.76 -","2","0.5","","Wang, Wei-wei; Lv, Jing-hua; Yu, Kai; Wang, Chun-mei; Zhang, He; Wu, Chu; Zhou, Bai-bin","The basket-type dimer layers based on tetra-electron reduced heteropoly blue directed by copper/nickel and strontium linkers","New J. Chem.","2017","41","7","2687","","10.1039/C6NJ03495K","","","0.71073","MoKα","","0.1002","0.0563","","","0.15","0.1747","","","","","","1.027","","","","has coordinates","195157","2020-10-21","18:00:00",""
"7056026","23.2228","0.0004","14.1531","0.0003","30.9026","0.0005","90","","98.311","0.001","90","","10050.2","0.3","296","2","296","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C40 H107.5 Mo36 N24 Ni O161.5 P12 Sr5 -","- C40 H107.4 Mo36 N24 Ni1.1 O161.7 P12 Sr4.9 -","- C80 H214.8 Mo72 N48 Ni2.2 O323.4 P24 Sr9.8 -","2","0.5","","Wang, Wei-wei; Lv, Jing-hua; Yu, Kai; Wang, Chun-mei; Zhang, He; Wu, Chu; Zhou, Bai-bin","The basket-type dimer layers based on tetra-electron reduced heteropoly blue directed by copper/nickel and strontium linkers","New J. Chem.","2017","41","7","2687","","10.1039/C6NJ03495K","","","0.71073","MoKα","","0.1015","0.0865","","","0.1465","0.169","","","","","","1.211","","","","has coordinates,has disorder","195157","2020-10-21","18:00:00",""
"7056358","16.8027","0.0016","12.4348","0.0012","17.2821","0.0016","90","","101.284","0.001","90","","3541.1","0.6","293","2","293.15","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C24 H51 Gd N4 O Si4 -","- C24 H51 Gd N4 O Si4 -","- C96 H204 Gd4 N16 O4 Si16 -","4","1","","Gu, Xiaoxia; Wang, Shaowu; Wei, Yun; Zhu, Xiancui; Zhou, Shuangliu; Huang, Zeming; Mu, Xiaolong","Rare earth metal bisamido complexes with a NNO tridentate ligand and catalytic activity for selective polymerization of isoprene","New J. Chem.","2017","","","","","10.1039/C7NJ01454F","","","0.71073","MoKα","","0.0343","0.0245","","","0.0557","0.0593","","","","","","1.052","","","","has coordinates,has disorder","198108","2020-10-21","18:00:00",""
"7056452","24.2039","0.0009","14.9856","0.0006","19.4818","0.0008","90","","98.214","0.001","90","","6993.8","0.5","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C80 H80 Cl6 N8 -","- C80 H80 Cl6 N8 -","- C320 H320 Cl24 N32 -","4","1","","Madhu, Suresh; Rashmi, E.; Gonnade, Rajesh G.; Sanjayan, G. J.","Exploring Gem-Dimethyl Effect in the Formation of Imine-Based Macrocycles and Cages","New J. Chem.","2017","","","","","10.1039/C7NJ02069D","","","1.54178","CuKα","","0.1031","0.0592","","","0.1402","0.1615","","","","","","1.027","","","","has coordinates","198882","2020-10-21","18:00:00",""
"7056572","8.375","0.0002","14.7703","0.0004","31.987","0.0009","90","","92.029","0.001","90","","3954.35","0.18","150","2","150.15","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C70 H84 Cl2 Mn2 N18 O14 Zn2 -","- C70 H84 Cl2 Mn2 N18 O14 Zn2 -","- C140 H168 Cl4 Mn4 N36 O28 Zn4 -","2","0.5","","Banerjee, Saikat; Brandao, Paula; Bauza, Antonio; Frontera, Antonio; Barcelo-Oliver, Miquel; Panja, Anangamohan; Saha, Amrita","Nuclearity versus oxidation state in catalytic efficiency of MnII/III azo Schiff base complexes: Computational study on supramolecular interactions and phenoxazinone synthase like activity","New J. Chem.","2017","","","","","10.1039/C7NJ02280H","","","0.71073","MoKα","","0.083","0.0613","","","0.1815","0.1995","","","","","","1.055","","","","has coordinates,has disorder","200057","2020-10-21","18:00:00",""
"7056600","12.325","0.003","6.5356","0.0015","17.769","0.003","90","","115.411","0.012","90","","1292.8","0.5","293","2","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C30 H26 Cd N4 O4 -","- C30 H26 Cd N4 O4 -","- C60 H52 Cd2 N8 O8 -","2","0.5","","Zhang, Mei-Li; Wang, Ji-Jiang; Ma, Zhen-Zhen; Qiao, Lei","Color tunable entangled coordination polymers based on long flexible bis(imidazole) ligands and phenylenediacetate","New J. Chem.","2017","","","","","10.1039/C7NJ00645D","","","0.71073","MoKα","","0.0413","0.0398","","","0.1104","0.1112","","","","","","1.0183","","","","has coordinates","200816","2020-10-21","18:00:00",""
"7057145","11.2374","0.0003","6.78252","0.00013","18.7482","0.0004","90","","91.4013","0.0019","90","","1428.52","0.06","130","2","130","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C29 H31 Cd N5 O5 -","- C29 H24 Cd N5 O5 -","- C58 H48 Cd2 N10 O10 -","2","0.5","","Barsukova, Marina O.; Sapchenko, Sergey A.; Kovalenko, Konstantin A.; Samsonenko, Denis G.; Potapov, Andrei S.; Dybtsev, Danil N.; Fedin, Vladimir P.","Exploring the multifunctionality in metal‒organic framework materials: how do the stilbenedicarboxylate and imidazolyl ligands tune the characteristics of coordination polymers?","New Journal of Chemistry","2018","42","8","6408","","10.1039/C8NJ00494C","","x-ray","0.71073","MoKα","","0.0338","0.026","","","0.0609","0.0641","","","","","","1.101","","","","has coordinates,has disorder","230233","2020-10-21","18:00:00",""
"7057146","11.4594","0.0003","6.5882","0.0002","18.3365","0.0005","90","","92.145","0.003","90","","1383.38","0.07","130","2","130","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C29 H31 Co N5 O5 -","- C29 H24 Co N5 O5 -","- C58 H48 Co2 N10 O10 -","2","0.5","","Barsukova, Marina O.; Sapchenko, Sergey A.; Kovalenko, Konstantin A.; Samsonenko, Denis G.; Potapov, Andrei S.; Dybtsev, Danil N.; Fedin, Vladimir P.","Exploring the multifunctionality in metal‒organic framework materials: how do the stilbenedicarboxylate and imidazolyl ligands tune the characteristics of coordination polymers?","New Journal of Chemistry","2018","42","8","6408","","10.1039/C8NJ00494C","","x-ray","0.71073","MoKα","","0.0526","0.0404","","","0.1032","0.1094","","","","","","1.084","","","","has coordinates,has disorder","230233","2020-10-21","18:00:00",""
"7057148","11.5569","0.0008","6.851","0.0005","17.499","0.0009","90","","92.086","0.007","90","","1384.59","0.16","130","2","130","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C29 H31 N5 O5 Zn -","- C29 H24 N5 O5 Zn -","- C58 H48 N10 O10 Zn2 -","2","0.5","","Barsukova, Marina O.; Sapchenko, Sergey A.; Kovalenko, Konstantin A.; Samsonenko, Denis G.; Potapov, Andrei S.; Dybtsev, Danil N.; Fedin, Vladimir P.","Exploring the multifunctionality in metal‒organic framework materials: how do the stilbenedicarboxylate and imidazolyl ligands tune the characteristics of coordination polymers?","New Journal of Chemistry","2018","42","8","6408","","10.1039/C8NJ00494C","","x-ray","0.71073","MoKα","","0.0884","0.0654","","","0.1802","0.1969","","","","","","1.077","","","","has coordinates,has disorder","230233","2020-10-21","18:00:00",""
"7057546","6.583","0.004","4.933","0.003","12.34","0.008","90","","90.968","0.007","90","","400.7","0.4","296","2","296.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- B3 Ba Li O9 Zn3 -","- B3 Ba Li O9 Zn3 -","- B6 Ba2 Li2 O18 Zn6 -","2","0.5","","Chen, Yanna; Zhang, Min; Pan, Shilie","BaLiZn3(BO3)3: a new member of the KBe2BO3F2 family possessing dense BO3 triangles and the smallest interlayer distance","New Journal of Chemistry","2018","42","15","12365","","10.1039/C8NJ02623H","","","0.71073","MoKα","","0.0356","0.0327","","","0.0862","0.0881","","","","","","1.111","","","","has coordinates","230462","2020-10-21","18:00:00",""
"7057626","8.3379","0.0013","12.8358","0.0012","8.7757","0.0013","90","","103.116","0.01","90","","914.7","0.2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H8 F4 N2 O4 Pb -","- C20 H8 F4 N2 O4 Pb -","- C40 H16 F8 N4 O8 Pb2 -","2","0.5","","Ma, Jing-xin; Yang, Zhihua; Zhou, Tong; Guo, Qi; Yang, Jinhui; Yang, Tianlin; Yang, Qingfeng","Construction of structurally diverse luminescent lead(ii) fluorinated coordination polymers based on auxiliary ligands","New Journal of Chemistry","2018","42","18","15413","","10.1039/C8NJ02846J","","","0.71073","MoKα","","0.0307","0.0271","","","0.0525","0.0541","","","","","","1.063","","","","has coordinates,has disorder","230485","2020-10-21","18:00:00",""
"7057855","23.7562","0.0016","9.1238","0.0003","25.2435","0.0016","90","","116.95","0.008","90","","4877.3","0.6","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C43 H66 Cl3 F N8 O3 -","- C43 H66 Cl3 F N8 O3 -","- C172 H264 Cl12 F4 N32 O12 -","4","1","","Manna, Utsab; Das, Gopal","Neutral host‒guest capsular associations by a homologous halophenyl-substituted organic tris-urea receptor series: solid and solution state studies","New Journal of Chemistry","2018","42","23","19164","","10.1039/C8NJ04457K","","","0.71073","MoKα","","0.1353","0.0744","","","0.1854","0.2284","","","","","","1.056","","","","has coordinates","230501","2020-10-21","18:00:00",""
"7058288","20.8248","0.0009","14.9586","0.0007","22.5799","0.0011","90","","113.663","0.001","90","","6442.5","0.5","298","2","298","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C63 H51.5 N16.5 O24.5 -","- C63 H51.5 N16.5 O24.5 -","- C252 H206 N66 O98 -","4","1","","Kandel, Shambhu; Sathish, Veerasamy; Mathivathanan, Logesh; Morozov, Alexander N.; Mebel, Alexander M.; Raptis, Raphael G.","Aggregation induced emission enhancement (AIEE) of tripodal pyrazole derivatives for sensing of nitroaromatics and vapor phase detection of picric acid","New Journal of Chemistry","2019","43","19","7251","","10.1039/C9NJ00166B","","","0.71073","MoKα","","0.2116","0.1015","","","0.2223","0.278","","","","","","1.014","","","","has coordinates","224834","2020-10-21","18:00:00",""
"7058375","11.2448","0.0014","10.0674","0.0013","24.394","0.003","90","","93.663","0.002","90","","2755.9","0.6","293","","293","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H15 N3 Ni O6 -","- C24 H15 N3 Ni O6 -","- C96 H60 N12 Ni4 O24 -","4","1","","Zhang, Jie; Gao, Lingling; Wang, Yang; Zhai, Lijun; Wang, Xiaoqing; Niu, Xiaoyan; Hu, Tuoping","Fluorescence sensing and magnetic properties of three coordination polymers based on 6-(3,5-dicarboxylphenyl)nicotinic acid and pyridine/imidazole linkers","New Journal of Chemistry","2019","43","24","9376","","10.1039/C9NJ00682F","","","0.71073","MoKα","","0.1241","0.0569","","","0.1174","0.1414","","","","","","0.909","","","","has coordinates,has disorder","224684","2020-10-21","18:00:00",""
"7058399","18.3382","0.0016","18.3305","0.0017","23.521","0.002","90","","97.649","0.001","90","","7836.2","1.2","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C84 H66 F6 O8 Sn4 Te2 -","- C84 H66 F6 O8 Sn4 Te2 -","- C336 H264 F24 O32 Sn16 Te8 -","4","1","","Chen, Shuai; Nie, Jia-Jia; Wang, Shuo; Li, Qian-Li; Zhang, Ru-Fen; Li, Yong-Xin; Ma, Chun-Lin","Syntheses, characterization, DNA/BSA binding, and in vitro cytostatic activity of fluorobenzenetelluronic triorganotin(iv) esters","New Journal of Chemistry","2019","43","24","9516","","10.1039/C9NJ00487D","","","0.71073","MoKα","","0.1331","0.0561","","","0.1342","0.172","","","","","","0.933","","","","has coordinates","224686","2020-10-21","18:00:00",""
"7058854","11.2448","0.0014","10.0674","0.0013","24.394","0.003","90","","93.663","0.002","90","","2755.9","0.6","293","","293","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H15 N3 Ni O6 -","- C24 H15 N3 Ni O6 -","- C96 H60 N12 Ni4 O24 -","4","1","","Zhang, Jie; Gao, Lingling; Wang, Yang; Zhai, Lijun; Niu, Xiaoyan; Hu, Tuoping","A novel 3D Cd-based luminescent coordination polymer for selective sensing of 4-NP and NZF","New Journal of Chemistry","2019","43","43","16853","","10.1039/C9NJ04250D","","","0.71073","MoKα","","0.1241","0.0569","","","0.1174","0.1414","","","","","","0.909","","","","has coordinates,has disorder","224763","2020-10-21","18:00:00",""
"7059876","39.5527","0.0015","9.5048","0.0004","33.7838","0.0016","90","","100.68","0.004","90","","12480.7","0.9","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C39 H34 Fe P2 -","- C39 H34 Fe P2 -","- C624 H544 Fe16 P32 -","16","4","","Harrison, Daniel P.; Kumar, Varshini J.; Noppers, Johanna N.; Gluyas, Josef B. G.; Sobolev, Alexandre N.; Moggach, Stephen A.; Low, Paul J.","Iron vs. ruthenium: syntheses, structures and IR spectroelectrochemical characterisation of half-sandwich Group 8 acetylide complexes","New Journal of Chemistry","2021","45","33","14932","14943","10.1039/D0NJ03093G","","","1.54178","CuKα","","0.1405","0.0647","","","0.1146","0.1508","","","","","","0.959","","","","has coordinates","268868","2021-09-06","12:03:18",""
"7059918","21.451","0.002","8.7308","0.0007","17.3855","0.0011","90","","92.489","0.007","90","","3253","0.5","295","1","295","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C66 H98 Br2 N6 O2 -","- C66 H98 Br2 N6 O2 -","- C132 H196 Br4 N12 O4 -","2","0.5","","Grgurić, Toni; Cetina, Mario; Petroselli, Manuel; Bacchiocchi, Corrado; Dzolić, Zoran; Cametti, Massimo","Anion binding with biphenyl-bis-urea derivatives: solution and solid-state studies","New Journal of Chemistry","2020","44","38","16294","16301","10.1039/D0NJ03670F","","x-ray","0.71073","MoKα","","0.081","0.0491","","","0.1254","0.1471","","","","","","1.015","","","","has coordinates","258941","2020-11-06","12:52:22",""
"7060002","12.3179","0.0006","6.6907","0.0003","31.3842","0.0014","90","","100.576","0.002","90","","2542.6","0.2","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C43 H36 Br2 Mo2 N6 O6 S4 -","- C43 H36 Br2 Mo2 N6 O6 S4 -","- C86 H72 Br4 Mo4 N12 O12 S8 -","2","0.5","","Biswal, Debanjana; Roy, Malini; Pramanik, Nikhil Ranjan; Paul, Suvendu; Drew, Michael G. B.; Chakrabarti, Syamal","The vital role of ditopic N‒N bridging ligands with different lengths in the formation of new binuclear dioxomolybdenum(vi) complexes: synthesis, crystal structures, supramolecular framework and protein binding studies","New Journal of Chemistry","2020","44","38","16645","16664","10.1039/D0NJ03702H","","","0.71073","MoKα","","0.058","0.0385","","","0.0872","0.0946","","","","","","1.019","","","","has coordinates","258940","2020-11-06","12:51:54",""
"7060060","13.9869","0.0006","5.09616","0.00015","24.461","0.0008","90","","104.972","0.004","90","","1684.38","0.11","293.5","0.1","293.5","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C44 H36 N2 O4 S -","- C44 H36 N2 O4 S -","- C88 H72 N4 O8 S2 -","2","0.5","","Zhou, Hongke; Zhang, Zhan; Liu, Xingliang; Xu, Defang; Zhang, Weidong; Fu, Shengjie; Feng, Xiucun; Huang, Qian","D‒A type luminophores with a twisted molecular conformation constructed by phenoxazine and diphenylsulfone showing high contrast mechanofluorochromism","New Journal of Chemistry","2020","44","41","17882","17890","10.1039/D0NJ04178E","","x-ray","1.54184","CuKα","","0.05","0.0405","","","0.1054","0.114","","","","","","1.059","","","","has coordinates","258898","2020-11-06","12:43:35",""
"7061022","14.4126","0.0002","20.6834","0.0004","16.477","0.0003","90","","104.14","0.002","90","","4763","0.15","200","0.1","200","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C93 H77 Cd2 N7 O11 -","- C93 H77 Cd2 N7 O11 -","- C186 H154 Cd4 N14 O22 -","2","0.5","","Asad, Muhammad; Wang, Shan; Wang, Qian-You; Li, Lin-Ke; Anwar, Muhammad Imran; Younas, Ayesha; Zang, Shuang-Quan","Aqueous media ultra-sensitive detection of antibiotics via highly stable luminescent 3D Cadmium-based MOF","New Journal of Chemistry","2021","45","44","20887","20894","10.1039/D1NJ04413C","","x-ray","1.54184","CuKα","","0.0798","0.0574","","","0.1524","0.1627","","","","","","1.05","","","","has coordinates","271186","2021-12-07","03:38:09",""
"7061061","13.734","0.006","12.91","0.006","12.794","0.006","90","","105.017","0.009","90","","2191","1.7","103","2","103","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C19.33 H17 B0.33 -","- C19.3333 H17 B0.333333 -","- C116 H102 B2 -","6","1.5","","Himeno, Ryoji; Ito, Shunichiro; Tanaka, Kazuo; Chujo, Yoshiki","Synthesis, crystal structure, solid-state optical property and C–H activation of sp3 carbon of highly-stable 1-(2′,6′-dimesitylphenyl)-2,3,4,5-tetraphenylborole","New Journal of Chemistry","2021","45","48","22569","22573","10.1039/D1NJ04666G","","","0.71075","MoKα","","0.1622","0.0722","","","0.1418","0.1752","","","","","","0.935","","","","has coordinates","271863","2022-01-06","21:47:41",""
"7061062","13.652","0.0009","12.8989","0.0006","12.7196","0.0007","90","","106.517","0.007","90","","2147.4","0.2","93","2","93","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C55 H52 B -","- C52 H45 B -","- C104 H90 B2 -","2","0.5","","Himeno, Ryoji; Ito, Shunichiro; Tanaka, Kazuo; Chujo, Yoshiki","Synthesis, crystal structure, solid-state optical property and C–H activation of sp3 carbon of highly-stable 1-(2′,6′-dimesitylphenyl)-2,3,4,5-tetraphenylborole","New Journal of Chemistry","2021","45","48","22569","22573","10.1039/D1NJ04666G","","","0.71075","MoKα","","0.1264","0.0796","","","0.1786","0.206","","","","","","1.075","","","","has coordinates","271863","2022-01-06","21:47:45",""
"7061293","8.8054","0.0001","9.7676","0.0001","26.3853","0.0003","90","","90.928","0.001","90","","2269.04","0.04","99.99","0.17","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C48 H38 N4 O10 S2 Zn3 -","- C48 H38 N4 O10 S2 Zn3 -","- C96 H76 N8 O20 S4 Zn6 -","2","0.5","","Zheng, Han-Wen; Yang, Dong-Dong; Liang, Qiong-Fang; Zheng, Xiang-Jun","Acetonitrile-induced structure fine-tuning of a trinuclear zinc complex showing multistimuli responsive luminescence","New Journal of Chemistry","2022","46","10","4800","4805","10.1039/D2NJ00200K","","","1.54184","CuKα","","0.0334","0.0312","","","0.0847","0.0859","","","","","","1.117","","","","has coordinates","275004","2022-05-05","20:42:01",""
"7061514","23.0412","0.0009","9.3628","0.0004","15.739","0.0007","90","","98.319","0.004","90","","3359.7","0.2","292","2","292","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C31 H48 Cl N5 O3 S -","- C31 H48 Cl N5 O3 S -","- C124 H192 Cl4 N20 O12 S4 -","4","1","","Kumari, Annu; Dehaen, Wim; Chopra, Deepak; Dey, Swapan","Imidazopyridine–fluoride interaction: solvent-switched AIE effects via S⋯O conformational locking","New Journal of Chemistry","2022","46","22","10628","10636","10.1039/D2NJ00561A","","","0.71073","MoKα","","0.0925","0.056","","","0.1362","0.1523","","","","","","1.012","","","","has coordinates","276649","2022-07-06","08:22:37",""
"7061734","21.301","0.0005","5.21057","0.00012","13.062","0.0003","90","","98.392","0.002","90","","1434.23","0.06","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C27 H28 O2 S8 -","- C27 H28 O2 S8 -","- C54 H56 O4 S16 -","2","0.5","","Afzali, Azedeh; Tabasi, Zahra A.; Zhang, Baiyu H.; Zhao, Yuming","Studies of a bola-type bis(dithiafulvene) molecular system: synthesis, crystal structure, and electrochemical properties","New Journal of Chemistry","2022","46","38","18133","18145","10.1039/D2NJ01796B","","x-ray","1.54184","CuKα","","0.0658","0.0631","","","0.1733","0.1752","","","","","","1.102","","","","has coordinates","278472","2022-10-07","01:16:27",""
"7061912","20.5834","0.0005","5.2244","0.0001","15.7133","0.0004","90","","111.662","0.003","90","","1570.41","0.07","100.01","0.1","100.01","0.1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Ethyl_3-oxo-4-hydropyrazine-2-carboxylate","","- C14 H18 N4 O7 -","- C14 H18 N4 O7 -","- C56 H72 N16 O28 -","4","1","","Ghosh, Priyanka; Panda, Subhra Jyoti; Purohit, Chandra Shekhar","A new short synthesis route for favipiravir and its analogue: Their tautomerization behaviour","New Journal of Chemistry","2022","46","39","18824","18831","10.1039/D2NJ02996K","","x-ray","1.54184","CuKα","","0.0519","0.0491","","","0.1356","0.1385","","","","","","1.031","","","","has coordinates","279014","2022-11-07","05:41:05",""
"7061971","19.1067","0.0008","17.7692","0.0008","19.638","0.0009","90","","109.191","0.001","90","","6296.8","0.5","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","asa267bp","","","- C264 H360 O24 Pb8 -","- C264 H360 O24 Pb8 -","- C264 H360 O24 Pb8 -","1","0.25","","Someşan, Adrian-Alexandru; Varga, Richard A.","Diaryllead(ii) species stabilized by C,O-chelating ligands","New Journal of Chemistry","2022","46","42","20074","20077","10.1039/D2NJ03796C","","","0.71073","MoKα","","0.0442","0.0361","","","0.0822","0.0856","","","","","","1.089","","","","has coordinates,has disorder","279004","2022-11-07","05:38:12",""
"7062106","18.6335","0.0009","13.7763","0.0006","19.963","0.0013","90","","103.298","0.006","90","","4987.1","0.5","150","0.1","150","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C28 H30 N4 O4 Zn -","- C28 H30 N4 O4 Zn -","- C224 H240 N32 O32 Zn8 -","8","2","","Podjed, Nina; Modec, Barbara","Amidines from cyclic amines and nitriles in the presence of zinc(ii): other nitriles in place of acetonitrile","New Journal of Chemistry","2022","46","48","23225","23238","10.1039/D2NJ04668G","","x-ray","0.71073","MoKα","","0.1465","0.0581","","","0.1305","0.1731","","","","","","0.969","","","","has coordinates","280205","2023-01-06","09:55:21",""
"7062174","23.5235","0.0008","9.3471","0.0003","15.7733","0.0005","90","","91.648","0.003","90","","3466.7","0.2","282","3","282","3","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C36 H90 Br10.76 Cl7.24 Mn3 N6 -","- C36 H90 Br10.76 Cl7.24 Mn3 N6 -","- C72 H180 Br21.52 Cl14.48 Mn6 N12 -","2","0.5","","Xu, Ran; Lun, Meng-Meng; Zhang, Tie; Li, Jie; Zou, Ke; Zhang, Yi; Fu, Da-Wei; Guo, Qiang","Dual dielectric-responsive hybrid materials with fluorescent properties","New Journal of Chemistry","2023","47","5","2405","2411","10.1039/D2NJ04939B","","x-ray","0.71073","MoKα","","0.087","0.041","","","0.0856","0.0979","","","","","","1.028","","","","has coordinates,has disorder","281515","2023-03-04","18:31:52",""
"7062175","23.6709","0.0012","9.4002","0.0004","15.9372","0.0007","90","","91.605","0.004","90","","3544.8","0.3","374.98","0.1","374.98","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C36 H90 Br10.94 Cl7.06 Mn3 N6 -","- C36 H90 Br10.944 Cl7.056 Mn3 N6 -","- C72 H180 Br21.888 Cl14.112 Mn6 N12 -","2","0.5","","Xu, Ran; Lun, Meng-Meng; Zhang, Tie; Li, Jie; Zou, Ke; Zhang, Yi; Fu, Da-Wei; Guo, Qiang","Dual dielectric-responsive hybrid materials with fluorescent properties","New Journal of Chemistry","2023","47","5","2405","2411","10.1039/D2NJ04939B","","x-ray","0.71073","MoKα","","0.1551","0.0562","","","0.1443","0.1791","","","","","","1.025","","","","has coordinates,has disorder","281515","2023-03-04","18:31:55",""
"7062213","26.0971","0.0002","11.66535","0.00008","36.7954","0.0003","90","","103.706","0.0008","90","","10882.7","0.15","100.1","0.1","100.1","0.1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C27 H33 N31 O28 -","- C27 H33 N31 O28 -","- C216 H264 N248 O224 -","8","2","","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","","0.0577","0.0519","","","0.141","0.1456","","","","","","1.044","","","","has coordinates","281516","2023-03-04","18:32:22",""
"7062417","20.3465","0.0007","10.9821","0.0003","23.9221","0.0009","90","","112.054","0.004","90","","4954.2","0.3","297.6","","297.6","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C25 H25 N5 O4 S -","- C25 H25 N5 O4 S -","- C200 H200 N40 O32 S8 -","8","2","","Suraj,; Swamy, K. C. Kumara","Ring expansion/opening reactions of epoxy ene-amides: access to azabicyclononene, tetrahydropyridine and tetrazole scaffolds","New Journal of Chemistry","2023","47","19","9061","9065","10.1039/D3NJ00529A","","x-ray","0.71073","MoKα","","0.1436","0.1008","","","0.3121","0.3473","","","","","","1.072","","","","has coordinates","284296","2023-06-05","04:44:28",""
"7062931","14.29","0.003","7.87","0.003","25.42","0.009","90","","100.45","0.02","90","","2811.4","1.6","295","2","295","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C29 H27 N8 O6 -","- C29 H27 N8 O6 -","- C116 H108 N32 O24 -","4","1","","Korotina, Anna V.; Tolshchina, Svetlana G.; Gazizov, Denis A.; Steparuk, Alexander S.; Kim, Grigory A.; Demina, Nadezhda S.; Ganebnykh, Ilya N.; Slepukhin, Pavel A.; Aleksandrov, Alexey E.; Tameev, Alexey R.; Rusinov, Gennady L.","Novel helix-shape bis[1,2,4]triazolo[4,3-b:3′,4′-f][1,2,4,5]tetrazines: synthesis, optical and charge-transfer properties","New Journal of Chemistry","2024","48","5","1983","1991","10.1039/D3NJ05306G","","","0.71073","MoKα","","0.1729","0.0436","","","0.0453","0.0505","","","","","","0.886","","","","has coordinates,has disorder","289579","2024-02-04","12:20:02",""
"7062988","10.422","0.0002","11.8014","0.0003","8.6298","0.0002","90","","112.076","0.001","90","","983.6","0.04","153.15","","153.15","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C23 H19 N7 O2 -","- C23 H19 N7 O2 -","- C46 H38 N14 O4 -","2","0.5","","Razuwika, Rufaro; Munro, Orde Q.","Synthesis and characterization of C2-symmetric bis(carboxamide) pincer ligands","New Journal of Chemistry","2024","48","10","4229","4244","10.1039/D3NJ05502G","","","0.71073","MoKα","","0.0342","0.0259","","","0.0591","0.0639","","","","","","1.0941","","","","has coordinates","291010","2024-04-05","00:02:07",""
"7100027","16.012","0.005","6.907","0.005","7.971","0.005","90","","76.101","0.005","90","","855.7","0.9","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","cobalt terephthaloyldiglycinate hydrate","","","- C12 H20 Co N2 O11 -","- C12 H20 Co N2 O11 -","- C24 H40 Co2 N4 O22 -","2","0.5","","Kostakis, George E.; Casella, Luigi; Hadjiliadis, Nick; Monzani, Enrico; Kourkoumelis, Nikolaos; Plakatouras, John C.","Interpenetrated networks from a novel nanometer-sized pseudopeptidic ligand, bridging water, and transition metal ions with CdSO4 topology","Chemical Communications (Cambridge, United Kingdom)","2005","","30","3859","3861","10.1039/b502788h","","","","","","","","","","","","","","","","","","","","","has coordinates","287991","2023-12-04","15:01:45",""
"7100028","15.795","0.002","6.8256","0.0014","8.1755","0.0006","90","","77.004","0.007","90","","858.8","0.2","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","copper terephthaloyldiglycinate hydrate","","","- C12 H20 Cu N2 O11 -","- C12 H20 Cu N2 O11 -","- C24 H40 Cu2 N4 O22 -","2","0.5","","Kostakis, George E.; Casella, Luigi; Hadjiliadis, Nick; Monzani, Enrico; Kourkoumelis, Nikolaos; Plakatouras, John C.","Interpenetrated networks from a novel nanometer-sized pseudopeptidic ligand, bridging water, and transition metal ions with CdSO4 topology","Chemical Communications (Cambridge, United Kingdom)","2005","","30","3859","3861","10.1039/b502788h","","","","","","","","","","","","","","","","","","","","","has coordinates","287991","2023-12-04","15:01:51",""
"7100424","11.312","0.002","10.012","0.002","16.597","0.003","90","","97.25","0.03","90","","1864.7","0.6","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C14 H14 Cu2 I2 N4 O2 -","- C14 H14 Cu2 I2 N4 O2 -","- C56 H56 Cu8 I8 N16 O8 -","4","1","","Kumar Biradha; Madhushree Sarkar","Beta-sheet recognition in the non-interpenetrated and interpenetrated two-dimensional coordination networks containing cavities","Chemical Communications","2005","","","","","10.1039/b500666j","","","","","","","","","","","","","","","","","","","","","has coordinates","180106","2020-10-21","18:00:00",""
"7100707","7.9659","0.0008","4.918","0.0006","11.6355","0.0012","90","","95.851","0.007","90","","453.46","0.09","296","2","296","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Al H6 O12 P3 -","- Al H6 O12 P3 -","- Al2 H12 O24 P6 -","2","0.5","","Adrian Wright; Neal J. Checker; John Godber; Benson M. Kariuki; Steven Rishi","Synthesis and crystal structure of AlH2P3O10 2H2O; a new structure-type for layered acid phosphates.","Chemical Communications","2006","","","","","10.1039/b514246f","","","","","","","","","","","","","","","","","","","","","has coordinates","180109","2020-10-21","18:00:00",""
"7100748","22.9059","0.0019","8.5806","0.0007","40.738","0.003","90","","93.308","0.002","90","","7993.6","1.1","120","2","120","2","","","","","","","Roberto Quesada","5","P 1 2/c 1","-P 2yc","13","","","","- C41 H56 N6 O3 S -","- C41 H56 N6 O3 S -","- C328 H448 N48 O24 S8 -","8","2","","Evans, Louise S.; Gale, Philip A.; Light, Mark E.; Quesada, Roberto","Pyrrolylamidourea based anion receptors","New Journal of Chemistry","2006","30","7","1019","","10.1039/b603223k","","","0.6814","synchrotron","","0.1344","0.0901","","","0.2368","0.2735","","","","","","1.042","","","","has coordinates,has disorder","180109","2020-10-21","18:00:00",""
"7101165","17.2292","0.0002","15.0443","0.0002","18.9657","0.0002","90","","114.425","0.0003","90","","4475.98","0.09","113.2","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H18 Cl2 N2 O6 -","- C24 H18 Cl2 N2 O6 -","- C192 H144 Cl16 N16 O48 -","8","2","","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","","","0.0345","","","","0.0917","","","","","","1.073","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101382","12.295","0.003","12.971","0.003","22.984","0.005","90","","103.57","0.03","90","","3563.1","1.3","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C66 H108 Cu2 O18 -","- C66 H108 Cu2 O18 -","- C132 H216 Cu4 O36 -","2","0.5","","J. Reedijk; Laurent Benisvy; Patrick Gamez; Ilpo Mutikainen; Manuel Quesada; Urho Turpeinen","The self-assembly between C2-symmetric (methanol)6 or S6-symmetric (ethanol)6 cyclohexamers and paddle-wheel dinuclear copper units leads to unique 1D polymer chains","Chemical Communications","2006","","35","","","10.1039/b608220c","","","0.71073","MoKα","","0.1381","0.0758","","","0.184","0.2199","","","","","","1.003","","","","has coordinates,has disorder","180115","2020-10-21","18:00:00",""
"7101733","13.772","0.0014","13.592","0.0014","8.548","0.0008","90","","101.364","0.003","90","","1568.7","0.3","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","TACNCU3","","","- C18 H50 Cl4 Cu2 N6 O4 -","- C18 H42 Cl4 Cu2 N6 O4 -","- C36 H84 Cl8 Cu4 N12 O8 -","2","0.5","","Steed, Jonathan W; Goeta, Andrés E; Lipkowski, Janusz; Swierczynski, Dariusz; Panteleon, Vicky; Handa, Sheetal","Templated crystal nucleation: mixed crystals of very different copper(II) N,N',N''-trimethyltriazacyclononane complexes.","Chemical communications (Cambridge, England)","2007","","8","813","815","10.1039/b614043b","","","0.71073","MoKα","","0.0494","0.0444","","","0.1223","0.1283","","","","","","1.048","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101750","19.8688","0.0008","7.9486","0.0005","21.8773","0.0008","90","","111.266","0.003","90","","3219.8","0.3","133","2","133","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C33 H46 N6 O2 -","- C33 H46 N6 O2 -","- C132 H184 N24 O8 -","4","1","","Katsiaouni, Stamatia; Dechert, Sebastian; Brückner, Christian; Meyer, Franc","A versatile building block for pyrazole-pyrrole hybrid macrocycles.","Chemical communications (Cambridge, England)","2007","","9","951","953","10.1039/b614049a","","","0.71073","MoKα","","0.0825","0.0506","","","0.1142","0.1263","","","","","","1.006","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101755","12.227","0.002","11.707","0.002","16.475","0.003","90","","102.516","0.012","90","","2302.2","0.7","173","2","173","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","bis(chloro-1-kappa-Sn)-bis(3-(diphenyl-phosphinoylmethyl)- benzene-1,2-diolat o)-1-kappa$4!-O,2-kappa$2!-P-tin(IV)-palladium(ii)","bis(chloro-1-κ-Sn)-bis(3-(diphenyl-phosphinoylmethyl)-benzene-1,2-diolat o)-1-κ^4^-O,2-κ^2^-P-tin(IV)-palladium(II)","","- C38 H30 Cl2 O4 P2 Pd Sn -","- C38 H30 Cl2 O4 P2 Pd Sn -","- C76 H60 Cl4 O8 P4 Pd2 Sn2 -","2","0.5","","Chikkali, Samir; Gudat, Dietrich; Niemeyer, Mark","Template controlled self-assembly of bidentate phosphine complexes with hemilabile coordination behaviour.","Chemical communications (Cambridge, England)","2007","","9","981","983","10.1039/b616102b","","","0.71073","MoKα","","0.0557","0.0445","","","0.1191","0.1248","","","","","","1.036","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7102077","10.082","0.005","11.384","0.005","15.744","0.008","90","","103.917","0.008","90","","1753.9","1.4","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C39 H31 N5 O9 Zn2 -","- C36 H24 N4 O8 Zn2 -","- C72 H48 N8 O16 Zn4 -","2","0.5","","Horike, Satoshi; Tanaka, Daisuke; Nakagawa, Keiji; Kitagawa, Susumu","Selective guest sorption in an interdigitated porous framework with hydrophobic pore surfaces","Chemical Communications (Cambridge, United Kingdom)","2007","","32","3395","3397","10.1039/b703502k","","","0.7107","MoKα","","0.077","0.06","","","0.1368","0.1449","","","","","","1.068","","","","has coordinates,has disorder","210637","2020-10-21","18:00:00",""
"7102156","16.307","0.003","5.7271","0.0007","24.026","0.003","90","","118.525","0.003","90","","1971.5","0.5","295","2","295","2","","","","","","","Synthesis","3","P 1 2/c 1","-P 2yc","13","","","","- C24 H20 N4 -","- C24 H20 N4 -","- C96 H80 N16 -","4","1","","Hill, Yennifer; Briceño, Alexander","Exploiting the use of hydrogen bonding and metal-coordination in the self-assembly of photoreactive multicomponent networks.","Chemical communications (Cambridge, England)","2007","","38","3930","3932","10.1039/b706936g","","","0.71073","MoKα","","0.117","0.0692","","","0.1514","0.1733","","","","","","1.138","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102250","14.399","0.003","6.3626","0.0015","7.3555","0.0018","90","","102.867","0.004","90","","657","0.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Manganese carboxylate","","","- C14 H10 Mn N0 O6 -","- C14 H10 Mn O6 -","- C28 H20 Mn2 O12 -","2","0.5","","Mahata, Partha; Sundaresan, A; Natarajan, Srinivasan","The role of temperature on the structure and dimensionality of MOFs: an illustrative study of the formation of manganese oxy-bis(benzoate) structures.","Chemical communications (Cambridge, England)","2007","","43","4471","4473","10.1039/b708060c","","","0.71073","MoKα","","0.0524","0.0384","","","0.0814","0.0868","","","","","","1.068","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102669","17.9842","0.0018","13.6634","0.0014","17.9165","0.0018","90","","90.262","0.002","90","","4402.5","0.8","273","2","273","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","p-tert-butyl-calix(4)arene*pentafluorobenzene","p-tert-butyl-calix[4]arene*pentafluorobenzene","","- C50 H57 F5 O4 -","- C50 H57 F5 O4 -","- C200 H228 F20 O16 -","4","1","","Enright, Gary D; Udachin, Konstantin A; Ripmeester, John A","Electrostatic and short-range interactions compete in directing the structure of p-tert-butylcalix[4]arene inclusion compounds of fluorinated benzenes.","Chemical communications (Cambridge, England)","2004","","12","1360","1361","10.1039/b401269k","","","0.71073","MoKα","","0.1293","0.0627","","","0.1377","0.1681","","","","","","0.936","","","","has coordinates,has disorder","180128","2020-10-21","18:00:00",""
"7102671","18.0102","0.0008","13.1981","0.0006","18.0381","0.0008","90","","89.975","0.001","90","","4287.7","0.3","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","p-tert-butyl-calix(4)arene*fluorobenzene","p-tert-butyl-calix[4]arene*fluorobenzene","","- C25 H30.5 F0.5 O2 -","- C25 H30.5 F0.5 O2 -","- C200 H244 F4 O16 -","8","2","","Enright, Gary D; Udachin, Konstantin A; Ripmeester, John A","Electrostatic and short-range interactions compete in directing the structure of p-tert-butylcalix[4]arene inclusion compounds of fluorinated benzenes.","Chemical communications (Cambridge, England)","2004","","12","1360","1361","10.1039/b401269k","","","0.7107","MoKα","","0.1134","0.0644","","","0.1572","0.1894","","","","","","1.009","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102673","17.91","0.002","13.4672","0.0017","17.84","0.002","90","","90.171","0.002","90","","4302.9","0.9","293","","293","","","","","","","","?","4","P 1 2/c 1","-P 2yc","13","","","","- C50 H59 F3 O4 -","- C50 H59 F3 O4 -","- C200 H236 F12 O16 -","4","1","","Enright, Gary D; Udachin, Konstantin A; Ripmeester, John A","Electrostatic and short-range interactions compete in directing the structure of p-tert-butylcalix[4]arene inclusion compounds of fluorinated benzenes.","Chemical communications (Cambridge, England)","2004","","12","1360","1361","10.1039/b401269k","","","0.71073","MoKα","","0.1018","0.0558","","0.1507","0.1376","0.1507","","","","","","0.7635","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7103496","13.069","0.0015","4.9527","0.0005","15.898","0.002","90","","112.114","0.01","90","","953.35","0.19","120","2","120","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","catena-dibromo(mu!2$-1,5,9,13- tetrathiacyclohexadecane)germaniun(ii)","catena-dibromo(μ~2~-1,5,9,13-tetrathiacyclohexadecane)germaniun(II)","","- C12 H24 Br2 Ge S4 -","- C12 H24 Br2 Ge S4 -","- C24 H48 Br4 Ge2 S8 -","2","0.5","","Cheng, Fei; Hector, Andrew L; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian","Coordination networks derived from germanium(ii) thioether macrocyclic complexes-the first authenticated chalcogenoether complexes of Ge(ii).","Chemical communications (Cambridge, England)","2008","","43","5508","5510","10.1039/b809444f","","","0.71073","MoKα","","0.0275","0.0218","","","0.0431","0.0458","","","","","","1.131","","","","has coordinates","180137","2020-10-21","18:00:00",""
"7103525","8.607","0.006","16.521","0.009","20.23","0.01","90","","100.12","0.02","90","","2832","2","213.2","","213","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C63 H48 F6 Fe2 O2 P2 S2 -","- C63 H48 F6 Fe2 O2 P2 S2 -","- C126 H96 F12 Fe4 O4 P4 S4 -","2","0.5","","Motoyama, Keiko; Koike, Takashi; Akita, Munetaka","Remarkable switching behavior of bimodally stimuli-responsive photochromic dithienylethenes with redox-active organometallic attachments.","Chemical communications (Cambridge, England)","2008","","44","5812","5814","10.1039/b809318k","","","0.7107","MoKα","","0.1225","0.0724","","","0.1981","0.2142","","","","","","1.208","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7103726","15.505","0.002","11.28","0.001","21.938","0.002","90","","107.268","0.002","90","","3664","1","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C44 H36 I18 N16 Zn2 -","- C44 H36 I18 N16 Zn2 -","- C88 H72 I36 N32 Zn4 -","2","0.5","","Martin Schroder; Alexander J. Blake; Neil Champness; Caitlin J. Horn; Vito Lippolis","Construction of the first cross-linked double helical polyiodide","Chemical communications (Cambridge, England)","2003","","","","","10.1039/b303289b","","","0.71073","MoKα","","0.0506","0.0361","","","0.0798","0.0868","","","","","","1.081","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7105006","13.5409","0.001","7.4008","0.0006","15.2713","0.0009","90","","101.533","0.003","90","","1499.49","0.19","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C32 H27 Ag N4 O10 S -","- C32 H24 Ag N4 O10 S1.234 -","- C64 H48 Ag2 N8 O20 S2.468 -","2","0.5","","Carpanese, Cristina; Ferlay, Sylvie; Kyritsakas, Nathalie; Henry, Marc; Hosseini, Mir Wais","Molecular tectonics: design of 2-D networks by simultaneous use of charge-assisted hydrogen and coordination bonds.","Chemical communications (Cambridge, England)","2009","","44","6786","6788","10.1039/b908496g","","","0.71073","MoKα","","0.1093","0.0716","","","0.1812","0.2058","","","","","","1.03","","","","has coordinates,has disorder","180154","2020-10-21","18:00:00",""
"7105634","22.2919","0.0007","11.7457","0.0004","9.6074","0.0004","90","","101.837","0.002","90","","2462.05","0.15","150","","150","","","","","","","","Synthesized by the authors. See text","6","P 1 2/c 1","-P 2yc","13","","","","- C27 H22 B2 N2 O S3 -","- C27 H22 B2 N2 O S3 -","- C108 H88 B8 N8 O4 S12 -","4","1","","Lepeltier, Marc; Lukoyanova, Olena; Jacobson, Alex; Jeeva, Shehzad; Perepichka, Dmitrii","New azaborine-thiophene heteroacenes","Chemical Communications","2010","46","37","7007","7009","10.1039/c0cc01963a","","","1.54178","CuKα","","0.0877","0.0822","","","0.2141","0.2192","","","","","","1.096","","","","has coordinates,has disorder","180160","2020-10-21","18:00:00",""
"7105713","23.078","0.009","11.08","0.004","15.594","0.006","90","","106.481","0.004","90","","3824","3","223","2","223","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C42 H34 Cu N2 O10 -","- C42 H34 Cu N2 O10 -","- C168 H136 Cu4 N8 O40 -","4","1","","Yasutaka Inubushi; Satoshi Horike; Tomohiro Fukushima; George Akiyama; Ryotaro Matsuda; Susumu Kitagawa","Modification of Flexible Part in Cu2+ Interdigitated Framework for CH4/CO2 Separation (structures: 'C24 H18 Cu N2 O8' and 'C42 H34 Cu N2 O10')","Chem.Commun.","2010","46","","9229","","10.1039/c0cc01294g","","","0.7107","MoKα","","0.0764","0.0655","","","0.1832","0.1932","","","","","","1.125","","","","has coordinates","180161","2020-10-21","18:00:00",""
"7106079","21.907","0.004","25.058","0.005","22.196","0.004","90","0.0005","108.637","0.0005","90","0.0005","11545","4","173","","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C119 H116 N8 Ni -","- C119 H116 N8 Ni -","- C476 H464 N32 Ni4 -","4","1","","Shimizu, Soji; Zhu, Hua; Kobayashi, Nagao","Azepiphthalocyanine—an unprecedented large twist of a π-conjugation system upon core-modification with a seven-membered ring unit","Chemical Communications (Cambridge, United Kingdom)","2011","47","11","3072","3072","10.1039/c0cc05276k","","","0.7107","MoKα","","0.1178","0.0989","","","0.255","0.2695","","","","","","1.163","","","","has coordinates,has disorder","218736","2020-10-21","18:00:00",""
"7106756","25.6242","0.0017","14.3236","0.0009","25.0786","0.0016","90","","103.088","0.001","90","","8965.5","1","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C22 H124 Cu5.5 N22 Nb12 O60 V3 -","- C22 H87 Cu5.5 N22 Nb12 O60 V3 -","- C88 H348 Cu22 N88 Nb48 O240 V12 -","4","1","","Guiling Guo; Yanqing Xu; Jie Cao; Changwen Hu","An unprecedented vanadoniobate cluster with 'trans-vanadium' bicapped Keggin-type {VNb12O40(VO)2}","Chem.Commun.","2011","47","","9411","","10.1039/c1cc12329g","","","0.71073","MoKα","","0.0438","0.0394","","","0.1036","0.1079","","","","","","1.096","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7106781","35.597","0.0015","24.2342","0.0008","31.2247","0.0017","90","","111.755","0.005","90","","25018","2","120","2","120","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C263 H348 Cd Dy2 N32 O39 -","- C263 H348 Cd Dy2 N32 O39 -","- C1052 H1392 Cd4 Dy8 N128 O156 -","4","1","","Hailong Wang; Kang Qian; Kang Wang; Yongzhong Bian; Jianzhuang Jiang; Song Gao","Sandwich-type Tetrakis(phthalocyaninato) Dysprosium-cadmium Quadruple-decker SMM","Chem.Commun.","2011","47","","9624","","10.1039/c1cc12509e","","","1.54184","CuKα","","0.2538","0.1117","","","0.2493","0.3535","","","","","","1.021","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7106800","32.027","0.009","11.894","0.003","24.907","0.007","90","","107.539","0.003","90","","9047","4","90","","90","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C88 H92 Cu4 F24 N16 O P4 -","- C88 H92 Cu4 F24 N16 O P4 -","- C352 H368 Cu16 F96 N64 O4 P16 -","4","1","","Yoshio Furusho; Hidetoshi Goto; Ken Itomi; Hiroshi Katagiri; Toyoharu Miyagawa; Eiji Yashima","Synthesis and optical resolution of a Cu(I) double-stranded helicate with ketimine-bridged tris(bipyridine) ligands","Chem.Commun.","2011","47","","9795","","10.1039/c1cc13333k","","","0.71073","MoKα","","0.1791","0.1338","","","0.2857","0.3032","","","","","","1.168","","","","has coordinates","180172","2020-10-21","18:00:00",""
"7106811","14.803","0.003","19.96","0.004","14.727","0.003","90","","103.18","0.03","90","","4236.7","1.6","180","2","180","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C38 H36 Cl2 Co2 N10 O4.25 -","- C38 H36 Cl2 Co2 N10 O4.25 -","- C152 H144 Cl8 Co8 N40 O17 -","4","1","","Robert J. Less; Thomas C. Wilson; Mary McPartlin; Paul; T.; Wood; Wright, Dominic","Transition metal complexes of the pentacyanocyclopentadienide anion","Chem.Commun.","2011","47","","10007","","10.1039/c1cc13021h","","","0.71073","MoKα","","0.1005","0.0752","","","0.224","0.2323","","","","","","1.054","","","","has coordinates","180172","2020-10-21","18:00:00",""
"7107178","8.4229","0.001","10.4692","0.0012","17.32","0.002","90","","94.296","0.002","90","","1523","0.3","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","1,1'-bis(pyridine-2yl-methyl)-2,2'-bipiperidine iron diperchlorate bis-acetonitrile","","- C26 H38 Cl2 Fe N6 O9 -","- C26 H38 Cl2 Fe N6 O9 -","- C52 H76 Cl4 Fe2 N12 O18 -","2","0.5","","Elena A. Mikhalyova; Olga V. Makhlynets; Alexander S. Filatov; Elena V. Rybak-Akimova","A new efficient iron catalyst for olefin epoxidation with hydrogen peroxide","Chem.Commun.","2012","48","","687","","10.1039/c1cc15935f","","","0.71073","Mo-Kα","","0.0933","0.0715","","","0.139","0.1487","","","","","","1.094","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7107240","9.471","0.0002","9.4545","0.0002","18.3295","0.0005","90","","90.054","0.001","90","","1641.29","0.07","296","2","296","2","","","","","","","Synthesised","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H36 Cu N9 O6 -","- C26 H36 Cu N9 O6 -","- C52 H72 Cu2 N18 O12 -","2","0.5","","Apurba Kalita; Pankaj Kumar; Ramesh C. Deka; Biplab Mondal","First example of Cu(I)-(e2-O,O)nitrite complex derived from Cu(II)-pnitrosyl","Chem.Commun.","2012","48","","1251","","10.1039/c1cc16316g","","x-ray","0.71073","MoKα","","0.0674","0.0582","","","0.1951","0.202","","","","","","1.1","","","","has coordinates","180176","2020-10-21","18:00:00",""
"7107628","9.3665","0.001","9.6913","0.0011","18.1622","0.0018","90","","90.203","0.005","90","","1648.6","0.3","296","2","296","2","","","","","","","Synthesised","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H36 Cu N9 O7 -","- C26 H36 Cu N9 O7 -","- C52 H72 Cu2 N18 O14 -","2","0.5","","Apurba Kalita; Pankaj Kumar; Biplab Mondal","Reaction of a copper(II)-nitrosyl complex with hydrogen peroxide: putative formation of a copper(I)-peroxynitrite intermediate","Chem.Commun.","2012","48","","4636","","10.1039/c2cc31117h","","x-ray","0.71073","MoKα","","0.0838","0.0664","","","0.2162","0.2274","","","","","","1.071","","","","has coordinates","180180","2020-10-21","18:00:00",""
"7107711","17.379","0.004","7.7605","0.0016","16.708","0.003","90","","101.77","0.03","90","","2206","0.8","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C22 H8 F14 N2 O4 -","- C22 H8 F14 N2 O4 -","- C88 H32 F56 N8 O16 -","4","1","","Aifeng Lv; Yan Li; Wan Yue; Lang Jiang; Huanli Dong; Guangyao Zhao; Qing Meng; Wei Jiang; Yudong He; Zhibo Li; Zhaohui Wang; Wenping Hu","High performance n-type single crystalline transistors of naphthalene bis(dicarboximide) and their anisotropic transport in crystals","Chem.Commun.","2012","48","","5154","","10.1039/c2cc31619f","","","0.71073","MoKα","","0.1153","0.0833","","","0.1476","0.1603","","","","","","1.169","","","","has coordinates","180181","2020-10-21","18:00:00",""
"7107750","23.03","0.004","11.422","0.002","44.36","0.009","90","","91.414","0.006","90","","11665","4","143","1","143","1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C52 H64 Dy K N8 O4 -","- C52 H64 Dy K N8 O4 -","- C416 H512 Dy8 K8 N64 O32 -","8","2","","Ursula J.Williams; Brian D. Mahoney; Patrick T. DeGregorio; Patrick Carroll; Eiko Nakamaru-Ogiso; James M.Kikkawa; Eric J. Schelter","A comparison of the effects of symmetry and magnetoanisotropy on paramagnetic relaxation in related dysprosium single ion magnets","Chem.Commun.","2012","48","","5593","","10.1039/c2cc31227a","","","0.71073","MoKα","","0.0746","0.0662","","","0.1378","0.1404","","","","","","1.207","","","","has coordinates","180181","2020-10-21","18:00:00",""
"7108201","13.4471","0.0003","22.4381","0.0007","18.2824","0.0005","90","","104.442","0.003","90","","5342","0.3","173","2","173","2","","","","","","","","10","P 1 2/c 1","-P 2yc","13","","","","- C97 H88 Ag2 Au6 B4 F16 N12 O4 P6 S2 -","- C97 H78 Ag2 Au6 B4 F16 N12 O4 P6 S2 -","- C194 H156 Ag4 Au12 B8 F32 N24 O8 P12 S4 -","2","0.5","","Li-Qin Mo; Jian-Hua Jia; Li-jia Sun; Quan-Ming Wang","Solvent-induced intercluster rearrangements and the reversible luminescence responses in sulfide bridged gold(I)-silver(I) clusters","Chem.Commun.","2012","48","","8691","","10.1039/c2cc33446a","","","0.71073","MoKα","","0.1141","0.0667","","","0.0992","0.1133","","","","","","1.073","","","","has coordinates,has disorder","180186","2020-10-21","18:00:00",""
"7108408","13.4471","0.0003","22.4381","0.0007","18.2824","0.0005","90","","104.442","0.003","90","","5342","0.3","173","2","173","2","","","","","","","","10","P 1 2/c 1","-P 2yc","13","","","","- C97 H88 Ag2 Au6 B4 F16 N12 O4 P6 S2 -","- C97 H78 Ag2 Au6 B4 F16 N12 O4 P6 S2 -","- C194 H156 Ag4 Au12 B8 F32 N24 O8 P12 S4 -","2","0.5","","Li Qu; Jingui Qin","A simple nickel bis(dithiolene) complex as an excellent n-type molecular semiconductor for field-effect transistors","Chem.Commun.","2012","48","","9965","","10.1039/c2cc33445c","","","0.71073","MoKα","","0.1141","0.0667","","","0.0992","0.1133","","","","","","1.073","","","","has coordinates,has disorder","180188","2020-10-21","18:00:00",""
"7108652","12.454","0.003","15.076","0.003","15.519","0.003","90","","124.822","0.013","90","","2392","1","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C38 H70 Li N6 Si4 Yb -","- C38 H70 Li N6 Si4 Yb -","- C76 H140 Li2 N12 Si8 Yb2 -","2","0.5","","Zhu, Xiancui; Zhou, Shuangliu; Wang, Shaowu; Wei, Yun; Zhang, Lijun; Wang, Fenhua; Wang, Shaoyin; Feng, Zhijun","Rare-earth metal complexes having an unusual indolyl-1,2-dianion through C‒H activation with a novel η1:(μ2‒η1:η1) bonding with metals","Chemical Communications (Cambridge, United Kingdom)","2012","48","98","12020","12022","10.1039/c2cc36045d","","","0.71073","MoKα","","0.1321","0.0684","","","0.1418","0.1726","","","","","","1.009","","","","has coordinates","210889","2020-10-21","18:00:00",""
"7108653","12.431","0.002","15.176","0.003","15.3466","0.0017","90","","124.166","0.009","90","","2395.5","0.7","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C38 H70 Li N6 Si4 Y -","- C38 H70 Li N6 Si4 Y -","- C76 H140 Li2 N12 Si8 Y2 -","2","0.5","","Zhu, Xiancui; Zhou, Shuangliu; Wang, Shaowu; Wei, Yun; Zhang, Lijun; Wang, Fenhua; Wang, Shaoyin; Feng, Zhijun","Rare-earth metal complexes having an unusual indolyl-1,2-dianion through C‒H activation with a novel η1:(μ2‒η1:η1) bonding with metals","Chemical Communications (Cambridge, United Kingdom)","2012","48","98","12020","12022","10.1039/c2cc36045d","","","0.71073","MoKα","","0.1974","0.062","","","0.087","0.1067","","","","","","1.121","","","","has coordinates","210889","2020-10-21","18:00:00",""
"7108725","7.09","0.01","12.017","0.016","20.97","0.03","90","","93.51","0.03","90","","1783","4","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C21 H18 N2 O4 S -","- C21 H18 N2 O4 S -","- C84 H72 N8 O16 S4 -","4","1","","Raju Adepu; Rajnikanth Sunke; Chandana L. T. Meda; D. Rambabu; G. Rama Krishna; C. Malla Reddy; Girdhar Singh Deora; Kishore V. L. Parsa; Manojit Pal","Facile assembly of two 6-membered fused N-heterocyclic rings: a rapid access to novel small molecules via Cu-mediated reaction","Chem.Commun.","2013","49","","190","","10.1039/c2cc37070k","","","0.71073","MoKα","","0.1146","0.0567","","","0.144","0.1749","","","","","","1.039","","","","has coordinates","180191","2020-10-21","18:00:00",""
"7108863","12.3743","0.0008","14.5842","0.0007","21.9435","0.0015","90","","104.821","0.004","90","","3828.4","0.4","123","2","123","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C28 H49 Dy N2 O23 -","- C28 H20 Dy N2 O9 -","- C112 H80 Dy4 N8 O36 -","4","1","","Jian-Ke Sun; Min Ji; Cheng Chen; Wu-Gen Wang; Peng Wang; Rui-Ping Chen; Jie Zhang","A charge-polarized porous metal-organic framework for gas chromatographic separation of alcohols from water","Chemical communications (Cambridge, England)","2013","49","16","1624","1626","10.1039/c3cc38260e","","","0.71073","MoKα","","0.0429","0.0362","","","0.0958","0.0989","","","","","","0.967","","","","has coordinates","180192","2020-10-21","18:00:00",""
"7109242","12.6712","0.0012","11.3892","0.0011","16.3973","0.0015","90","","104.7","0.005","90","","2288.9","0.4","200","2","200","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48.5 H69.6 Cr N6 O2 -","- C42 H54 Cr N6 O2 -","- C84 H108 Cr2 N12 O4 -","2","0.5","","Pei-Fang Wu; Shih-Cheng Liu; Yun-Jen Shieh; Ting-Shen Kuo; Gene-Hsiang Lee; Yu Wang; Yi-Chou Tsai","Divergent reactivity of nitric oxide with metal-metal quintuple bonds","Chem.Commun.","2013","49","","4391","","10.1039/c3cc37118b","","","0.71073","MoKα","","0.1235","0.0801","","","0.2343","0.2553","","","","","","1.032","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7109271","12.6","0.004","16.32","0.005","26.808","0.009","90","","92.213","0.011","90","","5508","3","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C120 H136 N8 O8 P8 -","- C120 H136 N8 O8 P8 -","- C240 H272 N16 O16 P16 -","2","0.5","","Caleb D. Martin; Cory M. Weinstein; Curtis E. Moore; Arnold L. Rheingold; Guy Bertrand","Exploring the reactivity of white phosphorus with electrophilic carbenes: synthesis of a P4 cage and P8 clusters","Chem.Commun.","2013","49","","4486","","10.1039/c3cc42041h","","","0.71073","MoKα","","0.1043","0.0625","","","0.1524","0.1766","","","","","","1.009","","","","has coordinates,has disorder","180196","2020-10-21","18:00:00",""
"7109345","11.7637","0.0005","8.2529","0.0006","17.2302","0.0009","90","","106.419","0.003","90","","1604.57","0.16","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18 H15 Cl Co0.5 P -","- C18 H15 Cl Co0.5 P -","- C72 H60 Cl4 Co2 P4 -","4","1","","Fen Yang; Qi Zhou; Yiquan Zhang; Guang Zeng; Guanghua Li; Zhan Shi; Bingwu Wang; Shouhua Feng","Inspiration from old molecules: field-induced slow magnetic relaxation in three air-stable tetrahedral cobalt(II) compounds","Chem.Commun.","2013","49","","5289","","10.1039/c3cc00277b","","","0.71073","MoKα","","0.0349","0.0271","","","0.0663","0.0714","","","","","","1.03","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7109424","18.248","0.007","10.379","0.005","14.366","0.006","90","","111.215","0.011","90","","2536.5","1.9","200","2","200","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H24 Br2 N2 O6 -","- C26 H24 Br2 N2 O6 -","- C104 H96 Br8 N8 O24 -","4","1","","Eric Daniel Glowacki; Gundula Voss; Kadir Demirak; Marek Havlicek; Nevsal Sunger; Aysu Ceren Okur; Uwe Monkowius; Jacek Gasiorowski; Lucia Leonat; Niyazi Serdar Sariciftci","A facile protection-deprotection route for obtaining indigo pigments as thin films and their applications in organic bulk heterojunctions","Chem.Commun.","2013","49","","6063","","10.1039/c3cc42889c","","","0.71073","MoKα","","0.0975","0.0584","","","0.1272","0.1412","","","","","","1.07","","","","has coordinates","180198","2020-10-21","18:00:00",""
"7109543","16.7149","0.0009","15.1584","0.0008","15.9373","0.0008","90","","112.098","0.002","90","","3741.4","0.3","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","CTHMOF238","uhouston02","","- C32 H16 Cu2 F16 O12 -","- C32 H16 Cu2 F16 O12 -","- C128 H64 Cu8 F64 O48 -","4","1","","Teng-Hao Chen; Ilya Popov; Oussama Zenasni; Olafs Daugulis; Ognjen S. Miljanic","Superhydrophobic perfluorinated metal-organic frameworks","Chem.Commun.","2013","49","","6846","","10.1039/c3cc41564c","","","0.71073","MoKα","","0.0488","0.0394","","","0.105","0.111","","","","","","1.091","","","","has coordinates","204147","2020-10-21","18:00:00",""
"7110571","13.4461","0.0015","11.0332","0.0014","19.2485","0.0013","90","","108.413","0.006","90","","2709.4","0.5","150","2","150","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C15 H5 F9 O -","- C15 H5 F9 O -","- C120 H40 F72 O8 -","8","2","","Batsanov, Andrei S.; Brooke, Gerald M.; Holling, Darren; Kenwright, Alan M.","Pyrolysis reactions of 4-nonafluorobiphenyl prop-2-enyl ether: a remarkable rearrangement reaction","Chemical Communications","1999","","16","1549","","10.1039/a903209f","","","1.54184","CuKα","","0.0648","0.0462","","","0.1","0.1086","","","","","","1.094","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7111346","17.8688","0.0014","5.0625","0.0004","18.6933","0.0015","90","","97.617","0.002","90","","1676.1","0.2","150","1","150","1","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C42 H22 F12 -","- C41.998 H22 F12 -","- C83.996 H44 F24 -","2","0.5","","Wilson, James N.; Smith, Mark D.; Enkelmann, Volker; Bunz, Uwe H. F.","Cruciform ?-systems: effect of aggregation on emissionElectronic supplementary information (ESI) available: X-ray data of 1?4 and electron diffraction (experimental and simulated) of 3. See http://www.rsc.org/suppdata/cc/b4/b406495j/","Chemical Communications","2004","","15","1700","1701","10.1039/b406495j","","","0.71073","MoKα","","0.0662","0.0546","","","0.1344","0.1421","","","","","","1.01","","","","has coordinates,has disorder","180227","2020-10-21","18:00:00",""
"7111434","9.1566","0.0007","12.0396","0.0009","26.852","0.002","90","","97.021","0.002","90","","2938","0.4","298","1","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C70 H76 Ge -","- C70 H76 Ge -","- C140 H152 Ge2 -","2","0.5","","Wong, Wai-Yeung; Poon, Suk-Yue; Lee, Albert W.-M.; Shi, Jian-Xin; Cheah, Kok-Wai","Oligo(fluorenyleneethynylenegermylene)s and their metallopolymers","Chemical Communications","2004","","21","2420","2421","10.1039/b409580d","","","0.7107","MoKα","","","0.051","","","","0.053","","","","","","1.027","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111614","28.219","0.003","6.388","0.0007","24.928","0.003","90","","115.2","0.002","90","","4065.9","0.8","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C31 H35 Co3 O19.5 S2 -","- C31 H30 Co3 O19.5 S2 -","- C124 H120 Co12 O78 S8 -","4","1","","Zhuang, Wenjuan; Sun, Haoling; Xu, Hongbin; Wang, Zheming; Gao, Song; Jin, Linpei","Reversible de-/resolvation and accompanied magnetism modulation in a framework of topologically ferrimagnetic [Co3(μ3-OH)2]n chains linked by a V-shaped ligand 4,4′-dicarboxybiphenyl sulfone","Chemical Communications","2010","46","24","4339","4341","10.1039/c002426k","","","0.71073","MoKα","","0.0991","0.047","","","0.1087","0.1321","","","","","","1.032","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7111728","13.884","0.003","15.417","0.003","24.502","0.005","90","","99.35","0.03","90","","5175","1.9","150","2","150","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","6-KetoMes-ether-dimer","","","- C55 H66 N4 O5 -","- C55 H66 N4 O5 -","- C220 H264 N16 O20 -","4","1","","Hudnall, Todd W.; Moerdyk, Jonathan P.; Bielawski, Christopher W.","Ammonia N‒H activation by a N,N′-diamidocarbene","Chemical Communications","2010","46","24","4288","4290","10.1039/c0cc00638f","","","0.71073","MoKα","","0.2052","0.0823","","","0.1618","0.1888","","","","","","1.004","","","","has coordinates","180231","2020-10-21","18:00:00",""
"7111934","7.3757","0.0003","11.0027","0.0005","17.9502","0.0008","90","","96.2569","0.0014","90","","1448.03","0.11","90","","90","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C26 H18 O4 S2 -","- C26 H18 O4 S2 -","- C52 H36 O8 S4 -","2","0.5","","Dinesh G. (Dan) Patel; Ian M. Walton; Jordan M. Cox; Cody J. Gleason; David R. Butzer; Jason B. Benedict","Photoresponsive porous materials: the design and synthesis of photochromic diarylethene-based linkers and a metal-organic framework","Chem.Commun.","2014","50","","2653","","10.1039/c3cc49666j","","x-ray","0.71073","MoKα","","0.053","0.0423","","","0.1136","0.1189","","","","","","1.083","","","","has coordinates","180233","2020-10-21","18:00:00",""
"7112275","18.981","0.006","12.104","0.004","38.971","0.013","90","","95.486","0.005","90","","8912","5","298","2","298","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C48 H50 Ag2 Cu2 F6 N12 O5 Sb -","- C48 H50 Ag2 Cu2 F6 N12 O5 Sb -","- C192 H200 Ag8 Cu8 F24 N48 O20 Sb4 -","4","1","","Ma, Jian-Ping; Wang, Shen-Qing; Zhao, Chao-Wei; Wang, Hai-Ying; Dong, Yu-Bin","Cu(ii)4L4 coordination-driven molecular container: a reusable visual colorimetric sensor for Ag(i) ions.","Chemical communications (Cambridge, England)","2014","50","36","4721","4724","10.1039/c4cc00118d","","","0.71073","MoKα","","0.1508","0.0572","","","0.131","0.1463","","","","","","0.657","","","","has coordinates,has disorder","180236","2020-10-21","18:00:00",""
"7113344","22.9059","0.0019","8.5806","0.0007","40.738","0.003","90","","93.308","0.002","90","","7993.6","1.1","120","2","120","2","","","","","","","Roberto Quesada","5","P 1 2/c 1","-P 2yc","13","","","","- C41 H56 N6 O3 S -","- C41 H56 N6 O3 S -","- C328 H448 N48 O24 S8 -","8","2","","Evans, Louise S.; Gale, Philip A.; Light, Mark E.; Quesada, Roberto","Anion binding vs. deprotonation in colorimetric pyrrolylamidothiourea based anion sensors.","Chemical communications (Cambridge, England)","2006","","9","965","967","10.1039/b517308f","","","0.6814","synchrotron","","0.1344","0.0901","","","0.2368","0.2735","","","","","","1.042","","","","has coordinates,has disorder","180247","2020-10-21","18:00:00",""
"7113993","12.1035","0.0004","14.2703","0.0006","13.6727","0.0006","90","","97.263","0.002","90","","2342.61","0.16","296","2","296","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C15 H11 N O2 -","- C15 H11 N O2 -","- C120 H88 N8 O16 -","8","2","","Siva Senthil Kumar Boominathan; Wan-Ping Hu; Gopal Chandru Senadi; Jaya Kishore Vandavasi; Jeh-Jeng Wang","A one-pot hypoiodite catalysed oxidative cycloetherification approach to benzoxazoles","Chem.Commun.","2014","50","","6726","","10.1039/C4CC02425G","","x-ray","0.71073","MoKα","","0.1009","0.064","","","0.1733","0.2084","","","","","","1.018","","","","has coordinates","180253","2020-10-21","18:00:00",""
"7114234","28.295","0.006","17.718","0.004","39.725","0.006","90","","101.317","0.018","90","","19528","7","220","2","220","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C206 H184 Cl4 N4 Na2 Ni8 O45 -","- C194 H158 Cl4 N4 Na2 Ni8 O38 -","- C776 H632 Cl16 N16 Na8 Ni32 O152 -","4","1","","Cadiou, Cyril; Coxall, Robert A.; Graham, Alasdair; Harrison, Andrew; Helliwell, Madeleine; Parsons, Simon; Winpenny, Richard E. P.","Octanuclear cobalt and nickel cages featuring formate ligands","Chemical Communications","2002","","10","1106","","10.1039/b202062a","","","1.54184","CuKα","","0.1577","0.0982","","","0.2374","0.2745","","","","","","1.037","","","","has coordinates,has disorder","180256","2020-10-21","18:00:00",""
"7114235","28.29","0.05","17.63","0.01","39.81","0.05","90","","101.31","0.08","90","","19470","4","150","2","150","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C203 H177.5 Cl4 Co8 N4 Na2 O43.25 -","- C194 H158 Cl4 Co8 N4 Na2 O38 -","- C776 H632 Cl16 Co32 N16 Na8 O152 -","4","1","","Cadiou, Cyril; Coxall, Robert A.; Graham, Alasdair; Harrison, Andrew; Helliwell, Madeleine; Parsons, Simon; Winpenny, Richard E. P.","Octanuclear cobalt and nickel cages featuring formate ligands","Chemical Communications","2002","","10","1106","","10.1039/b202062a","","","0.71069","MoKα","","0.1369","0.0666","","","0.1688","0.1927","","","","","","0.928","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7114728","16.946","0.002","7.446","0.0005","15.026","0.003","90","","113.08","0.01","90","","1744.2","0.4","295","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C16 H9 Cl3 N2 O S2 -","- C16 H9 Cl3 N2 O S2 -","- C64 H36 Cl12 N8 O4 S8 -","4","1","","Jeon, Moon-Kook; Kim, Kyongtae; Park, Yung Ja","Novel synthesis of 1-aryl-3-chloro-3-phenylazetidin-2-one-4-spiro-5′-4′-chloro-5′H-1′,2′,3′-dithiazoles and bis(2-oxo-azetidin-4-yl) trisulfides","Chemical Communications","2001","","15","1412","","10.1039/b103974c","","","0.7107","MoKα","","0.0606","0.0455","","","0.1156","0.1257","","","","","","1.052","","","","has coordinates","180261","2020-10-21","18:00:00",""
"7115224","18.9754","0.0004","12.8666","0.0003","19.7197","0.0004","90","","118.571","0.001","90","","4228.25","0.16","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C37.25 H65 N4 Ni O11.75 S -","- C34 H50 N4 Ni O8 S -","- C136 H200 N16 Ni4 O32 S4 -","4","1","","White, David J.; Laing, Norman; Miller, Hamish; Parsons, Simon; Tasker, Peter A.; Coles, Simon","Ditopic ligands for the simultaneous solvent extraction of cations and anions","Chemical Communications","1999","","20","2077","","10.1039/a906490g","","","0.71073","MoKα","","0.0736","0.0502","","","0.1358","0.1457","","","","","","1.084","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7116549","18.1297","0.0008","15.6334","0.0008","26.09","0.0012","90","","93.396","0.003","90","","7381.7","0.6","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C165 H156 Cl6 Nb2 O4 -","- C165 H156 Cl6 Nb2 O4 -","- C330 H312 Cl12 Nb4 O8 -","2","0.5","","Keith Searles; Patrick J. Carroll; Chun-Hsing Chen; Maren Pink; Daniel J. Mindiola","Niobium-nitrides derived from nitrogen splitting","Chem.Commun.","2015","51","","3526","","10.1039/C4cc09563D","","","1.54178","CuKα","","0.0916","0.0645","","","0.19","0.2116","","","","","","1.062","","","","has coordinates,has disorder","180279","2020-10-21","18:00:00",""
"7116847","20.8248","0.0007","7.2192","0.0002","19.4469","0.0007","90","","105.825","0.001","90","","2812.81","0.16","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C34 H26 N4 O4 -","- C34 H26 N4 O4 -","- C136 H104 N16 O16 -","4","1","","Stephane A. Baudron; Herve Ruffin; Mir Wais Hosseini","On Zn(II) 2,2'-bisdipyrrin circular helicates","Chem.Commun.","2015","51","","5906","","10.1039/C5cc00724K","","","0.71073","MoKα","","0.1032","0.0544","","","0.1259","0.1538","","","","","","1.023","","","","has coordinates,has disorder","180282","2020-10-21","18:00:00",""
"7117301","10.8511","0.0006","28.8803","0.0013","19.155","0.0008","90","","123.902","0.003","90","","4982.3","0.4","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C81 H49 O20 Tb3 -","- C81 H49 O20 Tb3 -","- C162 H98 O40 Tb6 -","2","0.5","","Hang Xu; Chun-Shuai Cao; Bin Zhao","A water-stable lanthanide-organic framework as a recyclable luminescent probe for detecting pollutant phosphorus anions","Chem.Commun.","2015","51","","10280","","10.1039/C5cc02596F","","","0.71073","MoKα","","0.1012","0.0825","","","0.2122","0.2313","","","","","","0.964","","","","has coordinates","139256","2020-10-21","18:00:00",""
"7117721","22.018","0.001","20.783","0.001","37.062","0.001","90","","94.845","0.001","90","","16899","1.2","90","2","90","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C199 H189 N23 O53 Zn11 -","- C184 H150 N18 O48 Zn11 -","- C368 H300 N36 O96 Zn22 -","2","0.5","","S. A. Sapchenko; D. N. Dybtsev; D. G. Samsonenko; R. V. Belosludov; V. R. Belosludov; Y. Kawazoe; M. Schroder; V. P. Fedin","Selective gas adsorption in microporous metal-organic frameworks incorporating urotropine basic sites: an experimental and theoretical study","Chem.Commun.","2015","51","","13918","","10.1039/C5cc05779E","","x-ray","0.9","synchrotron","","0.0912","0.0788","","","0.2235","0.2339","","","","","","1.017","","","","has coordinates,has disorder","153831","2020-10-21","18:00:00",""
"7118387","18.257","0.011","8.475","0.006","28.615","0.013","90","","129.59","0.03","90","","3412","4","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C53 H100 N12 Ni2 O24 -","- C53 H68 N12 Ni2 O24 -","- C106 H136 N24 Ni4 O48 -","2","0.5","","Jiang, Xiang; Kou, Hui-Zhong","Solid state reconstructive phase transition from porous supramolecular network to porous coordination polymer.","Chemical communications (Cambridge, England)","2016","52","14","2952","2955","10.1039/c5cc09808d","","","0.71073","MoKα","","0.1552","0.1032","","","0.2938","0.3237","","","","","","1.067","","","","has coordinates,has disorder","177692","2020-10-21","18:00:00",""
"7118647","20.39","0.004","6.3311","0.0013","17.654","0.004","90","","108.999","0.002","90","","2154.8","0.8","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18 H12 F8 I2 N4 -","- C18 H12 F8 I2 N4 -","- C72 H48 F32 I8 N16 -","4","1","","Bushuyev, Oleksandr S.; Tomberg, Anna; Vinden, Joanna R.; Moitessier, Nicolas; Barrett, Christopher J.; Friščić, Tomislav","Azo⋯phenyl stacking: a persistent self-assembly motif guides the assembly of fluorinated cis-azobenzenes into photo-mechanical needle crystals","Chemical Communications (Cambridge, United Kingdom)","2016","52","10","2103","2106","10.1039/c5cc08590j","","","0.71073","MoKα","","0.0613","0.0365","","","0.0636","0.07","","","","","","1.017","","","","has coordinates","209676","2020-10-21","18:00:00",""
"7118708","26.8876","0.0003","16.8644","0.0002","25.0129","0.0003","90","","95.248","0.001","90","","11294.4","0.2","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C65.5 H54 N3 O7.75 Tb -","- C65 H45.5 N3 O7.75 Tb -","- C520 H364 N24 O62 Tb8 -","8","2","","Zhang, Zhao; He, Ya-Ni; Liu, Lin; Lü, Xing-Qiang; Zhu, Xun-Jin; Wong, Wai-Kwok; Pan, Mei; Su, Cheng-Yong","Pure white-light and colour-tuning of Eu(3+)-Gd(3+)-containing metallopolymer.","Chemical communications (Cambridge, England)","2016","52","18","3713","3716","10.1039/c5cc09946c","","","0.71073","MoKα","","0.103","0.0781","","","0.2335","0.2577","","","","","","1.015","","","","has coordinates,has disorder","177646","2020-10-21","18:00:00",""
"7119138","17.8505","0.0005","8.3333","0.0002","13.1813","0.0003","90","","104.671","0.001","90","","1896.84","0.08","93","2","93","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","3PyMeBF3Ph_open","Open-ring isomer of a diarylethene","","- C39 H32 B2 F12 N2 S2 -","- C39 H32 B2 F12 N2 S2 -","- C78 H64 B4 F24 N4 S4 -","2","0.5","","Kazuki Takase; Kengo Hyodo; Masakazu Morimoto; Yuko Kojima; Hiroyuki Mayama; Satoshi Yokojima; Shinichiro Nakamura; Kingo Uchida","Photoinduced reversible formation of a superhydrophilic surface by crystal growth of diarylethene","Chem.Commun.","2016","52","","6885","","","","","1.54178","","","0.0815","0.0799","","","0.2034","0.2049","","","","","","1.064","","","","has coordinates,has disorder","185776","2020-10-21","18:00:00",""
"7119310","16.136","0.003","13.126","0.003","34.238","0.007","90","","90.19","0.03","90","","7252","3","113.15","","113.15","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C102 H98 Cd3 Cl6 K2 N36 O12 -","- C102 H98 Cd3 Cl6 K2 N36 O12 -","- C204 H196 Cd6 Cl12 K4 N72 O24 -","2","0.5","","Wang, Ying; Jia, Wei; Chen, Ran; Zhao, Xiao-Jun; Wang, Zhong-Liang","Guest-induced SC-SC transformation within the first K/Cd heterodimetallic triazole complex: a luminescent sensor for high-explosives and cyano molecules.","Chemical communications (Cambridge, England)","2017","53","3","636","639","10.1039/c6cc09566f","","","0.71073","MoKα","","0.1203","0.1023","","","0.2732","0.2903","","","","","","1.031","","","","has coordinates,has disorder","189804","2020-10-21","18:00:00",""
"7119920","11.4519","0.0006","8.5831","0.0004","13.3683","0.0006","90","","113","0.002","90","","1209.55","0.1","112","2","112","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","JA-ii-32","","","- C20 H40 Cl N Os P2 -","- C20 H40 Cl N Os P2 -","- C40 H80 Cl2 N2 Os2 P4 -","2","0.5","","Abbenseth, Josh; Diefenbach, Martin; Bete, Sarah C.; Würtele, Christian; Volkmann, Christian; Demeshko, Serhiy; Holthausen, Max C.; Schneider, Sven","A Square-Planar Osmium(II) Complex","Chem. Commun.","2017","","","","","10.1039/C7CC01569K","","","0.71073","MoKα","","0.0269","0.0161","","","0.0301","0.0329","","","","","","1.122","","","","has coordinates","195268","2020-10-21","18:00:00",""
"7120027","15.528","0.004","15.999","0.004","13.519","0.003","90","","112.643","0.016","90","","3099.7","1.4","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H6 N2 Nd O7.5 -","- C14 H6 N2 Nd O7.5 -","- C56 H24 N8 Nd4 O30 -","4","1","","Luo, Feng; Gao, Heng Ya; Peng, Wenli; Meng, PanPan; Feng, Xuefeng; Li, Jianqiang; Wu, HuiQiong; Yan, Chang Sheng; Xiaong, Yang Yang","Lanthanide separation using size-selective crystallization of Ln-MOFs","Chem. Commun.","2017","","","","","10.1039/C7CC01898C","","","0.71073","MoKα","","0.139","0.1276","","","0.3124","0.3178","","","","","","1.158","","","","has coordinates","195833","2020-10-21","18:00:00",""
"7120030","15.516","0.004","15.899","0.005","13.27","0.004","90","","112.469","0.011","90","","3025.1","1.5","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18.5 H17 Eu N3.5 O7.5 -","- C18.5 H17 Eu N3.5 O7.5 -","- C74 H68 Eu4 N14 O30 -","4","1","","Luo, Feng; Gao, Heng Ya; Peng, Wenli; Meng, PanPan; Feng, Xuefeng; Li, Jianqiang; Wu, HuiQiong; Yan, Chang Sheng; Xiaong, Yang Yang","Lanthanide separation using size-selective crystallization of Ln-MOFs","Chem. Commun.","2017","","","","","10.1039/C7CC01898C","","","0.71073","MoKα","","0.0573","0.0433","","","0.1291","0.1417","","","","","","1.063","","","","has coordinates","195833","2020-10-21","18:00:00",""
"7120037","15.5354","0.0008","15.8981","0.001","13.3111","0.0008","90","","112.592","0.003","90","","3035.3","0.3","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C16.5 H6 N3.5 O7.5 Sm -","- C16.5 H6 N3.5 O7.5 Sm -","- C66 H24 N14 O30 Sm4 -","4","1","","Luo, Feng; Gao, Heng Ya; Peng, Wenli; Meng, PanPan; Feng, Xuefeng; Li, Jianqiang; Wu, HuiQiong; Yan, Chang Sheng; Xiaong, Yang Yang","Lanthanide separation using size-selective crystallization of Ln-MOFs","Chem. Commun.","2017","","","","","10.1039/C7CC01898C","","","0.71073","MoKα","","0.1125","0.0818","","","0.2122","0.2345","","","","","","1.164","","","","has coordinates","195833","2020-10-21","18:00:00",""
"7120778","16.545","0.003","9.2664","0.0015","20.324","0.003","90","","115.236","0.01","90","","2818.5","0.8","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C44 H94 Ce Cl O13 Si2 -","- C44 H94 Ce Cl O13 Si2 -","- C88 H188 Ce2 Cl2 O26 Si4 -","2","0.5","","Friedrich, Jochen; Maichle-moessmer, Caecilia; Anwander, Reiner","Synthesis and derivatisation of ceric tris(tert-butoxy)siloxides","Chem. Commun.","2017","","","","","10.1039/C7CC06499C","","","0.71073","MoKα","","0.051","0.0348","","","0.0762","0.0824","","","","","","1.046","","","","has coordinates,has disorder","202009","2020-10-21","18:00:00",""
"7121032","17.31","0.003","12.286","0.0006","29.5628","0.0016","90","","102.028","0.009","90","","6149.1","1.2","290.83","0.1","290.83","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C72 H79 N18 O53 Tb3 Zn4 -","- C72 H79 N18 O53 Tb3 Zn4 -","- C144 H158 N36 O106 Tb6 Zn8 -","2","0.5","","Wang, Li; Xu, Cong; Han, Qingxin; Tang, Xiaoliang; Zhou, Panpan; Zhang, Ruilian; Gao, Guoshu; Xu, Benhua; Qin, Wenwu; Liu, Weisheng","Ambient chemical fixation of CO<sub>2</sub> using a highly efficient heterometallic helicate catalyst system.","Chemical communications (Cambridge, England)","2018","54","18","2212","2215","10.1039/c7cc09092g","","x-ray","0.71073","MoKα","","0.1931","0.1293","","","0.2756","0.3156","","","","","","1.106","","","","has coordinates","228439","2020-10-21","18:00:00",""
"7121033","16.7456","0.0018","12.2808","0.0004","27.4108","0.0012","90","","94.542","0.006","90","","5619.3","0.7","297.16","0.1","297.16","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C72 H79 Dy3 N18 O53 Zn4 -","- C72 H79 Dy3 N18 O53 Zn4 -","- C144 H158 Dy6 N36 O106 Zn8 -","2","0.5","","Wang, Li; Xu, Cong; Han, Qingxin; Tang, Xiaoliang; Zhou, Panpan; Zhang, Ruilian; Gao, Guoshu; Xu, Benhua; Qin, Wenwu; Liu, Weisheng","Ambient chemical fixation of CO<sub>2</sub> using a highly efficient heterometallic helicate catalyst system.","Chemical communications (Cambridge, England)","2018","54","18","2212","2215","10.1039/c7cc09092g","","x-ray","0.71073","MoKα","","0.1586","0.0843","","","0.1843","0.234","","","","","","1.031","","","","has coordinates","228439","2020-10-21","18:00:00",""
"7121472","15.9885","0.0007","6.2625","0.0003","14.7453","0.0006","90","","111.597","0.005","90","","1372.77","0.12","93","2","93","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C34 H24 N2 S4 -","- C34 H24 N2 S4 -","- C68 H48 N4 S8 -","2","0.5","","Nakazato, Takumi; Kamatsuka, Takuto; Inoue, Junichi; Sakurai, Tsuneaki; Seki, Shu; Shinokubo, Hiroshi; Miyake, Yoshihiro","The reductive aromatization of naphthalene diimide: a versatile platform for 2,7-diazapyrenes.","Chemical communications (Cambridge, England)","2018","54","41","5177","5180","10.1039/c8cc01937a","","","0.71073","MoKα","","0.0479","0.0461","","","0.1232","0.125","","","","","","1.098","","","","has coordinates","228076","2020-10-21","18:00:00",""
"7121551","10.379","0.003","18.921","0.005","8.611","0.002","90","","109.582","0.003","90","","1593.2","0.7","123","2","123","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C44 H36 B N -","- C44 H36 B N -","- C88 H72 B2 N2 -","2","0.5","","Ando, Naoki; Kushida, Tomokatsu; Yamaguchi, Shigehiro","A planarized B-phenyldibenzoborepin: Impacts of the structural constraint on its electronic properties and Lewis acidity","Chemical Communications","2018","","","","","10.1039/C8CC02837K","","","0.71075","MoKa","","0.0482","0.0418","","","0.1005","0.1042","","","","","","1.058","","","","has coordinates","207433","2020-10-21","18:00:00",""
"7121609","12.264","0.003","11.172","0.003","13.938","0.004","90","","104.374","0.003","90","","1849.9","0.9","100","1","100","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C12 H24 Cl3.5 O3 Pu -","- C12 H24 Cl3.5 O3 Pu -","- C48 H96 Cl14 O12 Pu4 -","4","1","","Pattenaude, Scott A.; Anderson, Nickolas H.; Bart, Suzanne C.; Gaunt, Andrew J.; Scott, Brian L.","Non-aqueous neptunium and plutonium redox behaviour in THF - access to a rare Np(iii) synthetic precursor.","Chemical communications (Cambridge, England)","2018","54","48","6113","6116","10.1039/c8cc02611d","","","0.71073","MoKα","","0.0364","0.0315","","","0.0654","0.0662","","","","","","1.742","","","","has coordinates","228356","2020-10-21","18:00:00",""
"7121674","22.7843","0.0003","8.4334","0.0002","27.6135","0.0005","90","","113.888","0.001","90","","4851.4","0.16","223","2","223","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C59 H46 B F10 P -","- C59 H46 B F10 P -","- C236 H184 B4 F40 P4 -","4","1","","Li, Jun; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard","Selective formation of heterocyclic trans-cycloalkenes by alkyne addition to a biphenylene-based phosphane/borane frustrated Lewis pair.","Chemical communications (Cambridge, England)","2018","54","49","6344","6347","10.1039/c8cc03369b","","","0.71073","MoKα","","0.1433","0.0822","","","0.1328","0.1584","","","","","","1.1","","","","has coordinates,has disorder","228497","2020-10-21","18:00:00",""
"7121984","10.927","0.003","12.297","0.003","30.796","0.007","90","","100.219","0.002","90","","4072.4","1.8","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C57 H45 Dy2 F36 N6 O18 -","- C57 H45 Dy2 F36 N6 O18 -","- C114 H90 Dy4 F72 N12 O36 -","2","0.5","","Xiao, Zhao-Xin; Miao, Hao; Shao, Dong; Wei, Hai-Yan; Zhang, Yi-Quan; Wang, Xin-Yi","Single-molecule magnet behaviour in a dysprosium-triradical complex.","Chemical communications (Cambridge, England)","2018","54","70","9726","9729","10.1039/c8cc04739a","","","0.71073","MoKα","","0.097","0.0572","","","0.133","0.143","","","","","","0.999","","","","has coordinates,has disorder","228020","2020-10-21","18:00:00",""
"7122353","13.4101","0.0009","7.7601","0.0005","13.0837","0.0012","90","","97.493","0.007","90","","1349.91","0.18","93","","93","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","1R","","- C14 H5 Au F5 N O2 -","- C14 H5 Au F5 N O2 -","- C56 H20 Au4 F20 N4 O8 -","4","1","","Seki, Tomohiro; Kobayashi, Koh; Mashimo, Takaki; Ito, Hajime","A gold isocyanide complex with a pendant carboxy group: orthogonal molecular arrangements and hypsochromically shifted luminescent mechanochromism.","Chemical communications (Cambridge, England)","2018","54","79","11136","11139","10.1039/c8cc06490c","","x-ray","1.54184","CuKα","","0.0676","0.0633","","","0.1704","0.1942","","","","","","1.101","","","","has coordinates","228220","2020-10-21","18:00:00",""
"7123913","6.0734","0.0004","14","0.0009","8.5374","0.0005","90","","94.866","0.008","90","","723.3","0.08","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C3 H10 Br4 N6 Pb -","- C3 H10 Br4 N6 Pb -","- C6 H20 Br8 N12 Pb2 -","2","0.5","","Guo, Yuanyuan; McNulty, Jason A.; Mica, Natalie; Samuel, Ifor D. W.; Slawin, Alexandra; Buehl, Michael; Lightfoot, Philip","Structure-directing effects in (110)-layered hybrid perovskites containing two distinct organic moieties","Chemical Communications","2019","","","","","10.1039/C9CC04964A","","","0.71075","MoKα","","0.0318","0.0261","","","0.0604","0.0624","","","","","","1.037","","","","has coordinates","217258","2020-10-21","18:00:00",""
"7123967","13.2366","0.0003","13.574","0.0003","16.9125","0.0005","90","","108.153","0.003","90","","2887.49","0.13","93","2","93","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","5,20-diaza[26]hexaphyrin","","- C33 H31 Cl2 N4 -","- C33 H31 Cl2 N4 -","- C132 H124 Cl8 N16 -","4","1","","Umetani, Masataka; Kim, Jinseok; Tanaka, Takayuki; Kim, Dongho; Osuka, Atsuhiro","5,20-Diheterohexaphyrins: metal-template-free synthesis and aromaticity switching","Chemical Communications","2019","","","","","10.1039/C9CC05580K","","","1.54184","CuKα","","0.0603","0.0521","","","0.1532","0.1609","","","","","","1.041","","","","has coordinates","217468","2020-10-21","18:00:00",""
"7124580","15.1845","0.0004","13.7904","0.0004","16.3311","0.0004","90","","104.673","0.001","90","","3308.2","0.15","150","2","150","2","","","","","","","synthesized by the authors","5","P 1 2/c 1","-P 2yc","13","","","","- C11 H21 N6 O5 P -","- C11 H21 N6 O5 P -","- C88 H168 N48 O40 P8 -","8","2","","Čechová, L; Procházková, E; Císařová, I; Dračínský, M; Janeba, Z.","Separation of planar rotamers through intramolecular hydrogen bonding in polysubstituted 5-nitrosopyrimidines.","Chemical communications (Cambridge, England)","2014","50","94","14892","14895","10.1039/c4cc06978a","","","0.71073","MoKα","","0.0893","0.0683","","","0.1865","0.2055","","","","","","1.039","","","","has coordinates,has disorder","232753","2020-10-21","18:00:00",""
"7124944","18.372","0.006","10.659","0.002","28.255","0.005","90","","100.193","0.01","90","","5446","2","100","2","100","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C56 H82 N4 Na4 O6 -","- C56 H82 N4 Na4 O6 -","- C224 H328 N16 Na16 O24 -","4","1","","Lichtenberg, C.; Krummenacher, I.","Aminotroponiminates as tunable, redox-active ligands: reversible single electron transfer and reductive dimerisation.","Chemical communications (Cambridge, England)","2016","52","65","10044","10047","10.1039/c6cc05762d","","","0.71073","MoKα","","0.1371","0.0706","","","0.1264","0.1462","","","","","","1.026","","","","has coordinates,has disorder","234370","2020-10-21","18:00:00",""
"7125223","31.22","0.004","10.5893","0.0012","13.5925","0.0015","90","","89.984","0.006","90","","4493.7","0.9","296","2","296","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C28 H26 O4 -","- C28 H26 O4 -","- C112 H104 O16 -","4","1","","Lu, Danyang; Wan, Yimei; Kong, Lichun; Zhu, Gangguo","Copper-catalyzed cascade annulation between α-bromocarbonyls and biaryl or (Z)-arylvinylacetylenes enabling a direct synthesis of dibenzocycloheptanes and related compounds.","Chemical communications (Cambridge, England)","2016","52","97","13971","13974","10.1039/c6cc07727g","","","0.71073","MoKα","","0.1945","0.1764","","","0.4273","0.4324","","","","","","2.859","","","","has coordinates","234611","2020-10-21","18:00:00",""
"7125228","10.8018","0.0006","17.3515","0.0009","26.7953","0.0016","90","","97.145","0.003","90","","4983.2","0.5","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C92 H56 N8 Zn2 -","- C92 H56 N8 Zn2 -","- C184 H112 N16 Zn4 -","2","0.5","","Baudron, Stéphane A; Hosseini, Mir Wais","Pre-organization of clefts for Ag-π interactions in Zn(ii) bisdipyrrin helicates for the construction of heterometallic networks.","Chemical communications (Cambridge, England)","2016","52","88","13000","13003","10.1039/c6cc07754d","","","0.71073","MoKα","","0.1039","0.0586","","","0.1573","0.1836","","","","","","1.034","","","","has coordinates","234617","2020-10-21","18:00:00",""
"7125340","23.3487","0.0009","12.1983","0.0005","21.8684","0.0009","90","","92.992","0.004","90","","6219.9","0.4","223","2","223","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C121 H200 N6 O4 Si4 Y2 -","- C121 H192 N6 O4 Si4 Y2 -","- C242 H384 N12 O8 Si8 Y4 -","2","0.5","","Zhuo, Zhixing; Zhang, Chen; Luo, Yunjie; Wang, Yaorong; Yao, Yingming; Yuan, Dan; Cui, Dongmei","Stereo-selectivity switchable ROP of rac-β-butyrolactone initiated by salan-ligated rare-earth metal amide complexes: the key role of the substituents on ligand frameworks.","Chemical communications (Cambridge, England)","2018","54","85","11998","12001","10.1039/c8cc05469j","","","0.71073","MoKα","","0.1221","0.0719","","","0.1757","0.2003","","","","","","1.016","","","","has coordinates,has disorder","236769","2020-10-21","18:00:00",""
"7125342","21.5295","0.0006","12.1512","0.0004","23.1374","0.0007","90","","93.7523","0.0009","90","","6040","0.3","120","2","120","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C107 H182 N6 O4 Si4 Yb2 -","- C107 H182 N6 O4 Si4 Yb2 -","- C214 H364 N12 O8 Si8 Yb4 -","2","0.5","","Zhuo, Zhixing; Zhang, Chen; Luo, Yunjie; Wang, Yaorong; Yao, Yingming; Yuan, Dan; Cui, Dongmei","Stereo-selectivity switchable ROP of rac-β-butyrolactone initiated by salan-ligated rare-earth metal amide complexes: the key role of the substituents on ligand frameworks.","Chemical communications (Cambridge, England)","2018","54","85","11998","12001","10.1039/c8cc05469j","","","0.71073","MoKα","","0.0404","0.0308","","","0.0717","0.0752","","","","","","1.129","","","","has coordinates,has disorder","236769","2020-10-21","18:00:00",""
"7125392","19.6993","0.0003","13.7805","0.0002","17.3821","0.0003","90","","92.071","0.002","90","","4715.57","0.13","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C54 H32 N8 O6 -","- C54 H32 N8 O6 -","- C216 H128 N32 O24 -","4","1","","Wang, Yin-Feng; Lu, Hai-Yan; Shen, Yi-Fan; Li, Meng; Chen, Chuan-Feng","Novel oxacalix[2]arene[2]triazines with thermally activated delayed fluorescence and aggregation-induced emission properties.","Chemical communications (Cambridge, England)","2019","55","64","9559","9562","10.1039/c9cc04995a","","","1.54178","CuKα","","0.0821","0.0644","","","0.1927","0.2088","","","","","","1.069","","","","has coordinates","237844","2020-10-21","18:00:00",""
"7126080","14.4635","0.0013","6.9797","0.0006","25.786","0.002","90","","100.159","0.005","90","","2562.3","0.4","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C30 H30 F N2 Ni O2 -","- C30 H30 F N2 Ni O2 -","- C120 H120 F4 N8 Ni4 O8 -","4","1","","Berkefeld, Andreas; Fröhlich, Markus; Kordan, Mike; Hörner, Gerald; Schubert, Hartmut","Selective metalation of phenol-type proligands for preparative organometallic chemistry.","Chemical communications (Cambridge, England)","2020","56","28","3987","3990","10.1039/d0cc01254h","","","0.71073","MoKα","","0.0504","0.0362","","","0.0895","0.097","","","","","","1.049","","","","has coordinates","251544","2020-10-21","18:00:00",""
"7126115","11.773","0.0003","8.0673","0.0002","22.7281","0.0006","90","","103.72","0.002","90","","2097.04","0.09","170","2","170","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C6 H24 Bi Br6 N3 -","- C6 H24 Bi Br6 N3 -","- C24 H96 Bi4 Br24 N12 -","4","1","","Li, Hui-Hui; Wang, Chang-Feng; Wu, Ya-Xing; Jiang, Fan; Shi, Chao; Ye, Heng-Yun; Zhang, Yi","Halogen substitution regulates the phase transition temperature and band gap of semiconductor compounds.","Chemical communications (Cambridge, England)","2020","56","11","1697","1700","10.1039/c9cc09477f","","","0.71073","MoKα","","0.0816","0.0693","","","0.1751","0.1826","","","","","","1.035","","","","has coordinates","248736","2020-10-21","18:00:00",""
"7126120","11.5267","0.0003","7.8653","0.0002","21.5333","0.0005","90","","103.831","0.002","90","","1895.62","0.08","170","2","170","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C6 H24 Bi Cl6 N3 -","- C6 H24 Bi Cl6 N3 -","- C24 H96 Bi4 Cl24 N12 -","4","1","","Li, Hui-Hui; Wang, Chang-Feng; Wu, Ya-Xing; Jiang, Fan; Shi, Chao; Ye, Heng-Yun; Zhang, Yi","Halogen substitution regulates the phase transition temperature and band gap of semiconductor compounds.","Chemical communications (Cambridge, England)","2020","56","11","1697","1700","10.1039/c9cc09477f","","","0.71073","MoKα","","0.0365","0.0282","","","0.0665","0.0684","","","","","","1.068","","","","has coordinates","248736","2020-10-21","18:00:00",""
"7126271","15.552","0.003","15.578","0.003","45.215","0.01","90","","90.58","0.004","90","","10954","4","193","2","193","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","[(TpAd,iPr)Ca(p-CH2C6H4CH3)(THF)]","","","- C120 H174 B2 Ca2 N12 O2 -","- C120 H174 B2 Ca2 N12 O2 -","- C480 H696 B8 Ca8 N48 O8 -","4","1","","Shi, Xianghui; Hou, Cuiping; Zhao, Lanxiao; Deng, Peng; Cheng, Jianhua","Mononuclear calcium complex as effective catalyst for alkenes hydrogenation.","Chemical communications (Cambridge, England)","2020","56","38","5162","5165","10.1039/d0cc01745k","","","0.71073","MoKα","","0.2307","0.0911","","","0.1914","0.2495","","","","","","0.982","","","","has coordinates,has disorder","252721","2020-10-21","18:00:00",""
"7126317","15.6802","0.0003","20.3433","0.0003","12.4505","0.0002","90","","109.194","0.001","90","","3750.77","0.11","100","","100","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C68 H77 N16 O S6 Sn4 -","- C68 H77 N16 O S6 Sn4 -","- C136 H154 N32 O2 S12 Sn8 -","2","0.5","","Geringer, Eugenie; Leusmann, Eliza; Tambornino, Frank; Gerhard, Marina; Koch, Martin; Dehnen, Stefanie","Trapping of ZnCl<sub>2</sub> by bipyridyl-functionalized organotin sulfide clusters, and its effect on optical properties.","Chemical communications (Cambridge, England)","2020","56","35","4769","4772","10.1039/d0cc01887b","","","1.54186","CuKα","","0.0429","0.0339","","","0.0834","0.0869","","","","","","0.982","","","","has coordinates,has disorder","251585","2020-10-21","18:00:00",""
"7126534","5.1905","0.0005","9.3677","0.0007","23.713","0.003","90","","94.729","0.012","90","","1149.1","0.2","293","2","293.15","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C27 H28 N2 O5 -","- C27 H28 N2 O5 -","- C54 H56 N4 O10 -","2","0.5","","He, Hui-Zi; Li, Kun; Yu, Kang-Kang; Lu, Pei-Long; Feng, Mei-Lin; Chen, Shan-Yong; Yu, Xiao-Qi","Additive- and column-free synthesis of rigid bis-coumarins as fluorescent dyes for G-quadruplex sensing via disaggregation-induced emission.","Chemical communications (Cambridge, England)","2020","56","50","6870","6873","10.1039/d0cc01437k","","x-ray","0.71073","MoKα","","0.1006","0.063","","","0.152","0.1644","","","","","","1.049","","","","has coordinates","253800","2020-10-21","18:00:00",""
"7126938","11.5212","0.0004","12.1354","0.0005","9.7135","0.0003","90","","104.176","0.001","90","","1316.73","0.08","100","","100","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C28 H20 F6 S2 Sn -","- C28 H20 F6 S2 Sn -","- C56 H40 F12 S4 Sn2 -","2","0.5","","Ramirez Y Medina, Isabel-Maria; Rohdenburg, Markus; Lork, Enno; Staubitz, Anne","Aggregation induced emission - emissive stannoles in the solid state.","Chemical communications (Cambridge, England)","2020","56","68","9775","9778","10.1039/d0cc04525j","","x-ray","0.71073","MoKα","","0.0305","0.0244","","","0.0496","0.0517","","","","","","1.083","","","","has coordinates,has disorder","256015","2020-10-21","18:00:00",""
"7128099","16.8017","0.0009","12.0565","0.0007","17.3015","0.001","90","","98.226","0.005","90","","3468.7","0.3","100","0.1","100","0.1","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C4 H29.5 K3.5 Mn N Na1.5 O34.75 W6 -","- C4 H10 K3.5 Mn N Na1.5 O34.75 W6 -","- C16 H40 K14 Mn4 N4 Na6 O139 W24 -","4","1","","Li, Qi; Wei, Yongge","Unprecedented monofunctionalized β-Anderson clusters: [R<sub>1</sub>R<sub>2</sub>C(CH<sub>2</sub>O)<sub>2</sub>Mn<sup>IV</sup>W<sub>6</sub>O<sub>22</sub>]<sup>6-</sup>, a class of potential candidates for new inorganic linkers.","Chemical communications (Cambridge, England)","2021","57","32","3865","3868","10.1039/d1cc00563d","","x-ray","0.71073","MoKα","","0.0688","0.0508","","","0.1019","0.1123","","","","","","1.066","","","","has coordinates,has disorder","264866","2021-05-05","08:03:08",""
"7128101","16.7373","0.0006","12.0905","0.0004","17.2671","0.0005","90","","98.832","0.003","90","","3452.8","0.2","100","0.1","100","0.1","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C4 H28 K3.67 Mn N Na1.33 O33 W6 -","- C4 H10 K3.66665 Mn N Na1.3333 O33 W6 -","- C16 H40 K14.6666 Mn4 N4 Na5.3332 O132 W24 -","4","1","","Li, Qi; Wei, Yongge","Unprecedented monofunctionalized β-Anderson clusters: [R<sub>1</sub>R<sub>2</sub>C(CH<sub>2</sub>O)<sub>2</sub>Mn<sup>IV</sup>W<sub>6</sub>O<sub>22</sub>]<sup>6-</sup>, a class of potential candidates for new inorganic linkers.","Chemical communications (Cambridge, England)","2021","57","32","3865","3868","10.1039/d1cc00563d","","x-ray","0.71073","MoKα","","0.0402","0.0337","","","0.0811","0.0859","","","","","","1.07","","","","has coordinates,has disorder","264866","2021-05-05","08:03:08",""
"7128218","9.3876","0.0003","11.0428","0.0003","15.2827","0.0005","90","","102.186","0.002","90","","1548.59","0.08","170","","170","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C24 H28 Ag2 F12 N4 P2 -","- C24 H28 Ag2 F12 N4 P2 -","- C48 H56 Ag4 F24 N8 P4 -","2","0.5","","Ward, Jas S.; Frontera, Antonio; Rissanen, Kari","Nucleophilic iodonium interactions (NIIs) in 2-coordinate iodine(I) and silver(I) complexes.","Chemical communications (Cambridge, England)","2021","57","41","5094","5097","10.1039/d1cc01505b","","","0.71073","MoKα","","0.0477","0.0345","","","0.072","0.0763","","","","","","1.038","","","","has coordinates","265853","2021-06-05","17:21:24",""
"7128619","24.7464","0.0009","8.0186","0.0003","23.0495","0.0009","90","","104.533","0.0019","90","","4427.4","0.3","130","0.5","130","0.5","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C28 H24 N4 O3 -","- C28 H24 N4 O3 -","- C224 H192 N32 O24 -","8","2","","Vygranenko, Kateryna V.; Poronik, Yevgen M.; Wrzosek, Antoni; Szewczyk, Adam; Gryko, Daniel T.","Red emissive sulfone-rhodols as mitochondrial imaging agents.","Chemical communications (Cambridge, England)","2021","57","63","7782","7785","10.1039/d1cc02687a","","","1.54178","CuKα","","0.1245","0.0977","","","0.2932","0.3189","","","","","","1.214","","","","has coordinates,has disorder","268524","2021-09-06","09:08:22",""
"7128779","23.1321","0.0005","13.8142","0.0003","23.2907","0.0006","90","","112.711","0.001","90","","6865.5","0.3","193","2","193","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C128 H170 Ag2 Au2 F24 O2 P2 Sb4 -","- C128 H170 Ag2 Au2 F24 O2 P2 Sb4 -","- C256 H340 Ag4 Au4 F48 O4 P4 Sb8 -","2","0.5","","Navarro, Miquel; Miranda-Pizarro, Juan; Moreno, Juan J.; Navarro-Gilabert, Carlos; Fernández, Israel; Campos, Jesús","A dicoordinate gold(I)-ethylene complex.","Chemical communications (Cambridge, England)","2021","57","73","9280","9283","10.1039/d1cc02769g","","","0.71073","MoKα","","0.0569","0.046","","","0.1192","0.1261","","","","","","1.03","","","","has coordinates","269613","2021-10-06","13:46:35",""
"7129375","14.9807","0.0007","11.3004","0.0003","21.6896","0.0009","90","","102.043","0.003","90","","3591","0.2","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C36 H46 B2 F5 Li O8 -","- C36 H46 B2 F5 Li O8 -","- C144 H184 B8 F20 Li4 O32 -","4","1","","Budy, Hendrik; Prey, Sven E.; Buch, Christoph D.; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Nucleophilic borylation of fluorobenzenes with reduced arylboranes","Chemical Communications","2021","","","","","10.1039/D1CC06225E","","","0.71073","MoKα","","0.0892","0.0701","","","0.1595","0.1754","","","","","","1.176","","","","has coordinates","271313","2021-12-09","22:57:49",""
"7129376","14.7855","0.0006","11.3455","0.0003","21.3068","0.0008","90","","99.601","0.003","90","","3524.1","0.2","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C36 H49 B2 F2 Li O8 -","- C36 H49 B2 F2 Li O8 -","- C144 H196 B8 F8 Li4 O32 -","4","1","","Budy, Hendrik; Prey, Sven E.; Buch, Christoph D.; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Nucleophilic borylation of fluorobenzenes with reduced arylboranes","Chemical Communications","2021","","","","","10.1039/D1CC06225E","","","0.71073","MoKα","","0.0489","0.0386","","","0.0951","0.1027","","","","","","1.046","","","","has coordinates","271313","2021-12-09","22:57:50",""
"7129658","16.153","0.009","11.48","0.006","21.506","0.012","90","","109.163","0.009","90","","3767","4","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C88 H96 N8 O4 -","- C88 H96 N8 O4 -","- C176 H192 N16 O8 -","2","0.5","","Fong, Angela; Cambell, Cameron; Huynh, Silvia; McCormick McPherson, Laura J.; Teat, Simon; Bebbington, Magnus W. P.; Dalgarno, Scott","Facile Synthetic Routes to Bridge-Functionalised Calix[4]arenes","Chemical Communications","2022","","","","","10.1039/D1CC06889J","","","0.7288","Synchrotron","","0.0719","0.0581","","","0.148","0.1598","","","","","","0.935","","","","has coordinates,has disorder","272499","2022-02-03","22:56:29",""
"7129663","16.3187","0.0002","12.848","0.0002","23.5087","0.0002","90","","106.8","0.001","90","","4718.53","0.1","100","0.1","100","0.1","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C107 H98 Cl2 Fe N5 O Si4 -","- C107 H98 Cl2 Fe N5 O Si4 -","- C214 H196 Cl4 Fe2 N10 O2 Si8 -","2","0.5","","Droege, Daniel G.; Johnstone, Timothy C.","A water-soluble iron-porphyrin complex capable of rescuing CO-poisoned red blood cells","Chemical Communications","2022","","","","","10.1039/D1CC05542A","","x-ray","1.54184","CuKα","","0.069","0.0648","","","0.1816","0.1847","","","","","","1.065","","","","has coordinates,has disorder","272501","2022-02-03","22:58:06",""
"7130491","21.6428","0.0013","11.8899","0.0008","19.3967","0.0011","90","","107.608","0.003","90","","4757.5","0.5","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C47.5 H71 Cl Ga N3 Si Sn -","- C47.5 H71 Cl Ga N3 Si Sn -","- C190 H284 Cl4 Ga4 N12 Si4 Sn4 -","4","1","","Bücker, Anna; Wölper, Christoph; Haberhauer, Gebhard; Schulz, Stephan","Structurally characterised intermediate of the oxidative addition of a heteroleptic germylene to gallanediyle","Chemical Communications","2022","","","","","10.1039/D2CC03561H","","","1.54178","CuKα","","0.0707","0.0506","","","0.1334","0.1564","","","","","","1.043","","","","has coordinates,has disorder","277154","2022-08-08","22:08:30",""
"7131789","17.7093","0.0005","16.7013","0.0006","23.8942","0.0006","90","","91.581","0.002","90","","7064.5","0.4","93","","93","","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C132 H140 F12 N4 O16 P4 Pt2 S4 -","- C132 H140 F12 N4 O16 P4 Pt2 S4 -","- C264 H280 F24 N8 O32 P8 Pt4 S8 -","2","0.5","","Oki, Kosuke; Zheng, Wei; Yashima, Eiji; Ikai, Tomoyuki","Optically-pure triptycene-based metallomacrocycles and homochiral self-sorting assisted by ladder formation","Chemical Communications","2023","","","","","10.1039/D3CC02259E","","x-ray","0.71073","MoKα","","0.152","0.0891","","","0.2502","0.2807","","","","","","1.043","","","","has coordinates,has disorder","284560","2023-06-29","08:45:21",""
"7131853","10.2784","0.0006","22.2038","0.0013","12.5344","0.0005","90","","105.268","0.005","90","","2759.6","0.3","123.1","0.3","123.1","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C61 H73 Cr2 N4 P -","- C61 H73 Cr2 N4 P -","- C122 H146 Cr4 N8 P2 -","2","0.5","","Elsayed Moussa, M.; Rummel, E.-M.; Balázs, G; Riesinger, C.; Noor, A.; Kempe, R.; Scheer, M.","Unusual coordination mode for 1,3-diphosphete ligands towards a Cr-Cr quintuple bond complex.","Chemical communications (Cambridge, England)","2023","59","55","8588","8591","10.1039/d3cc01358h","","","1.54184","CuKα","","0.1074","0.0835","","","0.2358","0.2465","","","","","","1.067","","","","has coordinates,has disorder","285067","2023-07-06","21:57:35",""
"7131914","15.5213","0.0001","11.6302","0.0001","29.0122","0.0002","90","","104.069","0.001","90","","5080.07","0.07","100","2","100","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C61 H70 B Cu N P -","- C61 H70 B Cu N P -","- C244 H280 B4 Cu4 N4 P4 -","4","1","","Lamprecht, Anna; Lindl, Felix; Endres, Lukas; Krummenacher, Ivo; Braunschweig, Holger","Coinage metal complexes of BN analogues of m-terphenyl ligands","Chemical Communications","2023","","","","","10.1039/D3CC03467D","","","1.54184","CuKα","","0.0365","0.0326","","","0.0847","0.0871","","","","","","1.04","","","","has coordinates","285323","2023-07-24","21:55:55",""
"7131916","15.5278","0.0001","11.6023","0.0001","29.4589","0.0002","90","","104.397","0.001","90","","5140.59","0.07","100","2","99.98","0.11","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C61 H70 Au B N P -","- C61 H70 Au B N P -","- C244 H280 Au4 B4 N4 P4 -","4","1","","Lamprecht, Anna; Lindl, Felix; Endres, Lukas; Krummenacher, Ivo; Braunschweig, Holger","Coinage metal complexes of BN analogues of m-terphenyl ligands","Chemical Communications","2023","","","","","10.1039/D3CC03467D","","","1.54184","CuKα","","0.0247","0.0233","","","0.0573","0.0579","","","","","","1.062","","","","has coordinates","285323","2023-07-24","21:55:56",""
"7132115","12.1162","0.0002","9.544","0.0002","22.0199","0.0005","90","","99.289","0.001","90","","2512.92","0.09","298","","298","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C12 H30 Br6 N2 Pb2 -","- C12 H30 Br6 N2 Pb2 -","- C48 H120 Br24 N8 Pb8 -","4","1","","He, Biqi; Kuang, Kuan; Xu, Bing; Tang, Junjie; Cao, Sheng; Yu, Zixian; Li, Mingkai; He, Yunbin; Chen, Junnian","Broadband red emission from one-dimensional hexamethonium lead bromide perovskitoid","Chemical Communications","2023","","","","","10.1039/D3CC03477A","","","0.71073","MoKα","","0.0927","0.0577","","","0.1285","0.1507","","","","","","1.061","","","","has coordinates","286262","2023-09-07","21:55:43",""
"7132223","19.8837","0.0005","18.2597","0.0004","27.4771","0.0008","90","","110.529","0.003","90","","9342.6","0.5","123","2","123","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C120 H56 F32 -","- C120 H56 F32 -","- C480 H224 F128 -","4","1","","Shudo, Hiroki; Kuwayama, Motonobu; Segawa, Yasutomo; Yagi, Akiko; Itami, Kenichiro","Half-substituted fluorocycloparaphenylenes with high symmetry: Synthesis, properties and derivatization to densely substituted carbon nanorings","Chemical Communications","2023","","","","","10.1039/D3CC04887J","","x-ray","0.71073","MoKα","","0.1261","0.0894","","","0.2678","0.3037","","","","","","1.035","","","","has coordinates,has disorder","287018","2023-10-18","21:57:03",""
"7132437","20.2379","0.0007","7.7225","0.0002","18.3961","0.0006","90","","96.014","0.003","90","","2859.25","0.16","293","2","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C20 H34 B20 -","- C20 H34 B20 -","- C80 H136 B80 -","4","1","","Chen, Feijing; Guo, Wenjing; Ma, Yan-Na; Chen, Xuenian","9,9'-Bis-<i>o</i>-carboranes: synthesis and exploration of properties.","Chemical communications (Cambridge, England)","2024","60","5","614","617","10.1039/d3cc05041f","","x-ray","1.54184","CuKα","","0.1137","0.0988","","","0.2969","0.3124","","","","","","1.066","","","","has coordinates","289336","2024-02-04","11:06:44",""
"7132780","14.8717","0.0005","15.8095","0.0005","28.9025","0.0009","90","","103.785","0.002","90","","6599.7","0.4","150","2","150","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C36 H98 I2 K O11 Si8 U -","- C36 H98 I2 K O11 Si8 U -","- C144 H392 I8 K4 O44 Si32 U4 -","4","1","","Lin, Nathan J.; Zeller, Matthias; Bart, Suzanne C.","Solution and solid-state characterization of rare silyluranium(III) complexes.","Chemical communications (Cambridge, England)","2024","60","29","3954","3957","10.1039/d4cc00655k","","","0.71073","MoKα","","0.1344","0.051","","","0.1003","0.1275","","","","","","1.007","","","","has coordinates,has disorder","291498","2024-05-05","00:38:23",""
"7150600","15.718","0.0007","13.3493","0.0006","23.9219","0.001","90","","92.478","0.002","90","","5014.7","0.4","160","1","160","1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C24.5 H28 N4 O2.5 -","- C24 H26 N4 O2 -","- C192 H208 N32 O16 -","8","2","","Rahanyan, Nelli; Linden, Anthony; Baldridge, Kim K.; Siegel, Jay S.","Diels‒Alder reactions of 3,6-disubstituted 1,2,4,5-tetrazines. Synthesis and X-ray crystal structures of diazafluoranthene derivatives","Organic & Biomolecular Chemistry","2009","7","10","2082","2092","10.1039/b820551e","","","0.71073","MoKα","","0.1478","0.0933","","","0.2436","0.2758","","","","","","1.053","","","","has coordinates","180292","2020-10-21","18:00:00",""
"7151686","13.988","0.0002","10.997","0.0002","16.197","0.0002","90","","95.645","0.001","90","","2479.44","0.07","150","2","150","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C32 H24 N2 O4 -","- C32 H23 N2 O4 -","- C128 H92 N8 O16 -","4","1","","Sunderland, Peter T.; Dhami, Archana; Mahon, Mary F.; Jones, Louise A.; Tully, Sophie R.; Lloyd, Matthew D.; Thompson, Andrew S.; Javaid, Hashim; Martin, Niall M. B.; Threadgill, Michael D.","Synthesis of 4-alkyl-, 4-aryl- and 4-arylamino-5-aminoisoquinolin-1-ones and identification of a new PARP-2 selective inhibitor.","Organic & biomolecular chemistry","2011","9","3","881","891","10.1039/C0OB00665C","","","0.71073","MoKα","","0.0836","0.0649","","","0.1729","0.186","","","","","","1.098","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7152843","12.3947","0.0007","8.5143","0.0004","21.6771","0.001","90","","104.571","0.006","90","","2214.1","0.2","294.5","0.14","294.5","0.14","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C22 H24 O6 -","- C22 H24 O6 -","- C88 H96 O24 -","4","1","","Zhang, Jian-Jian; Yan, Chang-Song; Peng, Yu; Luo, Zhen-Biao; Xu, Xiao-Bo; Wang, Ya-Wen","Total synthesis of (±)-sacidumlignans D and A through Ueno-Stork radical cyclization reaction.","Organic & biomolecular chemistry","2013","11","15","2498","2513","10.1039/c3ob00053b","","","0.7107","MoKα","","0.1775","0.0973","","","0.2672","0.3319","","","","","","0.986","","","","has coordinates","180314","2020-10-21","18:00:00",""
"7154242","18.306","0.004","5.603","0.0011","16.578","0.003","90","","101.41","0.03","90","","1666.8","0.6","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","(Z)-4-(1-Fluoro-2-phenylprop-1-en-1-yl)-1-(3-phenylpropyl)-1H-1,2,3-triazole","","- C20 H20 F N3 -","- C20 H20 F N3 -","- C80 H80 F4 N12 -","4","1","","Kumar, Rakesh; Singh, Govindra; Todaro, Louis J.; Yang, Lijia; Zajc, Barbara","E- or Z-Selective synthesis of 4-fluorovinyl-1,2,3-triazoles with fluorinated second-generation Julia-Kocienski reagents.","Organic & biomolecular chemistry","2015","13","5","1536","1549","10.1039/c4ob02179g","","","0.71073","MoKα","","0.1243","0.061","","","0.1177","0.1395","","","","","","1.025","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7155350","11.943","0.002","5.5757","0.0011","27.176","0.006","90","","91.791","0.007","90","","1808.8","0.6","125","","125","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C21 H28 F4 -","- C21 H28 F4 -","- C84 H112 F16 -","4","1","","Al-Maharik, Nawaf; Kirsch, Peer; Slawin, Alexandra M. Z.; Cordes, David B.; O'Hagan, David","Fluorinated liquid crystals: evaluation of selectively fluorinated facially polarised cyclohexyl motifs for liquid crystal applications.","Organic & biomolecular chemistry","2016","14","42","9974","9980","10.1039/c6ob01986b","","","1.54187","CuKα","","0.0537","0.0516","","","0.1699","0.1727","","","","","","1.059","","","","has coordinates","188032","2020-10-21","18:00:00",""
"7155352","11.934","0.003","5.5818","0.0015","26.703","0.007","90","","90.656","0.006","90","","1778.7","0.8","173","","173","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C21 H30 F2 -","- C21 H30 F2 -","- C84 H120 F8 -","4","1","","Al-Maharik, Nawaf; Kirsch, Peer; Slawin, Alexandra M. Z.; Cordes, David B.; O'Hagan, David","Fluorinated liquid crystals: evaluation of selectively fluorinated facially polarised cyclohexyl motifs for liquid crystal applications.","Organic & biomolecular chemistry","2016","14","42","9974","9980","10.1039/c6ob01986b","","","0.71075","MoKα","","0.2025","0.081","","","0.1331","0.1732","","","","","","1.019","","","","has coordinates,has disorder","188032","2020-10-21","18:00:00",""
"7155598","7.2737","0.0003","19.6223","0.0008","26.0959","0.001","90","","94.556","0.002","90","","3712.8","0.3","296","2","296","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C42 H38 N6 O7 -","- C42 H38 N6 O7 -","- C168 H152 N24 O28 -","4","1","","Behera, Harekrushna; V, Ramkumar; Madhavan, Nandita","Triamide macrocyclic chloride receptors via a one-pot tandem reduction-condensation-cyclization reaction","Org. Biomol. Chem.","2017","","","","","10.1039/C7OB00642J","","","0.71073","MoKα","","0.1381","0.0848","","","0.2533","0.297","","","","","","1.051","","","","has coordinates","195908","2020-10-21","18:00:00",""
"7155778","24.6806","0.0006","6.2455","0.0002","16.1174","0.0004","90","","93.541","0.001","90","","2479.64","0.12","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H27 Cl4 N3 O2 -","- C26 H27 Cl4 N3 O2 -","- C104 H108 Cl16 N12 O8 -","4","1","","Wuensch, Bernhard; Wittig, Christian; Schepmann, Dirk; Soeberdt, Michael; Daniliuc, Constantin Gabriel","Stereoselective synthesis of conformationally restricted KOR agonists based on the 2,5-diazabicyclo[2.2.2]octane scaffold","Org. Biomol. Chem.","2017","","","","","10.1039/C7OB01530E","","","1.54178","CuKα","","0.0793","0.0551","","","0.1299","0.1425","","","","","","1.055","","","","has coordinates","198822","2020-10-21","18:00:00",""
"7156083","14.0956","0.0005","11.3444","0.0004","19.9859","0.0005","90","","134.705","0.002","90","","2271.42","0.15","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","4-((4-(trifluoromethyl)isoxazol-5-yl)methyl)benzonitrile","","- C12 H7 F3 N2 O -","- C12 H7 F3 N2 O -","- C96 H56 F24 N16 O8 -","8","2","","Zeng, Qin; Zhang, Li; Xiao, Yuanjing; Zhang, Junliang","Divergent access to N-hydroxypyrroles and isoxazoles via the gold(i)- or Brønsted acid-catalysed regioselective cyclization of N-(2-trifluoromethyl-3-alkynyl) oximes.","Organic & biomolecular chemistry","2018","16","8","1375","1380","10.1039/c7ob03107f","","","0.71073","MoKα","","0.0472","0.0343","","","0.0783","0.0862","","","","","","1.02","","","","has coordinates,has disorder","230642","2020-10-21","18:00:00",""
"7156532","13.042","","5.681","","14.602","","90","","98.86","","90","","1068.98","","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C13 H9 N3 O -","- C13 H9 N3 O -","- C52 H36 N12 O4 -","4","1","","Chen, Zhengwang; Liang, Pei; Liu, Botao; Luo, Haiqing; Zheng, Jing; Wen, Xiaowei; Liu, Tanggao; Ye, Min","A facile tandem decyanation/cyanation reaction of α-iminonitriles toward cyano-substituted amides.","Organic & biomolecular chemistry","2018","16","44","8481","8485","10.1039/c8ob02186d","","","0.71073","MoKα","","0.1469","0.1114","","","0.2549","0.2965","","","","","","1.102","","","","has coordinates","230607","2020-10-21","18:00:00",""
"7159230","28.2772","0.001","11.1135","0.0009","7.9823","0.0003","90","","90.234","0.004","90","","2508.5","0.2","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C26 H26 N4 O5 -","- C24 H20 N4 O4 -","- C96 H80 N16 O16 -","4","1","","Fares, Mohamed; Wu, Xin; McNaughton, Daniel A.; Gilchrist, Alexander M.; Lewis, William; Keller, Paul A.; Arias-Betancur, Alain; Fontova, Pere; Pérez-Tomás, Ricardo; Gale, Philip A.","A potent fluorescent transmembrane HCl transporter perturbs cellular pH and promotes cancer cell death.","Organic & biomolecular chemistry","2023","21","12","2509","2515","10.1039/d3ob00128h","","x-ray","1.54184","CuKα","K-L~2,3~","0.1531","0.0661","","","0.1579","0.2088","","","","","","0.931","","","","has coordinates,has disorder","283488","2023-05-05","03:28:28",""
"7159365","29.3359","0.0004","9.2413","0.0001","38.2126","0.0006","90","","90.052","0.001","90","","10359.5","0.2","293","2","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C8 H8 Br F3 N4 -","- C8 H8 Br F3 N4 -","- C256 H256 Br32 F96 N128 -","32","8","","Lin, Bo; Yao, Yunfei; Wu, Minze; Qin, Lu; Chen, Shouxiong; You, Yi; Weng, Zhiqiang","Synthesis of 2-trifluoromethyl benzimidazoles, benzoxazoles, and benzothiazoles <i>via</i> condensation of diamines or amino(thio)phenols with CF<sub>3</sub>CN.","Organic & biomolecular chemistry","2023","21","23","4788","4793","10.1039/d3ob00517h","","","1.54178","CuKα","","0.1346","0.1209","","","0.344","0.3618","","","","","","1.414","","","","has coordinates","284971","2023-07-05","10:57:16",""
"7159803","23.5597","0.0004","11.55887","0.00018","19.1588","0.0003","90","","93.2727","0.0013","90","","5208.88","0.15","295","","295","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","5,15-bis-trifluoromethyl-10-(p-tolyl)-corrole","","- C62 H42 F12 N8 -","- C62 H42 F12 N8 -","- C248 H168 F48 N32 -","4","1","","Julliard, Paul-Gabriel; Pascal, Simon; Siri, Olivier; Giorgi, Michel; Cortés-Arriagada, Diego; Sanhueza, Luis; Canard, Gabriel","Two-step access to bis-<i>meso</i>-perfluoroalkyl-corroles towards <i>meso</i>-perfluoroacyl-ABC-corroles.","Organic & biomolecular chemistry","2024","22","10","1993","1997","10.1039/d4ob00191e","","x-ray","1.54184","CuKα","","0.0861","0.0765","","","0.23","0.2463","","","","","","1.072","","","","has coordinates","291042","2024-04-05","00:10:28",""
"7200483","12.999","0.003","6.7152","0.0014","16.547","0.003","90","","95.999","0.004","90","","1436.5","0.5","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H24 Co N4 O5 -","- C26 H22 Co N4 O5 -","- C52 H44 Co2 N8 O10 -","2","0.5","","Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Batten, Stuart R.","Four-, and six-connected entangled frameworks based on flexible bis(imidazole) ligands and long dicarboxylate anions","CrystEngComm","2009","11","1","151","159","10.1039/b816356c","","","0.71073","MoKα","","0.1473","0.095","","","0.2125","0.2474","","","","","","1.033","","","","has coordinates","218469","2020-10-21","18:00:00",""
"7200490","3.799","0.0003","10.4652","0.0009","12.4395","0.001","90","","90.309","0.006","90","","494.55","0.07","273","2","273","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C12 H6 O4 -","- C12 H6 O4 -","- C24 H12 O8 -","2","0.5","","Saravanakumar, Rajendran; Varghese, Babu; Sankararaman, Sethuraman","Hydrogen-bond network in isomeric phenylenedipropynoic acids and their DABCO salts. Water mediated helical hydrogen bond motifs","CrystEngComm","2009","11","2","337","346","10.1039/b816658g","","","0.71073","MoKα","","0.0919","0.0683","","","0.1602","0.1736","","","","","","1.191","","","","has coordinates","218424","2020-10-21","18:00:00",""
"7200580","12.6969","0.0007","6.9692","0.0004","23.6089","0.0009","90","","118.499","0.002","90","","1835.94","0.17","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C17 H10 Cu F6 O5 -","- C17 H10 Cu F6 O5 -","- C68 H40 Cu4 F24 O20 -","4","1","","Jiang, Xiu-Juan; Zhang, Su-Zhen; Guo, Jian-Hua; Wang, Xiu-Guang; Li, Jin-Shan; Du, Miao","Structural diversity and modulation of metal‒organic coordination frameworks with a flexible V-shaped dicarboxyl building block","CrystEngComm","2009","11","5","855","","10.1039/b818567k","","","0.71073","MoKα","","0.0309","0.0245","","","0.063","0.067","","","","","","1.009","","","","has coordinates","180336","2020-10-21","18:00:00",""
"7200805","23.6321","0.0003","7.3338","0.0001","16.9532","0.0002","90","","104.131","0.001","90","","2849.3","0.06","130","2","130","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","iodobis(1,10-phenanthroline)copper(ii) phenylsulphonate dihydrate","iodobis(1,10-phenanthroline)copper(II) phenylsulphonate dihydrate","","- C30 H25 Cu I N4 O5 S -","- C30 H23 Cu I N4 O5 S -","- C120 H92 Cu4 I4 N16 O20 S4 -","4","1","","Latham, Kay; Mensforth, Emily J.; Rix, Colin J.; White, Jonathan M.","Synthesis of supramolecular metallo-amine-oxy acid systems via crystal disassembly/reassembly","CrystEngComm","2009","11","7","1343","","10.1039/b822193f","","","1.54184","CuKα","","0.0804","0.0614","","","0.1664","0.1712","","","","","","1.102","","","","has coordinates,has disorder","180339","2020-10-21","18:00:00",""
"7201191","7.2816","0.0002","11.3892","0.0002","15.2587","0.0005","90","","102.407","0.001","90","","1235.88","0.06","123","1","123","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","[Co(CAN)2(4,4'-bipy)(H2O)2].4,4'-bipy","[Co(CAN)2(4,4'-bipy)(H2O)2].4,4'-bipy","","- C22 H20 Co N10 O6 -","- C22 H20 Co N10 O6 -","- C44 H40 Co2 N20 O12 -","2","0.5","","Kutasi, Anna M.; Turner, David R.; Jensen, Paul; Moubaraki, Boujemaa; Batten, Stuart R.; Murray, Keith S.","Coordination polymers of nitrocyanamide, O2NNCN−: synthesis, structure and magnetism","CrystEngComm","2009","11","10","2089","","10.1039/b905970a","","","0.71073","MoKα","","0.1","0.0594","","","0.0801","0.0899","","","","","","1.062","","","","has coordinates","180342","2020-10-21","18:00:00",""
"7201192","7.2742","0.0001","11.485","0.0002","15.2616","0.0003","90","","102.364","0.001","90","","1245.45","0.04","123","1","123","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","{[Fe(CAN)2(4,4'-bipy)(H2O)2].4,4'-bipy}","{[Fe(CAN)2(4,4'-bipy)(H2O)2].4,4'-bipy}","","- C22 H20 Fe N10 O6 -","- C22 H20 Fe N10 O6 -","- C44 H40 Fe2 N20 O12 -","2","0.5","","Kutasi, Anna M.; Turner, David R.; Jensen, Paul; Moubaraki, Boujemaa; Batten, Stuart R.; Murray, Keith S.","Coordination polymers of nitrocyanamide, O2NNCN−: synthesis, structure and magnetism","CrystEngComm","2009","11","10","2089","","10.1039/b905970a","","","0.71073","MoKα","","0.0519","0.0391","","","0.0698","0.0733","","","","","","1.068","","","","has coordinates","180342","2020-10-21","18:00:00",""
"7201193","7.3102","0.0001","11.59","0.0002","15.2784","0.0003","90","","101.865","0.001","90","","1266.81","0.04","123","1","123","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","{[Mn(CAN)2(4,4'-bipy)(H2O)2].4,4'-bipy}","{[Mn(CAN)2(4,4'-bipy)(H2O)2].4,4'-bipy}","","- C22 H20 Mn N10 O6 -","- C22 H20 Mn N10 O6 -","- C44 H40 Mn2 N20 O12 -","2","0.5","","Kutasi, Anna M.; Turner, David R.; Jensen, Paul; Moubaraki, Boujemaa; Batten, Stuart R.; Murray, Keith S.","Coordination polymers of nitrocyanamide, O2NNCN−: synthesis, structure and magnetism","CrystEngComm","2009","11","10","2089","","10.1039/b905970a","","","0.71073","MoKα","","0.0648","0.0378","","","0.0893","0.1013","","","","","","1.071","","","","has coordinates","180342","2020-10-21","18:00:00",""
"7201293","12.5784","0.0014","10.1347","0.0013","15.213","0.002","90","","97.987","0.002","90","","1920.5","0.4","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C36 H33 Cd2 N10 O9.5 -","- C36 H33 Cd2 N10 O9.5 -","- C72 H66 Cd4 N20 O19 -","2","0.5","","Cui, Feng-Yun; Huang, Kun-Lin; Xu, Yan-Qing; Han, Zhan-Gang; Liu, Xi; Chi, Ying-Nan; Hu, Chang-Wen","Structural variability of Cd(II) and Co(II) mixed-ligand coordination polymers: effect of ligand isomerism and metal-to-ligand ratio","CrystEngComm","2009","11","12","2757","","10.1039/b907606a","","","0.71073","MoKα","","0.073","0.0504","","","0.1297","0.1503","","","","","","1.063","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7201503","13.222","0.003","5.8829","0.0001","26.351","0.005","90","","114.443","0.009","90","","1866","0.6","313","2","313","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C44 H26 N8 O9 Zn2 -","- C44 H26 N8 O9 Zn2 -","- C88 H52 N16 O18 Zn4 -","2","0.5","","Wang, Xiu-Li; Bi, Yan-Feng; Liu, Guo-Cheng; Lin, Hong-Yan; Hu, Tong-Liang; Bu, Xian-He","Zn(ii) coordination architectures with mixed ligands of dipyrido[3,2-d ∶ 2′,3′-f]quinoxaline/2,3-di-2-pyridylquinoxaline and benzenedicarboxylate: syntheses, crystal structures, and photoluminescence properties","CrystEngComm","2008","10","3","349","","10.1039/b706071h","","","0.71073","MoKα","","0.0961","0.045","","","0.0833","0.0983","","","","","","0.963","","","","has coordinates","180346","2020-10-21","18:00:00",""
"7201601","9.0649","0.0013","7.1645","0.0011","11.7296","0.0017","90","","102.472","0.003","90","","743.81","0.19","153","2","153","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","2","","","- C14 H12 N2 O10 -","- C14 H12 N2 O10 -","- C28 H24 N4 O20 -","2","0.5","","Kelly, Niamh R.; Goetz, Sandrine; Batten, Stuart R.; Kruger, Paul E.","Coordination behaviour and network formation with 4,4′,6,6′-tetracarboxy-2,2′-bipyridine and 4,4′-dicarboxy-2,2′-bipyridine ligands with rare and alkaline earth metals","CrystEngComm","2008","10","1","68","","10.1039/b711469a","","","0.71073","MoKα","","0.0658","0.043","","","0.1099","0.1221","","","","","","1.021","","","","has coordinates","180347","2020-10-21","18:00:00",""
"7201707","20.384","0.002","8.4343","0.0009","6.9922","0.0008","90","","93.669","0.009","90","","1199.7","0.2","130","2","130","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C6 H10 Cl4 N2 Pb -","- C6 H10 Cl4 N2 Pb -","- C24 H40 Cl16 N8 Pb4 -","4","1","","Dobrzycki, Lukasz; Woźniak, Krzysztof","Inorganic‒organic hybrid salts of diaminobenzenes and related cations","CrystEngComm","2008","10","5","577","","10.1039/b713261a","","","0.71073","MoKα","","0.028","0.0157","","","0.0283","0.0298","","","","","","0.833","","","","has coordinates","180348","2020-10-21","18:00:00",""
"7202094","14.1572","0.0017","9.6534","0.0012","17.317","0.002","90","","91.729","0.002","90","","2365.6","0.5","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C46 H56 Cu N8 O10 S -","- C46 H48 Cu N8 O10 S -","- C92 H96 Cu2 N16 O20 S2 -","2","0.5","","Carlucci, Lucia; Ciani, Gianfranco; Maggini, Simona; Proserpio, Davide M.","Metal‒organic coordination frameworks assembled with the long flexible ligand 4,4′-bis(imidazol-1-ylmethyl)biphenyl","CrystEngComm","2008","10","9","1191","","10.1039/b803815e","","","0.71073","MoKα","","0.0822","0.0654","","0.1929","0.1777","","","","1.041","","","","","","","has coordinates","180351","2020-10-21","18:00:00",""
"7202156","15.9854","0.0015","6.1864","0.0006","16.4143","0.0016","90","","102.642","0.001","90","","1583.9","0.3","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14.5 H16 Mn N O8 -","- C14.5 H16 Mn N O8 -","- C58 H64 Mn4 N4 O32 -","4","1","","Wang, Hong; Wang, Yao-Yu; Yang, Guo-Ping; Wang, Cui-Juan; Wen, Gui-Lin; Shi, Qi-Zhen; Batten, Stuart R.","A series of intriguing metal‒organic frameworks with 3,3′,4,4′- benzophenonetetracarboxylic acid: structural adjustment and pH-dependence","CrystEngComm","2008","10","11","1583","","10.1039/b805727c","","","0.71073","MoKα","","0.0562","0.0399","","","0.0936","0.1043","","","","","","1.118","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202157","15.9043","0.0013","6.1361","0.0005","16.1034","0.0014","90","","102.51","0.001","90","","1534.2","0.2","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14.5 H15 Co N O8 -","- C14.5 H15 Co N O8 -","- C58 H60 Co4 N4 O32 -","4","1","","Wang, Hong; Wang, Yao-Yu; Yang, Guo-Ping; Wang, Cui-Juan; Wen, Gui-Lin; Shi, Qi-Zhen; Batten, Stuart R.","A series of intriguing metal‒organic frameworks with 3,3′,4,4′- benzophenonetetracarboxylic acid: structural adjustment and pH-dependence","CrystEngComm","2008","10","11","1583","","10.1039/b805727c","","","0.71073","MoKα","","0.0546","0.0377","","","0.0812","0.0898","","","","","","1.063","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202158","16.0396","0.0016","6.219","0.0006","16.2606","0.0017","90","","102.787","0.001","90","","1581.8","0.3","291","2","291","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14.5 H15 Mn N O8 -","- C14.5 H15 Mn N O8 -","- C58 H60 Mn4 N4 O32 -","4","1","","Wang, Hong; Wang, Yao-Yu; Yang, Guo-Ping; Wang, Cui-Juan; Wen, Gui-Lin; Shi, Qi-Zhen; Batten, Stuart R.","A series of intriguing metal‒organic frameworks with 3,3′,4,4′- benzophenonetetracarboxylic acid: structural adjustment and pH-dependence","CrystEngComm","2008","10","11","1583","","10.1039/b805727c","","","0.71073","MoKα","","0.0435","0.0342","","","0.083","0.0889","","","","","","1.05","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202235","8.794","0.002","9.856","0.002","15.258","0.003","90","","113","0.011","90","","1217.3","0.5","294","2","294","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C21 H11 Ag3 Er N3 O13 -","- C21 H9 Ag3 Er N3 O13 -","- C42 H18 Ag6 Er2 N6 O26 -","2","0.5","","Zhao, B.; Zhao, X-Q.; Chen, Z.; Shi, W.; Cheng, P.; Yan, S-P.; Liao, D-Z.","Structures and near-infrared luminescence of unique 4d‒4f heterometal‒organic frameworks (HMOF)","CrystEngComm","2008","10","9","1144","","10.1039/b807491g","","","0.71073","MoKα","","0.0401","0.036","","","0.0919","0.0949","","","","","","1.076","","","","has coordinates","180353","2020-10-21","18:00:00",""
"7202252","18.802","0.0017","8.5577","0.0008","16.0542","0.0016","90","","99.469","0.007","90","","2548","0.4","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","none","","","- C22 H18 Cu1.5 N2 O7.5 -","- C22 H17 Cu1.5 N2 O7.5 -","- C88 H68 Cu6 N8 O30 -","4","1","","He, Haiyan; Dai, Fangna; Xie, Aiping; Tong, Xin; Sun, Daofeng","Three novel 3D metal‒organic frameworks with a 1D ladder, tube or chain as assembly units","CrystEngComm","2008","10","10","1429","","10.1039/b808373h","","","0.71073","MoKα","","0.2326","0.0935","","","0.2151","0.2842","","","","","","1.009","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202272","18.3027","0.0005","11.4073","0.0001","13.7081","0.0004","90","","92.44","0.002","90","","2859.44","0.12","273","2","273","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C28 H24 Ag2 N4 O9 S -","- C28 H24 Ag2 N4 O9 S -","- C112 H96 Ag8 N16 O36 S4 -","4","1","","Wang, Yu-Ling; Liu, Qing-Yan; Xu, Li","Two novel luminescent silver(I) coordination polymers containing octanuclear silver cluster units or ligand unsupported Ag⋯Ag interactions constructed from 5-sulfoisophthalic acid (H3SIP) and organic amine","CrystEngComm","2008","10","11","1667","","10.1039/b808571d","","","0.71073","MoKα","","0.1165","0.0662","","","0.1508","0.1864","","","","","","1.003","","","","has coordinates","180353","2020-10-21","18:00:00",""
"7202329","12.6199","0.001","7.8969","0.0006","25.17","0.0017","90","","106.632","0.003","90","","2403.5","0.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C42 H44 Cd Cl2 N12 -","- C42 H44 Cd Cl2 N12 -","- C84 H88 Cd2 Cl4 N24 -","2","0.5","","Du, Miao; Zhang, Zhi-Hui; Wang, Xiu-Guang; Tang, Liang-Fu; Zhao, Xiao-Jun","Structural modulation of polythreading and interpenetrating coordination networks with an elongated dipyridyl building block and various anionic co-ligands","CrystEngComm","2008","10","12","1855","","10.1039/b810121c","","","0.71073","MoKα","","0.0582","0.0483","","","0.1896","0.2007","","","","","","1.304","","","","has coordinates","180354","2020-10-21","18:00:00",""
"7202436","14.4881","0.0018","4.3172","0.0005","14.5404","0.0017","90","","110.928","0.006","90","","849.48","0.18","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C16 H22 Br2 Cd N2 -","- C16 H22 Br2 Cd N2 -","- C32 H44 Br4 Cd2 N4 -","2","0.5","","Costin-Hogan, Christina E.; Chen, Chun-Long; Hughes, Emma; Pickett, Austin; Valencia, Richard; Rath, Nigam P.; Beatty, Alicia M.","“Reverse” engineering: Toward 0-D cadmium halide clusters","CrystEngComm","2008","10","12","1910","","10.1039/b812504j","","","0.71073","MoKα","","0.0328","0.0225","","","0.0399","0.042","","","","","","1.029","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202764","18.91","0.0016","5.9777","0.0006","17.2465","0.0017","90","","96.236","0.004","90","","1938","0.3","90","1","90","1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C25 H20 N2 O3 -","- C25 H20 N2 O3 -","- C100 H80 N8 O12 -","4","1","","Wang, Jing; Ding, Liyu; Yang, Caiqin","Three concomitant polymorphs of 1?:?1 4,4?-dihydroxybenzophenone/1,2-bis(4-pyridyl)-ethylene: applications of hydrothermal method in searching polymorphs","CrystEngComm","2007","9","7","591","","10.1039/b701746d","","","0.71073","MoKα","","0.0743","0.0495","","","0.1178","0.1337","","","","","","1.002","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202798","14.938","0.002","5.2272","0.0008","13.1403","0.0016","90","","109.792","0.013","90","","965.4","0.2","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C12 H16 Cl6 N2 O3 -","- C12 H16 Cl6 N2 O3 -","- C24 H32 Cl12 N4 O6 -","2","0.5","","Dobrzycki, Lukasz; Woźniak, Krzysztof","Structural consequences of benzidine dihydrochloride substitution in the solid state","CrystEngComm","2007","9","11","1029","","10.1039/b702072d","","","0.71073","MoKα","","0.0673","0.0284","","","0.0504","0.0541","","","","","","0.789","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202987","12.4015","0.0012","9.7313","0.0009","26.458","0.003","90","","96.289","0.001","90","","3173.8","0.6","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C36 H29 N3 O7 Zn -","- C36 H29 N3 O7 Zn -","- C144 H116 N12 O28 Zn4 -","4","1","","Du, Miao; Li, Cheng-Peng; Zhao, Xiao-Jun; Yu, Qian","Interplay of coordinative and supramolecular interactions in engineering unusual crystalline architectures of low-dimensional metal‒pamoate complexes under co-ligand intervention","CrystEngComm","2007","9","11","1011","","10.1039/b707853f","","","0.71073","MoKα","","0.0699","0.042","","","0.0999","0.1123","","","","","","1.05","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202992","11.8834","0.0019","15.273","0.002","19.365","0.003","90","","110.135","0.008","90","","3299.9","0.9","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C38 H29 Cd N3 O7 -","- C38 H29 Cd N3 O7 -","- C152 H116 Cd4 N12 O28 -","4","1","","Du, Miao; Li, Cheng-Peng; Zhao, Xiao-Jun; Yu, Qian","Interplay of coordinative and supramolecular interactions in engineering unusual crystalline architectures of low-dimensional metal‒pamoate complexes under co-ligand intervention","CrystEngComm","2007","9","11","1011","","10.1039/b707853f","","","0.71073","MoKα","","0.0437","0.0313","","","0.0822","0.0877","","","","","","1.039","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202993","14.6316","0.001","11.0803","0.0008","11.7201","0.0008","90","","108.242","0.001","90","","1804.6","0.2","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C39 H36 Cu N4 O8 -","- C39 H36 Cu N4 O8 -","- C78 H72 Cu2 N8 O16 -","2","0.5","","Du, Miao; Li, Cheng-Peng; Zhao, Xiao-Jun; Yu, Qian","Interplay of coordinative and supramolecular interactions in engineering unusual crystalline architectures of low-dimensional metal‒pamoate complexes under co-ligand intervention","CrystEngComm","2007","9","11","1011","","10.1039/b707853f","","","0.71073","MoKα","","0.0378","0.0321","","","0.0933","0.0969","","","","","","1.011","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7203290","14.7535","0.0008","10.3848","0.0006","35.2904","0.0019","90","","99.713","0.002","90","","5329.4","0.5","150","2","150","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C50 H51 Cl2 Cu N4 O9.5 S4 -","- C50 H44 Cl2 Cu N4 O9.5 S4 -","- C200 H176 Cl8 Cu4 N16 O38 S16 -","4","1","","Holmes, Kathryn E.; Kelly, Paul F.; Dale, Sophie H.; Elsegood, Mark R. J.","New observations of structural diversity in copper(ii) complexes of diphenylsulfimide","CrystEngComm","2006","8","5","391","","10.1039/b601230b","","","0.71073","MoKα","","0.0868","0.0671","","","0.1611","0.1736","","","","","","1.041","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7203366","13.6684","0.0004","7.4084","0.0002","23.4344","0.0008","90","","101.691","0.0012","90","","2323.76","0.12","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","2D-grid-FeSm","","","- C16 H18 Fe N8 O7 Sm -","- C16 H8 Fe N8 O7 Sm -","- C64 H32 Fe4 N32 O28 Sm4 -","4","1","","Zhang, Yuan-Zhu; Duan, Gong-Ping; Sato, Osamu; Gao, Song","Structures and magnetism of cyano-bridged grid-like two-dimensional 4f?3d arrays","Journal of Materials Chemistry","2006","16","26","2625","","10.1039/b603050e","","","0.71073","MoKα","","0.131","0.0739","","","0.1842","0.1987","","","","","","1.088","","","","has coordinates","180364","2020-10-21","18:00:00",""
"7203456","13.3881","0.001","4.2929","0.0003","12.2521","0.0009","90","","108.273","0.002","90","","668.67","0.08","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C13 H14 Cd Cl2 N2 -","- C13 H14 Cd Cl2 N2 -","- C26 H28 Cd2 Cl4 N4 -","2","0.5","","Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.; Porta, Francesca","New metal?organic frameworks and supramolecular arrays assembled with the bent ditopic ligand 4,4-diaminodiphenylmethane","CrystEngComm","2006","8","9","696","","10.1039/b606482e","","","0.71073","MoKα","","0.023","0.0222","","0.0561","0.0556","","","","1.083","","","","","","","has coordinates","180365","2020-10-21","18:00:00",""
"7203711","17.974","0.006","19.563","0.006","18.139","0.006","90","","114.41","0.01","90","","5808","3","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C42 H26 Ag2 F6 N8 O6 S2 -","- C42 H24 Ag2 F6 N8 O6 S2 -","- C168 H96 Ag8 F24 N32 O24 S8 -","4","1","","Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.; Porta, Francesca","Four new 2D porous polymeric frames from the self-assembly of silver triflate and silver tosylate with free-base and Zn-metallated 5,10,15,20-tetra(4-pyridyl)porphyrin","CrystEngComm","2005","7","11","78","","10.1039/b417709f","","","0.71073","MoKα","","0.1463","0.0553","","0.1432","0.1221","","","","0.764","","","","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203715","16.27","0.0006","11.3714","0.0004","16.604","0.0006","90","","91.6986","0.0016","90","","3070.6","0.19","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","Bis(2,6-bis(3-(hydroxymethyl)pyrazol-1-yl)pyridine)iron(ii) diperchlorate, alpha polymorph","Bis[2,6-bis{3-(hydroxymethyl)pyrazol-1-yl}pyridine]iron(II) diperchlorate, alpha polymorph","","- C26 H26 Cl2 Fe N10 O12 -","- C26 H26 Cl2 Fe N10 O12 -","- C104 H104 Cl8 Fe4 N40 O48 -","4","1","","Jérôme Elhaïk; Colin A. Kilner; Malcolm A. Halcrow","An iron(ii) complex salt that crystallises in three crystal forms, one of which undergoes a sterically controlled incomplete spin-state transition on cooling","CrystEngComm","2005","7","23","151","","10.1039/b417718e","","","0.71073","MoKα","","0.0713","0.0621","","","0.1697","0.1822","","","","","","1.035","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7204111","7.606","0.003","6.773","0.003","34.531","0.002","90","","93.12","0.01","90","","1776.2","1.1","296.2","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C28 H17 N2 O4 S16 -","- C28 H17 N2 O4 S16 -","- C56 H34 N4 O8 S32 -","2","0.5","","Zaman, Md. B.; Toyoda, J.; Morita, Y.; Nakamura, S.; Yamochi, H.; Saito, G.; Nishimura, K.; Yoneyama, N.; Enoki, T.; Nakasuji, K.","Preparation of a Mott insulator based on a BEDT-TTF charge transfer complex of hydrogen cyananilate: α'-(BEDT-TTF)2HCNAL","Journal of Materials Chemistry","2001","11","9","2211","","10.1039/b101635k","","","0.7107","MoKα","","","0.0378","","","","0.037","","","","","","1.001","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204491","7.2582","0.0002","7.3697","0.0002","11.8514","0.0003","90","","99.4053","0.0019","90","","625.42","0.03","150","","150","","","","","","","","?","6","P 1 2/c 1","-P 2yc","13","","","","- C3 H14 N2 O11 S2 U -","- C3 H14 N2 O11 S2 U -","- C6 H28 N4 O22 S4 U2 -","2","0.5","","Thomas, Paul M.; Norquist, Alexander J.; Doran, Michael B.; O'Hare, Dermot","Organically templated uranium(vi) sulfates: understanding phase stability using composition space","Journal of Materials Chemistry","2003","13","1","88","","10.1039/b206694g","","","0.71073","MoKα","","","0.0185","","","","0.0434","","","","","","0.8569","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204822","15.37","0.002","8.7969","0.0012","20.914","0.003","90","","99.398","0.002","90","","2789.8","0.7","150","2","150","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C52 H54 Cu F12 N4 O P2 S4 -","- C52 H54 Cu F12 N4 O P2 S4 -","- C104 H108 Cu2 F24 N8 O2 P4 S8 -","2","0.5","","Holmes, Kathryn E.; Kelly, Paul F.; Elsegood, Mark R. J.","Concomitant polymorphism of [Cu(Ph2SNH)4][PF6]2","CrystEngComm","2004","6","13","56","","10.1039/b316215j","","","0.71073","MoKα","","0.0708","0.0519","","","0.1737","0.1846","","","","","","1.054","","","","has coordinates,has disorder","180379","2020-10-21","18:00:00",""
"7204884","12.009","0.0006","8.5819","0.0004","13.9542","0.0009","90","","103.305","0.002","90","","1399.52","0.13","120","2","120","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C10 H15 Cl2 Cu N5 O -","- C10 H15 Cl2 Cu N5 O -","- C40 H60 Cl8 Cu4 N20 O4 -","4","1","","Suksangpanya, Unchulee; Blake, Alexander J.; Cade, Emma L.; Hubberstey, Peter; Parker, David J.; Wilson, Claire","Hydrogen-bonded supramolecular architectures in (N-(methylpyridin-2-yl)-amidino-O-alkylurea)copper(ii) halides","CrystEngComm","2004","6","28","159","","10.1039/b405875e","","","0.71073","MoKα","","0.0985","0.0494","","","0.0939","0.1094","","","","","","0.999","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7205001","4.6598","0.0007","5.6862","0.0009","4.9159","0.0007","90","","90.521","0.003","90","","130.25","0.03","296","2","296","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","CoMoO4-II","","","- Co Mo O4 -","- Co Mo O4 -","- Co2 Mo2 O8 -","2","0.5","","Livage, Carine; Hynaux, Amélie; Marrot, Jérôme; Nogues, Marc; Férey, Gérard","Solution process for the synthesis of the “high-pressure” phase CoMoO4 and X-ray single crystal resolution","Journal of Materials Chemistry","2002","12","5","1423","","10.1039/b110760g","","","0.71073","MoKα","","0.0329","0.027","","0.0687","0.066","","","","1.05","1.086","1.086","","","","","has coordinates","180381","2020-10-21","18:00:00",""
"7205070","11.845","0.002","14.043","0.003","17.092","0.003","90","","108.75","0.003","90","","2692.2","0.9","291","2","291","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C45 H44 Cd2 N6 O20 -","- C45 H44 Cd2 N6 O20 -","- C90 H88 Cd4 N12 O40 -","2","0.5","","Ji, Chang-Chun; Li, Jing; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Solvothermal synthesis, structures and physical properties of four new complexes constructed from multi-variant tricarboxylate ligand and pyridyl-based ligands","CrystEngComm","2011","13","2","459","","10.1039/c003986a","","","0.71073","MoKα","","0.0675","0.0547","","","0.1447","0.1501","","","","","","1.071","","","","has coordinates","180381","2020-10-21","18:00:00",""
"7205272","17.4744","0.0013","9.8931","0.0008","25.4804","0.0014","90","","131.238","0.003","90","","3312.4","0.4","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C28 H19 Cd11 N8 O1.5 S8.25 Zn -","- C28 H19 Cd N8 O11 S Zn0.5 -","- C112 H76 Cd4 N32 O44 S4 Zn2 -","4","1","","Zhao, Li-Min; Zhang, Zhen-Jie; Zhang, Shi-Yuan; Cui, Ping; Shi, Wei; Zhao, Bin; Cheng, Peng; Liao, Dai-Zheng; Yan, Shi-Ping","Metal‒organic frameworks based on transition-metal carboxylate clusters as secondary building units: synthesis, structures and properties","CrystEngComm","2011","13","3","907","","10.1039/c0ce00315h","","","0.71075","MoKα","","0.1193","0.1023","","","0.2532","0.2613","","","","","","1.657","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7205274","17.181","0.003","9.5978","0.0011","24.677","0.003","90","","130.288","0.009","90","","3104","0.9","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C28 H19 N8 O11 S Zn1.5 -","- C28 H19 N8 O11 S Zn1.5 -","- C112 H76 N32 O44 S4 Zn6 -","4","1","","Zhao, Li-Min; Zhang, Zhen-Jie; Zhang, Shi-Yuan; Cui, Ping; Shi, Wei; Zhao, Bin; Cheng, Peng; Liao, Dai-Zheng; Yan, Shi-Ping","Metal‒organic frameworks based on transition-metal carboxylate clusters as secondary building units: synthesis, structures and properties","CrystEngComm","2011","13","3","907","","10.1039/c0ce00315h","","","0.71073","MoKα","","0.129","0.0762","","","0.1777","0.195","","","","","","1.031","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7205504","3.8169","0.0014","7.901","0.003","26.283","0.009","90","","96.527","0.006","90","","787.5","0.5","291","2","291","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C14 H10 Ag N5 O3 S2 -","- C14 H10 Ag N5 O3 S2 -","- C28 H20 Ag2 N10 O6 S4 -","2","0.5","","Wang, Li; Tao, Tao; Fu, Shu-Jun; Wang, Cheng; Huang, Wei; You, Xiao-Zeng","Linear extension of bithiophene compounds by the combination of C‒N covalent bond cross-coupling and N‒Ag coordinative bond formation","CrystEngComm","2011","13","3","747","","10.1039/c0ce00689k","","","0.71073","MoKα","","0.0729","0.0408","","","0.1006","0.1384","","","","","","1.018","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205597","25.41","0.004","11.2071","0.0015","23.501","0.004","90","","96.552","0.002","90","","6648.7","1.8","223","2","223","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C50 H44 Cl8 N6 O2 S12 Zn3 -","- C50 H36 Cl8 N6 O2 S12 Zn3 -","- C200 H144 Cl32 N24 O8 S48 Zn12 -","4","1","","Zhu, Qin-Yu; Yu, Lei; Qin, Yu-Rong; Huo, Li-Bin; Shao, Ming-Yan; Dai, Jie","Anion-dependent crystallization of zinc complexes with the ligand 4′,5′-diaza-9′-(4,5-disubstituted-1,3-dithiol-2-ylidene) fluorene: Structures and spectroscopic properties","CrystEngComm","2011","13","7","2521","","10.1039/c0ce00424c","","","0.71075","MoKα","","0.1176","0.1033","","","0.1797","0.1862","","","","","","1.185","","","","has coordinates","180386","2020-10-21","18:00:00",""
"7205598","25.617","0.005","11.331","0.002","24.005","0.005","90","","94.519","0.003","90","","6946","2","223","2","223","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C55.5 H54 Cl6 N6 O1.5 S12 Zn3 -","- C55.5 H28 Cl6 N6 O1.5 S12 Zn3 -","- C222 H112 Cl24 N24 O6 S48 Zn12 -","4","1","","Zhu, Qin-Yu; Yu, Lei; Qin, Yu-Rong; Huo, Li-Bin; Shao, Ming-Yan; Dai, Jie","Anion-dependent crystallization of zinc complexes with the ligand 4′,5′-diaza-9′-(4,5-disubstituted-1,3-dithiol-2-ylidene) fluorene: Structures and spectroscopic properties","CrystEngComm","2011","13","7","2521","","10.1039/c0ce00424c","","","0.71075","MoKα","","0.1267","0.1003","","","0.2698","0.2934","","","","","","1.153","","","","has coordinates,has disorder","180386","2020-10-21","18:00:00",""
"7205653","14.536","0.003","5.2295","0.0005","6.4483","0.0008","90","","100.415","0.013","90","","482.1","0.13","294","","294","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C4 H5 Ca0.5 O2 -","- C4 H5 Ca0.5 O2 -","- C16 H20 Ca2 O8 -","4","1","","Hickey, Magali B.; Schlam, Roxana F.; Guo, Chengyun; Cho, Tae H.; Snider, Barry B.; Foxman, Bruce M.","Stereospecific solid-state cyclodimerization of bis(trans-2-butenoato)calcium and triaquabis(trans-2-butenoato)magnesium","CrystEngComm","2011","13","9","3146","","10.1039/c0ce00535e","","","0.71073","MoKα","","0.0455","0.0333","","0.0594","0.042","0.042","","","","","","1.0087","","","","has coordinates,has disorder","288252","2023-12-12","14:26:25",""
"7205846","16.91","0.003","5.8674","0.0012","17.368","0.003","90","","108.49","0.03","90","","1634.3","0.6","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C16 H22 Cd N2 O5 -","- C16 H20 Cd N2 O5 -","- C64 H80 Cd4 N8 O20 -","4","1","","Wang, Xin; Yao, Wei; Qi, Yan-Fei; Luo, Ming-Fa; Wang, Yong-Hui; Xie, Hong-Wei; Yu, Yang; Ma, Rui-Ying; Li, Yang-Guang","From ladder, net to framework: Coordination polymers based on Zn(ii)/Cd(ii) ions and mixed bicarboxyl- and bipyridine-containing linear ligands","CrystEngComm","2011","13","7","2542","","10.1039/c0ce00878h","","","0.71073","MoKα","","0.0333","0.0266","","","0.0644","0.0656","","","","","","1.098","","","","has coordinates","180389","2020-10-21","18:00:00",""
"7205992","8.2118","0.0011","5.068","0.0007","38.683","0.005","90","","93.264","0.006","90","","1607.3","0.4","120","2","120","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Isonicotinamide:azelaic acid","","- C15 H22 N2 O5 -","- C15 H22 N2 O5 -","- C60 H88 N8 O20 -","4","1","","Thompson, Laura J.; Voguri, Raja S.; Male, Louise; Tremayne, Maryjane","The crystal structures and melting point properties of isonicotinamide cocrystals with alkanediacids HO2C(CH2)n−2CO2H n = 7‒9","CrystEngComm","2011","13","12","4188","","10.1039/c1ce05160a","","","0.71073","MoKα","","0.1217","0.088","","","0.1995","0.225","","","","","","1.185","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7205993","8.2223","0.0005","5.1437","0.0003","33.389","0.002","90","","93.873","0.003","90","","1408.9","0.15","120","2","120","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Isonicotinamide:pimelic acid","","- C13 H18 N2 O5 -","- C13 H18 N2 O5 -","- C52 H72 N8 O20 -","4","1","","Thompson, Laura J.; Voguri, Raja S.; Male, Louise; Tremayne, Maryjane","The crystal structures and melting point properties of isonicotinamide cocrystals with alkanediacids HO2C(CH2)n−2CO2H n = 7‒9","CrystEngComm","2011","13","12","4188","","10.1039/c1ce05160a","","","0.71073","MoKα","","0.0901","0.0557","","","0.1184","0.1337","","","","","","1.077","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7206203","10.6942","0.0002","5.73","0.0001","15.4546","0.0005","90","","108.438","0.0009","90","","898.41","0.04","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C6 H16 Cl6 Cu N12 -","- C6 H16 Cl6 Cu N12 -","- C12 H32 Cl12 Cu2 N24 -","2","0.5","","Weng, Dan-Feng; Wang, Bing-Wu; Wang, Zhe-Ming; Gao, Song","Polymorphism of (H2mela)2[CuCl5]Cl (mela = melamine): structures, transformation and magnetic properties","CrystEngComm","2011","13","14","4683","","10.1039/c1ce05143a","","","0.71073","MoKα","","0.0451","0.0285","","","0.0715","0.0759","","","","","","1.021","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7206317","13.464","0.003","12.053","0.002","14.304","0.003","90","","95.68","0.03","90","","2309.9","0.8","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C14 H20 Fe N5 O7 S4 -","- C14 H20 Fe N5 O7 S4 -","- C56 H80 Fe4 N20 O28 S16 -","4","1","","Kara, Hulya; Adams, Christopher J.; Schwarz, Björn; Orpen, A. Guy","The use of [Fe(dithiooxalate)2(NO)]2− as a tecton in crystal engineering","CrystEngComm","2011","13","16","5082","","10.1039/c1ce05309d","","","0.71073","MoKα","","0.0324","0.0299","","","0.0741","0.0755","","","","","","1.075","","","","has coordinates","180394","2020-10-21","18:00:00",""
"7206371","7.7391","0.0004","5.2338","0.0002","26.9102","0.0013","90","","90.321","0.005","90","","1089.98","0.09","294","2","294","1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","NppM","","","- C13 H12 N2 O -","- C13 H12 N2 O -","- C52 H48 N8 O4 -","4","1","","Mocilac, Pavle; Gallagher, John F.","Structural systematics and conformational analyses of a 3 ×3 isomer grid of nine N-(tolyl)pyridinecarboxamides and three chlorinated relatives","CrystEngComm","2011","13","17","5354","","10.1039/c1ce05169e","","","0.71073","MoKα","","0.0816","0.0512","","","0.1285","0.1405","","","","","","0.97","","","","has coordinates","180394","2020-10-21","18:00:00",""
"7206617","6.6641","0.0002","7.7528","0.0003","19.6619","0.0007","90","","109.75","0.003","90","","956.08","0.06","294","2","294","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18 H11 La2 N3 O13 -","- C18 H11 La2 N3 O13 -","- C36 H22 La4 N6 O26 -","2","0.5","","Fang, Shao-Ming; Hu, Min; Jia, Li-Ran; Wang, Cong; Zhang, Qiang; Ma, Song-Tao; Du, Miao; Liu, Chun-Sen","Highly-thermostable lanthanide‒organic coordination frameworks with N-protonated 2,6-dihydroxypyridine-4-carboxylate exhibiting unusual 3-D mixed-connected network topology","CrystEngComm","2011","13","21","6555","","10.1039/c1ce05465a","","","0.71073","MoKα","","0.0386","0.0228","","","0.0304","0.0312","","","","","","0.883","","","","has coordinates,has disorder","180397","2020-10-21","18:00:00",""
"7206618","6.5605","0.0007","7.6743","0.0008","19.351","0.002","90","","108.709","0.009","90","","922.79","0.17","294","2","294","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18 H11 N3 O13 Sm2 -","- C18 H11 N3 O13 Sm2 -","- C36 H22 N6 O26 Sm4 -","2","0.5","","Fang, Shao-Ming; Hu, Min; Jia, Li-Ran; Wang, Cong; Zhang, Qiang; Ma, Song-Tao; Du, Miao; Liu, Chun-Sen","Highly-thermostable lanthanide‒organic coordination frameworks with N-protonated 2,6-dihydroxypyridine-4-carboxylate exhibiting unusual 3-D mixed-connected network topology","CrystEngComm","2011","13","21","6555","","10.1039/c1ce05465a","","","0.71073","MoKα","","0.0605","0.0316","","","0.0498","0.0527","","","","","","0.98","","","","has coordinates,has disorder","180397","2020-10-21","18:00:00",""
"7206619","6.6571","0.0006","7.6931","0.0007","19.61","0.002","90","","108.808","0.008","90","","950.68","0.16","294","2","294","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18 H9 La2 N3 O12 -","- C18 H9 La2 N3 O12 -","- C36 H18 La4 N6 O24 -","2","0.5","","Fang, Shao-Ming; Hu, Min; Jia, Li-Ran; Wang, Cong; Zhang, Qiang; Ma, Song-Tao; Du, Miao; Liu, Chun-Sen","Highly-thermostable lanthanide‒organic coordination frameworks with N-protonated 2,6-dihydroxypyridine-4-carboxylate exhibiting unusual 3-D mixed-connected network topology","CrystEngComm","2011","13","21","6555","","10.1039/c1ce05465a","","","0.71073","MoKα","","0.0793","0.0675","","","0.2079","0.2238","","","","","","1.045","","","","has coordinates","180397","2020-10-21","18:00:00",""
"7206620","6.5238","0.0002","7.6246","0.0002","19.2614","0.0007","90","","108.791","0.003","90","","907.02","0.05","294","2","294","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18 H9 N3 O12 Sm2 -","- C18 H9 N3 O12 Sm2 -","- C36 H18 N6 O24 Sm4 -","2","0.5","","Fang, Shao-Ming; Hu, Min; Jia, Li-Ran; Wang, Cong; Zhang, Qiang; Ma, Song-Tao; Du, Miao; Liu, Chun-Sen","Highly-thermostable lanthanide‒organic coordination frameworks with N-protonated 2,6-dihydroxypyridine-4-carboxylate exhibiting unusual 3-D mixed-connected network topology","CrystEngComm","2011","13","21","6555","","10.1039/c1ce05465a","","","0.71073","MoKα","","0.0313","0.0259","","","0.0604","0.0628","","","","","","1.068","","","","has coordinates","180397","2020-10-21","18:00:00",""
"7206625","8.9652","0.0001","9.6841","0.0002","15.5712","0.0003","90","","90.783","0.001","90","","1351.76","0.04","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C18 H24 Co N14 O2 S2 -","- C18 H24 Co N14 O2 S2 -","- C36 H48 Co2 N28 O4 S4 -","2","0.5","","Li, Xia; Gu, Ya-Kun; Deng, Xue-Bin; Zhao, Kai; Jin, Lin-Pei","Effect of anions on architectures of transition metal complexes with 1,4-bis(1,2,4-triazol-1-yl)butane","CrystEngComm","2011","13","22","6665","","10.1039/c1ce05491k","","","0.71073","MoKα","","0.0841","0.0659","","","0.1922","0.2118","","","","","","1.026","","","","has coordinates,has disorder","180397","2020-10-21","18:00:00",""
"7206631","8.4528","0.0017","8.9701","0.0018","15.53","0.003","90","","104.559","0.003","90","","1139.7","0.4","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C8 H12 Cu N3 O4 -","- C8 H12 Cu N3 O4 -","- C32 H48 Cu4 N12 O16 -","4","1","","Li, Xia; Gu, Ya-Kun; Deng, Xue-Bin; Zhao, Kai; Jin, Lin-Pei","Effect of anions on architectures of transition metal complexes with 1,4-bis(1,2,4-triazol-1-yl)butane","CrystEngComm","2011","13","22","6665","","10.1039/c1ce05491k","","","0.71073","MoKα","","0.0522","0.0368","","","0.0847","0.0904","","","","","","1.082","","","","has coordinates","180397","2020-10-21","18:00:00",""
"7206793","10.0124","0.0006","14.1908","0.0009","21.6482","0.0016","90","","102.265","0.002","90","","3005.7","0.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C47 H60 Cu4 N4 O24 -","- C47 H60 Cu4 N4 O24 -","- C94 H120 Cu8 N8 O48 -","2","0.5","","Yu, Fan; Li, Bao","Temperature-controlled synthesis of two novel coordination polymers modeled by semi-rigid tetrapyridines","CrystEngComm","2011","13","23","7025","","10.1039/c1ce05549f","","","0.71073","MoKα","","0.066","0.0486","","","0.1254","0.1346","","","","","","1.093","","","","has coordinates","180398","2020-10-21","18:00:00",""
"7206845","11.4997","0.0003","11.122","0.0004","22.5876","0.0006","90","","91.285","0.002","90","","2888.22","0.15","193","2","193","2","","","","","","","synthesis as described","4","P 1 2/c 1","-P 2yc","13","","","","- C17 H14 N2 O2 -","- C17 H14 N2 O2 -","- C136 H112 N16 O16 -","8","2","","Artigau, Marine; Bonnet, Antoine; Ladeira, Sonia; Hoffmann, Pascal; Vigroux, Alain","A free-base dipyrrin capable of forming extended architectures comparable to those of its metal(ii) complex counterparts","CrystEngComm","2011","13","23","7149","","10.1039/c1ce05913k","","x-ray","0.71073","MoKα","","0.1025","0.0505","","","0.1167","0.1377","","","","","","1.033","","","","has coordinates","180399","2020-10-21","18:00:00",""
"7206847","11.532","0.0013","11.0426","0.001","22.891","0.003","90","","90.073","0.004","90","","2915","0.6","193","2","193","2","","","","","","","synthesis as described","5","P 1 2/c 1","-P 2yc","13","","","","- C34 H26 N4 O4 Zn -","- C34 H26 N4 O4 Zn -","- C136 H104 N16 O16 Zn4 -","4","1","","Artigau, Marine; Bonnet, Antoine; Ladeira, Sonia; Hoffmann, Pascal; Vigroux, Alain","A free-base dipyrrin capable of forming extended architectures comparable to those of its metal(ii) complex counterparts","CrystEngComm","2011","13","23","7149","","10.1039/c1ce05913k","","x-ray","0.71073","MoKα","","0.1044","0.0486","","","0.0962","0.1161","","","","","","1.006","","","","has coordinates","180399","2020-10-21","18:00:00",""
"7206885","13.698","0.005","16.631","0.005","14.562","0.005","90","0.005","95.825","0.005","90","0.005","3300.3","1.9","150","","150","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C53 H28 Cu2 O10 -","- C26.5 H14 Cu O5 -","- C106 H56 Cu4 O20 -","4","1","","Moreau, Florian; Audebrand, Nathalie; Poriel, Cyril; Moizan-Baslé, Virginie; Ouvry, Jean","A 9,9′-spirobifluorene based Metal‒Organic Framework: synthesis, structure analysis and gas sorption properties","Journal of Materials Chemistry","2011","21","46","18715","","10.1039/c1jm12859k","","","0.71069","MoKα","","0.0789","0.049","","","0.1395","0.1504","","","","","","0.958","","","","has coordinates","180399","2020-10-21","18:00:00",""
"7206892","6.8155","0.0014","11.734","0.002","11.551","0.002","90","","103.23","0.03","90","","899.3","0.3","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C9 H8 N2 O4 -","- C9 H7 N2 O4 -","- C36 H28 N8 O16 -","4","1","","Yong, Guo-Ping; Zhang, Yi-Man; She, Wen-Long; Li, Ying-Zhou","Stacking-induced white-light and blue-light phosphorescence from purely organic radical materials","Journal of Materials Chemistry","2011","21","46","18520","","10.1039/c1jm14690d","","","0.71073","MoKα","","0.1529","0.0923","","","0.233","0.2717","","","","","","1.069","","","","has coordinates","180399","2020-10-21","18:00:00",""
"7207146","7.8622","0.0005","7.8443","0.0004","14.2865","0.0009","90","","102.523","0.006","90","","860.14","0.09","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C16 H12 Cd N2 O8 -","- C16 H12 Cd N2 O8 -","- C32 H24 Cd2 N4 O16 -","2","0.5","","Kong, Guo-Qiang; Wu, Chuan-De","Five coordination networks based on zwitterionic ligands: synthesis, crystal structures and optical properties","CrystEngComm","2012","14","3","847","","10.1039/c1ce06052j","","","0.71073","MoKα","","0.051","0.0452","","","0.1035","0.1065","","","","","","1.126","","","","has coordinates","180402","2020-10-21","18:00:00",""
"7207207","16.592","0.005","10.452","0.003","16.77","0.005","90","","90.42","0.007","90","","2908.2","1.5","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","poly(Dicadmium bis(1,4-bis(imidazol-1'-yl)butane)bis(u-bromide)dibromide)","","","- C20 H28 Br4 Cd2 N8 O0 -","- C20 H28 Br4 Cd2 N8 -","- C80 H112 Br16 Cd8 N32 -","4","1","","Li, Xiaoju; Guo, Xiaofang; Weng, XiuLan; Lin, Shen","Two novel 2D cadmium(ii) MOFs based on flexible bis(imidazolyl) and zwitterionic dicarboxylate ligands","CrystEngComm","2012","14","4","1412","","10.1039/c1ce06216f","","","0.71073","MoKα","","0.0548","0.0383","","","0.0825","0.0901","","","","","","1.07","","","","has coordinates","180403","2020-10-21","18:00:00",""
"7207252","29.5578","0.0014","10.5995","0.0006","7.5118","0.0004","90","","91.337","0.004","90","","2352.8","0.2","296","","296","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H16 N6 O7 Pb -","- C14 H16 N6 O7 Pb -","- C56 H64 N24 O28 Pb4 -","4","1","","Hashemi, Lida; Morsali, Ali","Microwave assisted synthesis of a new lead(ii) porous three-dimensional coordination polymer: study of nanostructured size effect on high iodide adsorption affinity","CrystEngComm","2012","14","3","779","","10.1039/c2ce06133c","","","0.71073","MoKα","","0.0777","0.0455","","","0.094","0.1015","","","","","","0.964","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7207295","18.924","0.004","6.2925","0.0013","7.9164","0.0016","90","","99.48","0.03","90","","929.8","0.3","173","2","173","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","(Z)-1, 2-bis(dibenzo[b,d]thiophen-2-yl)ethene","","- C26 H16 S2 -","- C26 H16 S2 -","- C52 H32 S4 -","2","0.5","","Qiao, Yali; Wei, Zhongming; Risko, Chad; Li, Hong; Brédas, Jean-Luc; Xu, Wei; Zhu, Daoben","Synthesis, experimental and theoretical characterization, and field-effect transistor properties of a new class of dibenzothiophene derivatives: From linear to cyclic architectures","Journal of Materials Chemistry","2012","22","4","1313","","10.1039/c1jm13962b","","","0.71073","MoKα","","0.0879","0.0706","","","0.1345","0.1423","","","","","","1.159","","","","has coordinates","180403","2020-10-21","18:00:00",""
"7207370","13.268","0.003","10.287","0.002","13.771","0.004","90","","113.39","0.03","90","","1725.1","0.8","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C41 H32 N4 O Si -","- C41 H32 N4 O Si -","- C82 H64 N8 O2 Si2 -","2","0.5","","Mei, J.; Wang, J.; Qin, A.; Zhao, H.; Yuan, W.; Zhao, Z.; Sung, H. H. Y.; Deng, C.; Zhang, S.; Williams, I. D.; Sun, J. Z.; Tang, B. Z.","Construction of soft porous crystal with silole derivative: strategy of framework design, multiple structural transformability and mechanofluorochromism","Journal of Materials Chemistry","2012","22","10","4290","","10.1039/c1jm12673c","","","1.54178","CuKα","","0.095","0.0562","","","0.1091","0.1175","","","","","","1.003","","","","has coordinates","180404","2020-10-21","18:00:00",""
"7207520","16.1859","0.0007","4.8014","0.0002","9.2596","0.0004","90","","90.191","0.004","90","","719.61","0.05","295","2","295","2","","","","","","","synthesis as described","4","P 1 2/c 1","-P 2yc","13","","","","- C6 H8 Co O4 -","- C6 H8 Co O4 -","- C24 H32 Co4 O16 -","4","1","","Saines, Paul J.; Barton, Phillip T.; Jain, Prashant; Cheetham, Anthony K.","Structures and magnetic properties of Mn and Co inorganic‒organic frameworks with mixed linear dicarboxylate ligands","CrystEngComm","2012","14","8","2711","","10.1039/c2ce05947a","","x-ray","0.71073","MoKα","","0.0939","0.083","","","0.2275","0.2361","","","","","","1.185","","","","has coordinates","180406","2020-10-21","18:00:00",""
"7207566","13.1622","0.0015","7.2427","0.0008","17.7408","0.0019","90","","103.584","0.002","90","","1643.9","0.3","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18 H13 Co N2 O5 -","- C18 H11 Co N2 O5 -","- C72 H44 Co4 N8 O20 -","4","1","","Liu, Bo; Miao, Hui; Pang, Ling-Yan; Hou, Lei; Wang, Yao-Yu; Shi, Qi-Zhen","Solvent influences structural variation from a 3D 4-fold interpenetrated framework to a 2D layer-type porous coordination polymer: Structure analysis and highly selective gas adsorption properties","CrystEngComm","2012","14","8","2954","","10.1039/c2ce06372g","","","0.71073","MoKα","","0.0424","0.0353","","","0.0901","0.0942","","","","","","1.044","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7207645","11.9182","0.0003","7.2555","0.0002","14.557","0.0004","90","","98.464","0.002","90","","1245.07","0.06","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C10 H28 N26 Ni O2 -","- C10 H28 N26 Ni O2 -","- C20 H56 N52 Ni2 O4 -","2","0.5","","Lin, Jiao-Min; Qiu, Yan-Xuan; Chen, Wen-Bin; Yang, Meng; Zhou, Ai-Ju; Dong, Wen; Tian, Chang-En","Unusual π−‒π− stacking interactions between 5,5′-azotetrazolate(AT) anions in six AT based 3d metal photochromic complexes","CrystEngComm","2012","14","8","2779","","10.1039/c2ce06606h","","","0.71073","MoKα","","0.0348","0.0302","","","0.0802","0.0832","","","","","","1.074","","","","has coordinates","180407","2020-10-21","18:00:00",""
"7207653","11.7361","0.0006","11.1568","0.0009","10.1886","0.0006","90","","110.205","0.006","90","","1251.97","0.15","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","pentobarbital, nembutal","5-ethyl,5-(1-methylbutyl)barbituric acid","","- C11 H18 N2 O3 -","- C11 H18 N2 O3 -","- C44 H72 N8 O12 -","4","1","","Rossi, Denise; Gelbrich, Thomas; Kahlenberg, Volker; Griesser, Ulrich J.","Supramolecular constructs and thermodynamic stability of four polymorphs and a co-crystal of pentobarbital (nembutal)","CrystEngComm","2012","14","7","2494","","10.1039/c2ce06659a","","","1.5418","CuKα","","0.1233","0.088","","","0.1612","0.174","","","","","","1.056","","","","has coordinates","180407","2020-10-21","18:00:00",""
"7207942","23.039","0.002","8.756","0.0006","21.7481","0.0019","90","","109.477","0.005","90","","4136.2","0.6","293.15","","293.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C28.5 H22.5 Cu2 N4.5 O13.5 -","- C28.5 H22.5 Cu2 N4.5 O13.5 -","- C114 H90 Cu8 N18 O54 -","4","1","","Ma, Jie; Jiang, Feilong; Chen, Lian; Wu, Mingyan; Zhang, Shuquan; Xiong, Kecai; Han, Dong; Hong, Maochun","Temperature-controlled reduction of Cu(ii) and structural transformation on the assembly of coordination network","CrystEngComm","2012","14","12","4181","","10.1039/c2ce00004k","","","0.71073","MoKα","","0.0785","0.0678","","","0.1918","0.2056","","","","","","1.074","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7207969","6.8215","0.0014","11.724","0.002","11.57","0.002","90","","103.04","0.03","90","","901.5","0.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18 H15 Cl N4 O7 -","- C18 H14 Cl N4 O7 -","- C36 H28 Cl2 N8 O14 -","2","0.5","","Yong, Guo-Ping; Zhang, Yi-Man; She, Wen-Long","Anion‒π interactions in new electron-deficient π systems: the relevance to solid phosphorescent colors","CrystEngComm","2012","14","11","3923","","10.1039/c2ce06702a","","","0.71073","MoKα","","0.2046","0.1628","","","0.4625","0.4937","","","","","","1.698","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7207973","8.8844","0.0004","10.4799","0.0005","17.2726","0.0007","90","","98.368","0.004","90","","1591.09","0.12","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C15 H13 Cd Cl N4 O2 -","- C15 H13 Cd Cl N4 O2 -","- C60 H52 Cd4 Cl4 N16 O8 -","4","1","","Ji, Can; Li, Bo; Ma, Ming-Li; Zang, Shuang-Quan; Hou, Hong-Wei; Mak, Thomas C. W.","A series of five divalent zinc and cadmium coordination polymers based on a new bifunctional ligand: syntheses, crystal structures, and properties","CrystEngComm","2012","14","11","3951","","10.1039/c2ce06720j","","","0.71073","MoKα","","0.0767","0.0515","","","0.0751","0.0778","","","","","","2.137","","","","has coordinates","180410","2020-10-21","18:00:00",""
"7208211","14.5232","0.0006","21.131","0.0009","16.0399","0.0007","90","","103.615","0.002","90","","4784.2","0.4","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C30 H26 Cd N4 O6 -","- C30 H26 Cd N4 O6 -","- C120 H104 Cd4 N16 O24 -","4","1","","Sie, Ming-Jhe; Chang, Yin-Jui; Cheng, Po-Wen; Kuo, Po-Ting; Yeh, Chun-Wei; Cheng, Chi-Feng; Chen, Jhy-Der; Wang, Ju-Chun","Interpenetrated and polycatenated nets of Cd(ii) coordination networks from mixed N,N′-dipyridyladipoamide and dicarboxylate ligands","CrystEngComm","2012","14","17","5505","","10.1039/c2ce25202c","","","0.71073","MoKα","","0.0965","0.0493","","","0.1038","0.1112","","","","","","1.031","","","","has coordinates,has disorder","180413","2020-10-21","18:00:00",""
"7208240","15.2257","0.0004","9.4717","0.0003","21.6848","0.0008","90","","124.913","0.002","90","","2564.4","0.15","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H23.5 Cd N6 O6 -","- C26 H24 Cd N6 O6 -","- C104 H96 Cd4 N24 O24 -","4","1","","Wang, Nan; Ma, Jian-Gong; Shi, Wei; Cheng, Peng","Two novel Cd(ii) complexes with unprecedented four- and six-fold interpenetration","CrystEngComm","2012","14","16","5198","","10.1039/c2ce25282a","","","0.71073","MoKα","","0.0391","0.0324","","","0.0781","0.083","","","","","","1.063","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7208277","6.1559","0.0005","12.1831","0.0011","18.1485","0.0015","90","","99.044","0.001","90","","1344.2","0.2","297","2","297","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C24 H10 F8 I4 -","- C24 H10 F8 I4 -","- C48 H20 F16 I8 -","2","0.5","","Shen, Qian Jin; Pang, Xue; Zhao, Xiao Ran; Gao, Hai Yue; Sun, Hao-Ling; Jin, Wei Jun","Phosphorescent cocrystals constructed by 1,4-diiodotetrafluorobenzene and polyaromatic hydrocarbons based on C‒I⋯π halogen bonding and other assisting weak interactions","CrystEngComm","2012","14","15","5027","","10.1039/c2ce25338k","","","0.71073","MoKα","","0.0524","0.0404","","","0.093","0.1","","","","","","1.035","","","","has coordinates","180413","2020-10-21","18:00:00",""
"7208306","13.8436","0.0005","6.4099","0.0002","20.5475","0.0008","90","","125.007","0.002","90","","1493.44","0.1","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- B K5 O34 P4 Ta8 -","- B K5 O34 P4 Ta8 -","- B2 K10 O68 P8 Ta16 -","2","0.5","","Babaryk, Artem A.; Odynets, Ievgen V.; Slobodyanik, Nikolay S.; Baumer, Vyacheslav N.; Khainakov, Sergei","Structure-driven mixed-site borate‒phosphate K5Ta8BP4O34: synthesis, structural, spectroscopic and theoretical study","CrystEngComm","2012","14","15","5071","","10.1039/c2ce25451d","","","0.71073","MoKα","","0.0413","0.0282","","","0.0626","0.0666","","","","","","1.079","","","","has coordinates","180414","2020-10-21","18:00:00",""
"7208434","16.011","0.003","5.987","0.0012","19.649","0.004","90","","111.46","0.03","90","","1752.9","0.7","294","2","294","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C12 H9 I3 N4 S -","- C12 H9 I3 N4 S -","- C48 H36 I12 N16 S4 -","4","1","","Aragoni, M. Carla; Arca, Massimiliano; Caltagirone, Claudia; Castellano, Carlo; Demartin, Francesco; Garau, Alessandra; Isaia, Francesco; Lippolis, Vito; Montis, Riccardo; Pintus, Anna","Cationic and anionic 1D chains based on NH+⋯N charge-assisted hydrogen bonds in bipyridyl derivatives and polyiodides","CrystEngComm","2012","14","18","5809","","10.1039/c2ce25212k","","","0.71073","MoKα","","0.0585","0.0329","","","0.07","0.0787","","","","","","1.049","","","","has coordinates","180415","2020-10-21","18:00:00",""
"7208495","11.398","0.002","7.0474","0.0014","25.64","0.007","90","","107.84","0.03","90","","1960.5","0.8","223.15","","223.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C21 H18 N2 O5 Zn -","- C21 H16 N2 O5 Zn -","- C84 H64 N8 O20 Zn4 -","4","1","","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","","0.1293","0.0803","","","0.1933","0.2465","","","","","","1.18","","","","has coordinates","180415","2020-10-21","18:00:00",""
"7208587","12.8165","0.0015","8.8463","0.001","16.94","0.002","90","","102.31","0.002","90","","1876.5","0.4","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C19.5 H15 N2 O5 Zn -","- C19.5 H12 N2 O5 Zn -","- C78 H48 N8 O20 Zn4 -","4","1","","Liu, Bo; Pang, Ling-Yan; Hou, Lei; Wang, Yao-Yu; Zhang, Yue; Shi, Qi-Zhen","Two solvent-dependent zinc(ii) supramolecular isomers: structure analysis, reversible and nonreversible crystal-to-crystal transformation, highly selective CO2 gas adsorption, and photoluminescence behaviors","CrystEngComm","2012","14","19","6246","","10.1039/c2ce26058a","","","0.71073","MoKα","","0.1","0.0647","","","0.1399","0.1556","","","","","","1.024","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7208698","9.8633","0.0003","16.4409","0.0006","18.2187","0.0006","90","","94.197","0.003","90","","2946.45","0.17","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C103 H102 Cd4 N17 O29 -","- C103 H80 Cd4 N17 O29 -","- C103 H80 Cd4 N17 O29 -","1","0.25","","Guo, Jiao; Yang, Jin; Liu, Ying-Ying; Ma, Jian-Fang","Two novel 3D metal‒organic frameworks based on two tetrahedral ligands: syntheses, structures, photoluminescence and photocatalytic properties","CrystEngComm","2012","14","20","6609","","10.1039/c2ce25588j","","","0.71073","MoKα","","0.0774","0.0595","","","0.1613","0.1755","","","","","","1.056","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7208740","22.717","0.003","8.7709","0.001","20.543","0.002","90","","91.765","0.002","90","","4091.2","0.8","173","2","173","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C18 H22 Ag Cl N2 O4 S2 -","- C18 H22 Ag Cl N2 O4 S2 -","- C144 H176 Ag8 Cl8 N16 O32 S16 -","8","2","","Park, Sunhong; Lee, Seul-Gi; Jung, Jong Hwa; Ikeda, Mari; Habata, Yoichi; Lee, Shim Sun","Macrocycles incorporating isomeric arms: synthesis and crystal structures of ligands and their mono-, di- and polynuclear supramolecular complexes","CrystEngComm","2012","14","20","6515","","10.1039/c2ce25708d","","","0.71073","MoKα","","0.0744","0.0455","","","0.1029","0.1188","","","","","","1.025","","","","has coordinates","180418","2020-10-21","18:00:00",""
"7208911","14.001","0.01","10.758","0.008","16.911","0.012","90","","105.111","0.008","90","","2459","3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C56 H33 Co3 N0 O19 -","- C56 H33 Co3 O19 -","- C112 H66 Co6 O38 -","2","0.5","","Hu, Feilong; Zou, Huahong; Zhao, Xuebo; Mi, Yan; Luo, Caili; Wang, Yunxiao","Second ligands-assisted structural variation of entangled coordination polymers with polycatenated or polythreaded features","CrystEngComm","2013","15","6","1068","","10.1039/c2ce26165k","","","0.71073","MoKα","","0.0618","0.0393","","","0.0813","0.0911","","","","","","1.015","","","","has coordinates,has disorder","180420","2020-10-21","18:00:00",""
"7208943","23.4064","0.001","5.9565","0.0002","33.4858","0.0017","90","","121.375","0.003","90","","3985.9","0.3","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C42 H36 O21 Sm2 -","- C42 H36 O21 Sm2 -","- C168 H144 O84 Sm8 -","4","1","","Jiang, Zhi-Qiang; Jiang, Gui-Yuan; Hou, Duan-Chuan; Wang, Fei; Zhao, Zhen; Zhang, Jian","Urothermal synthesis of photoluminescent lanthanide‒organic frameworks with unusual topologies","CrystEngComm","2013","15","2","315","","10.1039/c2ce26242h","","","0.71073","MoKα","","0.0528","0.0338","","","0.0693","0.0724","","","","","","0.962","","","","has coordinates","180420","2020-10-21","18:00:00",""
"7208954","5.8422","0.0003","9.8906","0.0004","21.5267","0.001","90","","93.957","0.004","90","","1240.91","0.1","120","2","120","2","","","","","","","synthesis as described","4","P 1 2/c 1","-P 2yc","13","","","","- C18 H34 O17 Y2 -","- C18 H32 O17 Y2 -","- C36 H64 O34 Y4 -","2","0.5","","Saines, Paul J.; Steinmann, Mark; Tan, Jin-Chong; Yeung, Hamish H.-M.; Cheetham, Anthony K.","Structural diversity and luminescent properties of lanthanide 2,2- and 2,3-dimethylsuccinate frameworks","CrystEngComm","2013","15","1","100","","10.1039/c2ce26279g","","x-ray","1.54184","CuKα","","0.0891","0.086","","","0.1903","0.1918","","","","","","1.241","","","","has coordinates,has disorder","180420","2020-10-21","18:00:00",""
"7209093","18.0861","0.0006","14.2083","0.0003","19.298","0.0005","90","","97.836","0.002","90","","4912.8","0.2","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C34 H35 Cd4 N4 O22.5 -","- C34 H22 Cd4 N4 O22.5 -","- C136 H88 Cd16 N16 O90 -","4","1","","Ma, Jie; Chen, Lian; Wu, Ming-Yan; Zhang, Shu-Quan; Xiong, Ke-Cai; Han, Dong; Jiang, Fei-Long; Hong, Mao-Chun","Auxiliary ligand-directed and counter anion-templated effects on coordination networks based on semirigid 2-aminodiacetic terephthalic acid ligand","CrystEngComm","2013","15","5","911","","10.1039/c2ce26553b","","","0.71073","MoKα","","0.0455","0.0433","","","0.1184","0.1206","","","","","","1.081","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209121","14.909","0.003","7.1963","0.0015","24.592","0.005","90","","104.312","0.002","90","","2556.6","0.9","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C26 H15 Co F6 N2 O4 -","- C26 H15 Co F6 N2 O4 -","- C104 H60 Co4 F24 N8 O16 -","4","1","","Zhou, Hong; Liu, Guang-Xiang; Wang, Xiao-Feng; Wang, Yan","Three cobalt(ii) coordination polymers based on V-shaped aromatic polycarboxylates and rigid bis(imidazole) ligand: syntheses, crystal structures, physical properties and theoretical studies","CrystEngComm","2013","15","7","1377","","10.1039/c2ce26606g","","","0.71073","MoKα","","0.1006","0.067","","","0.1487","0.1653","","","","","","1.015","","","","has coordinates","180422","2020-10-21","18:00:00",""
"7209196","9.664","0.002","9.582","0.002","16.414","0.004","90","","104.43","0.003","90","","1472","0.6","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C15 H13 N3 O5 Zn -","- C15 H13 N3 O5 Zn -","- C60 H52 N12 O20 Zn4 -","4","1","","Uebler, Jacob W.; Wilson, Julie A.; LaDuca, Robert L.","Donor disposition and aliphatic conformation effects on structure in luminescent zinc dicarboxylate coordination polymers with isomeric dipyridylamide coligands","CrystEngComm","2013","15","8","1586","","10.1039/c2ce26929e","","","0.71073","MoKα","","0.11","0.1057","","","0.2217","0.2234","","","","","","1.309","","","","has coordinates,has disorder","180422","2020-10-21","18:00:00",""
"7209258","25.899","0.002","19.5796","0.0017","34.39","0.003","90","","94.006","0.002","90","","17396","3","223","2","223","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C118 H236 I6 K6 N60 O83 -","- C118 H132 K6 N60 O36 -","- C472 H528 K24 N240 O144 -","4","1","","Li, Zhong-Fei; Liang, Li-Li; Wu, Feng; Zhou, Fa-Gen; Ni, Xin-Long; Feng, Xing; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Zhu, Qian-Jiang; Clegg, Jack K.; Tao, Zhu; Lindoy, Leonard F.; Wei, Gang","An approach to networks based on coordination of alkyl-substituted cucurbit[5]urils and potassium ions","CrystEngComm","2013","15","10","1994","","10.1039/c3ce26491b","","","0.71073","MoKα","","0.1988","0.1228","","","0.2823","0.3189","","","","","","0.965","","","","has coordinates,has disorder","180423","2020-10-21","18:00:00",""
"7209508","18.4148","0.0002","8.7874","0.0001","27.3027","0.0004","90","","107.422","0.0005","90","","4215.4","0.09","150","","150","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C17 H34 Br2 N2 O -","- C17 H34 Br2 N2 O -","- C136 H272 Br16 N16 O8 -","8","2","","Caballero, Antonio; Bennett, Sam; Serpell, Christopher J.; Beer, Paul D.","Iodo-imidazolium salts: halogen bonding in crystals and anion-templated pseudorotaxanes","CrystEngComm","2013","15","16","3076","","10.1039/c2ce26020d","","","0.71073","MoKα","","0.0786","0.0507","","0.1048","0.0948","0.1048","","","","","","1.0066","","","","has coordinates,has disorder","180426","2020-10-21","18:00:00",""
"7209568","12.4628","0.0018","10.8337","0.0015","20.597","0.003","90","","105.875","0.003","90","","2674.9","0.7","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C53 H44 Cl6 Cu4 N12 O2 -","- C53 H44 Cl6 Cu4 N12 O2 -","- C106 H88 Cl12 Cu8 N24 O4 -","2","0.5","","Chen, Yanmei; Li, Lei; Cao, Yanyuan; Wu, Jian; Gao, Qian; Li, Yahong; Hu, Hailiang; Liu, Wei; Liu, Yonglu; Kang, Zhenhui; Li, Jingping","CuII-mediated controllable creation of tertiary and quaternary carbon centers: designed assembly and structures of a new class of copper complexes supported by in situ generated substituted 1-pyridineimidazo[1,5-a]pyridine ligands","CrystEngComm","2013","15","14","2675","","10.1039/c3ce00012e","","","0.71073","MoKα","","0.1474","0.1288","","","0.2922","0.3017","","","","","","1.129","","","","has coordinates,has disorder","180426","2020-10-21","18:00:00",""
"7209571","12.8398","0.0018","5.1086","0.0007","15.192","0.002","90","","105.007","0.003","90","","962.5","0.2","296","2","296","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C25 H18 N6 -","- C25 H18 N6 -","- C50 H36 N12 -","2","0.5","","Chen, Yanmei; Li, Lei; Cao, Yanyuan; Wu, Jian; Gao, Qian; Li, Yahong; Hu, Hailiang; Liu, Wei; Liu, Yonglu; Kang, Zhenhui; Li, Jingping","CuII-mediated controllable creation of tertiary and quaternary carbon centers: designed assembly and structures of a new class of copper complexes supported by in situ generated substituted 1-pyridineimidazo[1,5-a]pyridine ligands","CrystEngComm","2013","15","14","2675","","10.1039/c3ce00012e","","","0.71073","MoKα","","0.0555","0.0401","","","0.1053","0.1149","","","","","","1.08","","","","has coordinates","180426","2020-10-21","18:00:00",""
"7209581","9.7163","0.0004","9.3623","0.0003","18.4041","0.0008","90","","105.392","0.004","90","","1614.12","0.11","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C30 H36 Cd N9 O4 -","- C30 H36 Cd N9 O4 -","- C60 H72 Cd2 N18 O8 -","2","0.5","","Guo, Xiang-Guang; Yang, Wen-Bin; Wu, Xiao-Yuan; Zhang, Qi-Kai; Lin, Lang; Yu, RongMin; Lu, Can-Zhong","Stoichiometry, temperature, solvent, metal-directed syntheses of metal‒organic frameworks based on flexible V-shaped methylenebis(3,5-dimethylpyrazole) and various aromatic dicarboxylate acids","CrystEngComm","2013","15","18","3654","","10.1039/c3ce00048f","","","1.54184","CuKα","","0.0331","0.0287","","","0.0703","0.0738","","","","","","1.028","","","","has coordinates","180426","2020-10-21","18:00:00",""
"7209653","10.041","0.002","6.8049","0.0014","13.405","0.003","90","","100.97","0.03","90","","899.2","0.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C20 H10 F4 N4 O5 -","- C20 H10 F4 N4 O5 -","- C40 H20 F8 N8 O10 -","2","0.5","","Wang, Lei; Zhao, Lei; Hu, Yanjing; Wang, Wenqiang; Chen, Ruixin; Yang, Yu","A cooperation molecular recognition study: syntheses and analysis of supramolecular assemblies of tetrafluoroterephthalic acid with some aza compounds","CrystEngComm","2013","15","15","2835","","10.1039/c3ce26865a","","","0.71073","MoKα","","0.0382","0.0356","","","0.0997","0.1011","","","","","","1.087","","","","has coordinates","180427","2020-10-21","18:00:00",""
"7210200","12.8567","0.0003","8.9378","0.0002","16.0555","0.0004","90","","101.613","0.002","90","","1807.18","0.07","291","2","291.15","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C16 H14 Cd2 O12 -","- C16 H12 Cd2 O12 -","- C64 H48 Cd8 O48 -","4","1","","Lou, Xin-Hua; Xu, Chen; Li, Hong-Mei; Wang, Zhi-Qiang; Guo, Hui; Xue, Dong-Xu","Metal-directed topological diversity of three fluorescent metal‒organic frameworks based on a new tetracarboxylate strut","CrystEngComm","2013","15","23","4606","","10.1039/c3ce40443a","","","0.7107","MoKα","","0.0381","0.0301","","","0.0624","0.0661","","","","","","1.069","","","","has coordinates","180433","2020-10-21","18:00:00",""
"7210355","11.1425","0.0003","15.6947","0.0004","14.6254","0.0005","90","","110.235","0.004","90","","2399.81","0.14","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C26 H28 N4 O3 -","- C26 H28 N4 O3 -","- C104 H112 N16 O12 -","4","1","","Parra, Nicole; Guarda, Luz; Belmar, Julio B.; Hidalgo, Paulina I.; Jiménez, Claudio A.; Pasán, Jorge; Ruiz-Pérez, Catalina","Conformational influence of quinoline moieties in the crystal packing of bis(quinolinecarboxamide)alkane derivatives","CrystEngComm","2013","15","36","7212","","10.1039/c3ce40807h","","","1.5418","CuKα","","0.0775","0.0593","","","0.1827","0.2012","","","","","","1.063","","","","has coordinates","180434","2020-10-21","18:00:00",""
"7210831","11.892","0.0003","7.2477","0.0002","14.5382","0.0004","90","","98.479","0.002","90","","1239.35","0.06","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C12 H34 Co N20 O6 -","- C12 H34 Co N20 O6 -","- C24 H68 Co2 N40 O12 -","2","0.5","","Yang, Meng; OuYang, Zhen-Jie; Chen, Wen-Bin; Zhou, Rong-Fu; Li, Nan; Dong, Wen","Structures of six photochromic 3d complexes containing 3,3′-azobis-1,2,4-triazole ligand","CrystEngComm","2013","15","42","8529","","10.1039/c3ce40736e","","","0.71073","MoKα","","0.0796","0.0673","","","0.198","0.2087","","","","","","1.059","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7210851","9.2171","0.0018","10.278","0.002","17.086","0.005","90","","116.74","0.02","90","","1445.5","0.6","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C32 H36 N4 O5 Zn -","- C32 H36 N4 O5 Zn -","- C64 H72 N8 O10 Zn2 -","2","0.5","","Liu, Lu; Huang, Chao; Wang, Zhengchuang; Wu, Dongqing; Hou, Hongwei; Fan, Yaoting","Entangled Zn(ii)/Cd(ii) coordination complexes based on a flexible bis(methylbenzimidazole) ligand and different dicarboxylates","CrystEngComm","2013","15","35","7095","","10.1039/c3ce40823j","","","0.71073","MoKα","","0.0622","0.0518","","","0.1078","0.1143","","","","","","1.012","","","","has coordinates","180439","2020-10-21","18:00:00",""
"7210852","9.0664","0.0018","10.293","0.002","17.46","0.005","90","","115.29","0.02","90","","1473.2","0.6","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C32 H36 Cd N4 O5 -","- C32 H36 Cd N4 O5 -","- C64 H72 Cd2 N8 O10 -","2","0.5","","Liu, Lu; Huang, Chao; Wang, Zhengchuang; Wu, Dongqing; Hou, Hongwei; Fan, Yaoting","Entangled Zn(ii)/Cd(ii) coordination complexes based on a flexible bis(methylbenzimidazole) ligand and different dicarboxylates","CrystEngComm","2013","15","35","7095","","10.1039/c3ce40823j","","","0.71073","MoKα","","0.031","0.0291","","","0.0646","0.0658","","","","","","1.09","","","","has coordinates","180439","2020-10-21","18:00:00",""
"7210858","9.2122","0.0018","10.31","0.002","17.092","0.005","90","","117.59","0.02","90","","1438.8","0.6","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C32 H36 N4 O5 Zn -","- C32 H36 N4 O5 Zn -","- C64 H72 N8 O10 Zn2 -","2","0.5","","Liu, Lu; Huang, Chao; Wang, Zhengchuang; Wu, Dongqing; Hou, Hongwei; Fan, Yaoting","Entangled Zn(ii)/Cd(ii) coordination complexes based on a flexible bis(methylbenzimidazole) ligand and different dicarboxylates","CrystEngComm","2013","15","35","7095","","10.1039/c3ce40823j","","","0.71073","MoKα","","0.0814","0.0718","","","0.1624","0.1686","","","","","","1.164","","","","has coordinates","180439","2020-10-21","18:00:00",""
"7210859","9.0575","0.0018","10.338","0.002","17.427","0.005","90","","115.35","0.02","90","","1474.7","0.6","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C32 H36 Cd N4 O5 -","- C32 H36 Cd N4 O5 -","- C64 H72 Cd2 N8 O10 -","2","0.5","","Liu, Lu; Huang, Chao; Wang, Zhengchuang; Wu, Dongqing; Hou, Hongwei; Fan, Yaoting","Entangled Zn(ii)/Cd(ii) coordination complexes based on a flexible bis(methylbenzimidazole) ligand and different dicarboxylates","CrystEngComm","2013","15","35","7095","","10.1039/c3ce40823j","","","0.71073","MoKα","","0.0538","0.0514","","","0.1109","0.1123","","","","","","1.132","","","","has coordinates","180439","2020-10-21","18:00:00",""
"7210916","6.7949","0.0005","4.5234","0.0003","12.2711","0.0009","90","","95.701","0.007","90","","375.3","0.05","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C5 H12 N2 O3 -","- C5 H12 N2 O3 -","- C10 H24 N4 O6 -","2","0.5","","Taouss, Christina; Thomas, Lena; Jones, Peter G.","Packing principles for urea and thiourea solvates: structures of urea : morpholine (1 : 1), urea : 1,4-dioxane (1 : 1), thiourea : morpholine (4 : 3) and thiourea : 1,4-dioxane (4 : 1)","CrystEngComm","2013","15","34","6829","","10.1039/c3ce40933c","","","0.71073","MoKα","","0.0507","0.0455","","","0.1251","0.1294","","","","","","1.052","","","","has coordinates","288501","2023-12-22","13:20:51",""
"7210983","15.999","0.0015","10.6917","0.0014","14.4959","0.0019","90","","116.938","0.008","90","","2210.6","0.5","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C42 H38 Co2 N8 O18 -","- C42 H32 Co2 N8 O18 -","- C84 H64 Co4 N16 O36 -","2","0.5","","Luo, Li; Lv, Gao-Chao; Wang, Peng; Liu, Qing; Chen, Kai; Sun, Wei-Yin","pH-Dependent cobalt(ii) frameworks with mixed 3,3′,5,5′-tetra(1H-imidazol-1-yl)-1,1′-biphenyl and 1,3,5-benzenetricarboxylate ligands: synthesis, structure and sorption property","CrystEngComm","2013","15","45","9537","","10.1039/c3ce41056k","","","0.71073","MoKα","","0.0703","0.0468","","","0.1091","0.1179","","","","","","1.105","","","","has coordinates,has disorder","180440","2020-10-21","18:00:00",""
"7210991","12.824","0.009","10.318","0.007","31.48","0.02","90","","101.75","","90","","4078","5","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C H Co N O -","- C3.92157 H2.35294 Co0.156863 N0.470588 O0.627451 -","- C200 H120 Co8 N24 O32 -","51","12.75","","Hu, Fei-Long; Mi, Yan; Gu, Yun-Qiong; Zhu, Li-Gang; Yang, Sheng-Lan; Wei, Han; Lang, Jian-Ping","Structure diversities of ten entangled coordination polymers assembled from reactions of Co(ii) or Ni(ii) salts with 5-(pyridin-4-yl)isophthalic acid in the absence or presence of auxiliary N-donor ligands","CrystEngComm","2013","15","45","9553","","10.1039/c3ce41059e","","","0.71073","MoKα","","0.097","0.0588","","","0.1296","0.1424","","","","","","0.923","","","","has coordinates","180440","2020-10-21","18:00:00",""
"7211095","9.718","0.002","9.962","0.003","13.971","0.003","90","","128.918","0.011","90","","1052.3","0.5","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C19 H25 N5 O6 Zn -","- C19 H25 N5 O6 Zn -","- C38 H50 N10 O12 Zn2 -","2","0.5","","Zhang, Xiaoxi; Xing, Na; Bai, Fengying; Wan, Lijuan; Shan, Hui; Hou, Yanan; Xing, Yongheng; Shi, Zhan","Multi-functional d10 metal‒organic materials based on bis-pyrazole/pyridine ligands supported by a 2,6-di(3-pyrazolyl)pyridine with different spanning flexible dicarboxylate ligands: synthesis, structure, photoluminescent and catalytic properties","CrystEngComm","2013","15","44","9135","","10.1039/c3ce41213j","","","0.71073","MoKα","","0.0557","0.0439","","","0.1048","0.1122","","","","","","1.042","","","","has coordinates","180441","2020-10-21","18:00:00",""
"7211229","12.805","0.001","4.0989","0.0003","16.246","0.001","90","","96.729","0.001","90","","846.82","0.1","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H14 Cl2 N4 Pb -","- C14 H14 Cl2 N4 Pb -","- C28 H28 Cl4 N8 Pb2 -","2","0.5","","Hashemi, Lida; Morsali, Ali","Solid state structural transformation of 1D to intermediate 2D and then to 3D porous coordination polymer by anion replacement; new precursors for preparation of PbCl2, Pb3O2Cl2 and PbO nanoparticles","CrystEngComm","2013","15","44","8894","","10.1039/c3ce41566j","","","0.71073","MoKα","","0.0157","0.0155","","","0.0388","0.0389","","","","","","1.06","","","","has coordinates","180443","2020-10-21","18:00:00",""
"7211251","12.362","0.002","9.9067","0.0016","22.294","0.004","90","","98.383","0.002","90","","2701.1","0.8","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C28 H8 N5 O48 Sm7 U2 -","- C28 H8 N5 O48 Sm7 U2 -","- C56 H16 N10 O96 Sm14 U4 -","2","0.5","","Cantos, Paula M.; Pope, Simon J. A.; Cahill, Christopher L.","An exploration of homo- and heterometallic UO22+ hybrid materials containing chelidamic acid: synthesis, structure, and luminescence studies","CrystEngComm","2013","15","44","9039","","10.1039/c3ce41655k","","","0.71073","MoKα","","0.0566","0.0473","","","0.1012","0.1052","","","","","","1.045","","","","has coordinates","180443","2020-10-21","18:00:00",""
"7211301","27.6303","0.001","4.10757","0.00017","19.1097","0.0006","90","","110.163","0.003","90","","2035.91","0.13","120","2","123","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C24 H18 N4 O3 -","- C24 H18 N4 O3 -","- C96 H72 N16 O12 -","4","1","","Matos, Catiúcia R M O; Miranda, Fabio S.; Carneiro, José W de M; Pinheiro, Carlos B.; Ronconi, Célia M","The effect of the molecular structures of dicyanomethylene compounds on their supramolecular assembly, photophysical and electrochemical properties.","Physical chemistry chemical physics : PCCP","2013","15","31","13013","13023","10.1039/c3cp51957k","","","1.54184","CuKα","","0.0441","0.0434","","","0.1129","0.1143","","","","","","1.081","","","","has coordinates","180444","2020-10-21","18:00:00",""
"7211303","27.4458","0.0009","4.3843","0.0001","19.1157","0.0007","90","","110.267","0.003","90","","2157.8","0.12","273","2","273","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C25 H20 N4 O2 -","- C25 H20 N4 O2 -","- C100 H80 N16 O8 -","4","1","","Matos, Catiúcia R M O; Miranda, Fabio S.; Carneiro, José W de M; Pinheiro, Carlos B.; Ronconi, Célia M","The effect of the molecular structures of dicyanomethylene compounds on their supramolecular assembly, photophysical and electrochemical properties.","Physical chemistry chemical physics : PCCP","2013","15","31","13013","13023","10.1039/c3cp51957k","","","1.54178","","","0.0732","0.0542","","","0.1331","0.1472","","","","","","1.015","","","","has coordinates","180444","2020-10-21","18:00:00",""
"7211359","13.584","0.003","7.9537","0.0015","12.942","0.002","90","","115.153","0.004","90","","1265.7","0.4","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C18 H18 Cl4 N8 S2 Zn2 -","- C18 H18 Cl4 N8 S2 Zn2 -","- C36 H36 Cl8 N16 S4 Zn4 -","2","0.5","","Jiang, Lu; Wang, Zhe; Bai, Shi-Qiang; Hor, T. S. Andy","Tuning the Zn(ii) coordination assembly by adjusting the spacers of 2-pyridylthiomethyl functionalized 1,2,3-triazoles","CrystEngComm","2013","15","48","10451","","10.1039/c3ce41385c","","","0.71073","MoKα","","0.0403","0.0307","","","0.0845","0.1079","","","","","","1.096","","","","has coordinates","180444","2020-10-21","18:00:00",""
"7211410","20.3721","0.0008","9.4647","0.0002","17.2551","0.0007","90","","97.434","0.003","90","","3299.1","0.2","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C30 H38 Cd N8 O6 -","- C30 H38 Cd N8 O6 -","- C120 H152 Cd4 N32 O24 -","4","1","","Guo, Xiang-Guang; Yang, Wen-Bin; Wu, Xiao-Yuan; Zhang, Qi-Kai; Lu, Can-Zhong","Construction of coordination polymers based on methylenebis(3,5-dimethylpyrazole) and varied aromatic carboxylic acids","CrystEngComm","2013","15","46","10107","","10.1039/c3ce41575a","","","0.71073","MoKα","","0.056","0.0387","","","0.109","0.1457","","","","","","1.009","","","","has coordinates","180445","2020-10-21","18:00:00",""
"7211427","11.5273","0.0001","9.0488","0.0001","18.0697","0.0002","90","","97.707","0.001","90","","1867.79","0.03","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C17 H17 Cd N2 O9 -","- C17 H16 Cd N2 O9 -","- C68 H64 Cd4 N8 O36 -","4","1","","Cheng, Pei-Chi; Wu, Ming-Hao; Xie, Ming-Yuan; Huang, Wun-Jhih; He, Hsiu-Yi; Wu, Tsung-Tai; Lo, Yang-Chih; Proserpio, Davide M.; Chen, Jhy-Der","Construction of N,N′-di(3-pyridyl)adipoamide-based Zn(ii) and Cd(ii) coordination networks by tuning the isomeric effect of polycarboxylate ligands","CrystEngComm","2013","15","47","10346","","10.1039/c3ce41622d","","","0.71073","MoKα","","0.0326","0.0253","","","0.0602","0.0634","","","","","","1.048","","","","has coordinates,has disorder","180445","2020-10-21","18:00:00",""
"7211545","9.3818","0.0004","10.4613","0.0005","14.1476","0.0007","90","","99.41","0.003","90","","1369.84","0.11","120","2","120","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","3189-80-03 minoxidil and succinic acid","","- C22 H40 N10 O8 -","- C22 H40 N10 O8 -","- C44 H80 N20 O16 -","2","0.5","","Schultheiss, Nate; Lorimer, Keith; Wolfe, Skylar; Desper, John","Attempted construction of minoxidil: carboxylic acid cocrystals; 7 salts and 1 cocrystal resulted","CrystEngComm","2010","12","3","742","","10.1039/b910136e","","","0.71073","MoKα","","0.0584","0.0465","","","0.1236","0.132","","","","","","1.003","","","","has coordinates,has disorder","180446","2020-10-21","18:00:00",""
"7211555","12.3342","0.0003","11.3752","0.0003","19.0229","0.0006","90","","103.81","0.002","90","","2591.84","0.13","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C52 H46 N4 O21 Sm2 -","- C52 H46 N4 O21 Sm2 -","- C104 H92 N8 O42 Sm4 -","2","0.5","","Fan, Jun; Wang, Zhi-Hong; Yang, Ming; Yin, Xia; Zhang, Wei-Guang; Huang, Zhuo-Fen; Zeng, Rong-Hua","Controlled synthesis, structures and properties of one-, two-, and three-dimensional lanthanide coordination polymers based on (8-quinolyloxy)acetate","CrystEngComm","2010","12","1","216","","10.1039/b910219a","","","0.71073","MoKα","","0.0535","0.0332","","","0.0738","0.0815","","","","","","1.026","","","","has coordinates","180446","2020-10-21","18:00:00",""
"7211755","12.941","0.002","6.9994","0.0012","23.738","0.004","90","","118.131","0.003","90","","1896.2","0.5","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C17 H10 F6 O5 Zn -","- C17 H10 F6 O5 Zn -","- C68 H40 F24 O20 Zn4 -","4","1","","Gándara, Felipe; Medina, Manuela E.; Snejko, Natalia; Gutiérrez-Puebla, Enrique; Proserpio, Davide M.; Angeles Monge, M.","Ligand dependent topology changes in six zinc coordination polymers","CrystEngComm","2010","12","3","711","","10.1039/b914147b","","","0.71073","MoKα","","0.0722","0.0408","","","0.0909","0.0963","","","","","","0.971","","","","has coordinates","180448","2020-10-21","18:00:00",""
"7211769","14.27","0.003","13.896","0.003","19.504","0.007","90","","120.6","0.02","90","","3329","1.7","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C8 H25 Cl4 N8 O16 Tb3 -","- C8 H25 Cl4 N8 O16 Tb3 -","- C32 H100 Cl16 N32 O64 Tb12 -","4","1","","Tong, Yu-Zhang; Wang, Qing-Lun; Yang, Guang; Yang, Guang-Ming; Yan, Shi-Ping; Liao, Dai-Zheng; Cheng, Peng","Hydrolytic synthesis and structural characterization of five hexanuclear oxo-hydroxo lanthanide clusters","CrystEngComm","2010","12","2","543","","10.1039/b914208h","","","0.71073","MoKα","","0.0946","0.0544","","","0.1048","0.1173","","","","","","1.081","","","","has coordinates","180448","2020-10-21","18:00:00",""
"7211775","19.493","0.008","9.687","0.004","24.2","0.009","90","","98.736","0.01","90","","4517","3","213","2","213","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C64 H90 Ba2 Cr4 N8 O53 -","- C64 H48 Ba2 Cr4 N8 O53 -","- C128 H96 Ba4 Cr8 N16 O106 -","2","0.5","","Viciano-Chumillas, Marta; Marino, Nadia; Sorribes, Iván; Vicent, Cristian; Lloret, Francesc; Julve, Miguel","[Cr(dmbipy)(ox)2]−: a new bis-oxalato building block for metal assembling. Crystal structures and magnetic properties of XPh4[Cr(dmbipy)(ox)2]·5H2O (X = P and As), {Ba(H2O)2[Cr(dmbipy)(ox)2]2}n·17/2nH2O and {Ag(H2O)[Cr(dmbipy)(ox)2]}n·3nH2O","CrystEngComm","2010","12","1","122","","10.1039/b914419f","","","0.71073","MoKα","","0.1149","0.0553","","","0.1241","0.1483","","","","","","1.053","","","","has coordinates","180448","2020-10-21","18:00:00",""
"7211841","10.405","0.003","14.441","0.005","8.194","0.002","90","","112.074","0.018","90","","1141","0.6","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C12 H8 I N O2 -","- C12 H8 I N O2 -","- C48 H32 I4 N4 O8 -","4","1","","Labat, Gaël; Behrnd, Norwid-Rasmus; Couderc, Gaëtan; Bonin, Michel; Tsuwi, Julius; Batagiannis, Athanasios; Berger, Ricarda; Bertoni, Mariana; Prodi-Schwab, Anna; Hulliger, Jürg","Polymorphism, polar morphology and absolute structure determination of 4-iodo-4′-nitrobiphenyl (INBP)","CrystEngComm","2010","12","4","1252","","10.1039/b915469h","","","0.71073","MoKα","","0.0535","0.0281","","","0.0511","0.0576","","","","","","1.022","","","","has coordinates","180449","2020-10-21","18:00:00",""
"7211883","17.165","0.005","5.634","0.005","11.085","0.005","90","0.005","100.122","0.005","90","0.005","1055.3","1.1","173","","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","Sodium Nonafluorobutylsulfonate hydrate","Sodium Nonafluorobutylsulfonate hydrate","","- C4 H2 F9 Na O4 S -","- C4 H2 F9 Na O4 S -","- C16 H8 F36 Na4 O16 S4 -","4","1","","Brüdgam, Irene; Lentz, Dieter; Vorbrüggen, Helmut","Synthesis, crystal and molecular structure of alkali metal nonaflates","CrystEngComm","2010","12","3","795","","10.1039/b916157k","","","0.71073","MoKα","","0.1689","0.0846","","","0.2173","0.2639","","","","","","0.976","","","","has coordinates","180449","2020-10-21","18:00:00",""
"7212254","13.287","0.002","11.6791","0.0018","16.141","0.003","90","","90.408","0.002","90","","2504.7","0.7","294","2","294","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H36 Mn3 N8 O20 -","- C48 H36 Mn3 N8 O20 -","- C96 H72 Mn6 N16 O40 -","2","0.5","","Ma, Lu-Fang; Liu, Bin; Wang, Li-Ya; Hu, Jiang-Liang; Du, Miao","Hydrothermal preparation, crystal structures and properties of novel Mn(ii) metal‒organic frameworks with 5-nitro-1,2,3-benzenetricarboxylate and various dipyridyl ligands","CrystEngComm","2010","12","5","1439","","10.1039/b923522c","","","0.71073","MoKα","","0.0415","0.0347","","","0.0987","0.1042","","","","","","1.04","","","","has coordinates","180453","2020-10-21","18:00:00",""
"7212560","9.7117","0.0003","10.2821","0.0002","10.9564","0.0004","90","","113.107","0.004","90","","1006.3","0.06","130","2","130","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18 H22 Cu N2 O11 -","- C18 H14 Cu N2 O11 -","- C36 H28 Cu2 N4 O22 -","2","0.5","","Abrahams, Brendan F.; Grannas, Martin J.; McCormick, Laura J.; Robson, Richard; Thistlethwaite, Peter J.","Chiral and achiral linear coordination polymers from aldaric acids","CrystEngComm","2010","12","10","2885","","10.1039/c001505a","","","1.54184","CuKα","","0.0559","0.0469","","","0.134","0.1376","","","","","","1.216","","","","has coordinates","180456","2020-10-21","18:00:00",""
"7212794","25.323","0.004","4.8988","0.0008","33.3","0.004","90","","120","","90","","3577.5","0.9","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C54 H42 Cl6 Hg3 N6 O14 -","- C54 H42 Cl6 Hg3 N6 O14 -","- C108 H84 Cl12 Hg6 N12 O28 -","2","0.5","","Wang, Xiu-Jian; Huang, Ting-Hong; Tang, Lin-Hua; Cen, Zhong-Min; Ni, Qing-Ling; Gui, Liu-Cheng; Jiang, Xuan-Feng; Liu, Hong-Ke","Synthesis and structures of helical and meso-helical coordination polymers directed by the conformation restriction of flexible/angular pyridine-containing ligands","CrystEngComm","2010","12","12","4356","","10.1039/c0ce00110d","","","0.71073","MoKα","","0.1584","0.0992","","","0.2657","0.307","","","","","","1.015","","","","has coordinates","180458","2020-10-21","18:00:00",""
"7212809","11.5165","0.0011","11.4813","0.0011","13.1038","0.0011","90","","106.602","0.005","90","","1660.4","0.3","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C30 H36 Fe N6 O2 S2 -","- C30 H36 Fe N6 O2 S2 -","- C60 H72 Fe2 N12 O4 S4 -","2","0.5","","Adams, Christopher J.; Real, José Antonio; Waddington, Rachel E.","The two-dimensional iron(ii)‒thiocyanate‒4,4′-bipyridine coordination network","CrystEngComm","2010","12","11","3547","","10.1039/c0ce00149j","","","0.71073","MoKα","","0.0584","0.0396","","","0.0918","0.1001","","","","","","1.034","","","","has coordinates","180459","2020-10-21","18:00:00",""
"7212810","11.5535","0.0019","11.5357","0.0018","15.45","0.003","90","","114.365","0.012","90","","1875.7","0.6","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C34 H40 Fe N6 O4 S2 -","- C34 H40 Fe N6 O4 S2 -","- C68 H80 Fe2 N12 O8 S4 -","2","0.5","","Adams, Christopher J.; Real, José Antonio; Waddington, Rachel E.","The two-dimensional iron(ii)‒thiocyanate‒4,4′-bipyridine coordination network","CrystEngComm","2010","12","11","3547","","10.1039/c0ce00149j","","","0.71073","MoKα","","0.2478","0.1937","","","0.5167","0.5303","","","","","","1.88","","","","has coordinates","180459","2020-10-21","18:00:00",""
"7212813","11.5305","0.0005","11.5424","0.0005","12.7461","0.0006","90","","110.832","0.002","90","","1585.48","0.12","200","2","200","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C25 H16 Fe N6 S8 -","- C25 H16 Fe N6 S8 -","- C50 H32 Fe2 N12 S16 -","2","0.5","","Adams, Christopher J.; Real, José Antonio; Waddington, Rachel E.","The two-dimensional iron(ii)‒thiocyanate‒4,4′-bipyridine coordination network","CrystEngComm","2010","12","11","3547","","10.1039/c0ce00149j","","","0.71073","MoKα","","0.0576","0.0468","","","0.143","0.1495","","","","","","1.153","","","","has coordinates","180459","2020-10-21","18:00:00",""
"7212921","10.16","0.0017","5.16","0.0009","18.758","0.003","90","","94.687","0.004","90","","980.1","0.3","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18 H20 N2 Pb S4 -","- C18 H20 N2 Pb S4 -","- C36 H40 N4 Pb2 S8 -","2","0.5","","Akhtar, Javeed; Malik, Mohammad Azad; O'Brien, Paul; Helliwell, Madeleine","Controlled synthesis of PbS nanoparticles and the deposition of thin films by Aerosol-Assisted Chemical Vapour Deposition (AACVD)","Journal of Materials Chemistry","2010","20","29","6116","","10.1039/c0jm00830c","","","0.71069","MoKα","","0.0132","0.0129","","","0.0305","0.0306","","","","","","1.073","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7213633","16.0991","0.0016","8.8039","0.001","23.399","0.003","90","","120.917","0.007","90","","2845.2","0.6","296","","296","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C17 H8 Ag5 F12 N3 O10 -","- C17 H8 Ag5 F12 N3 O10 -","- C68 H32 Ag20 F48 N12 O40 -","4","1","","Li, Bo; Huang, Ren-Wu; Yao, Hong-Chang; Zang, Shuang-Quan; Mak, Thomas C. W.","Silver(i)‒organic frameworks assembled with flexible supramolecular synthons with a pendant ethynide arm attached to the heteroaryl skeleton","CrystEngComm","2014","16","4","723","","10.1039/c3ce41752b","","","0.71073","MoKα","","0.151","0.0884","","","0.1675","0.1955","","","","","","1.006","","","","has coordinates,has disorder","180467","2020-10-21","18:00:00",""
"7213769","18.782","0.004","9.3645","0.0019","18.609","0.004","90","","97.15","0.03","90","","3247.6","1.2","295","2","295","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C22 H24 Cu4 I4 N6 O -","- C22 H22 Cu4 I4 N6 O -","- C88 H88 Cu16 I16 N24 O4 -","4","1","","Zhang, Zhu-Yan; Deng, Zhao-Peng; Zhang, Xian-Fa; Huo, Li-Hua; Zhao, Hui; Gao, Shan","Self-assembly of [Cu3I2]- or [CuI]n-based (n = 2, 4, and ∞) coordination polymers from unsymmetrical bis(pyridyl) and in situ ligands: syntheses, structures, and properties","CrystEngComm","2014","16","3","359","","10.1039/c3ce41774c","","","0.71073","MoKα","","0.0955","0.0544","","","0.1434","0.1933","","","","","","1.094","","","","has coordinates,has disorder","180468","2020-10-21","18:00:00",""
"7213809","10.235","0.005","9.554","0.005","24.242","0.009","90","","112.62","0.016","90","","2188.2","1.8","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C44 H42 Cd2 N6 O13 -","- C44 H36 Cd2 N6 O13 -","- C88 H72 Cd4 N12 O26 -","2","0.5","","Jia, Chunmei; Lin, Qiang; Yuan, Wenbing","A series of coordination polymers constructed by a flexible tetracarboxylic acid: synthesis, structural diversity and luminescent properties","CrystEngComm","2014","16","12","2508","","10.1039/c3ce42127a","","","0.71073","MoKα","","0.0483","0.0384","","","0.0971","0.1027","","","","","","1.014","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213885","21.33","0.003","8.1009","0.0013","30.993","0.003","90","","122.46","0.007","90","","4518.7","1.1","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C41 H21 F12 N2 O8 S Zn2 -","- C41 H21 F12 N2 O8 S Zn2 -","- C164 H84 F48 N8 O32 S4 Zn8 -","4","1","","Shi, Zhi-Qiang; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Syntheses, structures, and photoluminescent properties of a series of metal‒organic frameworks constructed by 5,5′-bis(1H-imidazol-1-yl)-2,2′-bithiophene and various carboxylate ligands","CrystEngComm","2014","16","5","900","","10.1039/c3ce41966e","","","0.71073","MoKα","","0.0704","0.0424","","","0.1014","0.1091","","","","","","1.002","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213892","15.1796","0.0007","15.6453","0.0005","16.984","0.0015","90","","119.218","0.005","90","","3520.3","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C55 H41 Cd2 N5 O20 -","- C55 H41 Cd2 N5 O20 -","- C110 H82 Cd4 N10 O40 -","2","0.5","","Li, Huimin; Zhou, Jingmin; Shi, Wei; Zhang, Xuejing; Zhang, Zhenjie; Zhang, Meng; Cheng, Peng","Structural diversity of four new metal‒organic frameworks with a curved tetracarboxdiimide dicarboxylic acid","CrystEngComm","2014","16","5","834","","10.1039/c3ce41805g","","","0.71073","MOKα","","0.1062","0.0867","","","0.2439","0.2622","","","","","","1.069","","","","has coordinates,has disorder","180469","2020-10-21","18:00:00",""
"7214148","11.642","0.003","10.284","0.005","19.916","0.003","90","","114.706","0.016","90","","2166.2","1.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C40 H46 N10 O11 Zn -","- C40 H36 N10 O11 Zn -","- C80 H72 N20 O22 Zn2 -","2","0.5","","Wang, Hai-Ning; Shan, Guo-Gang; Li, Hai-Bin; Wang, Xin-Long; Cao, Hong-Tao; Su, Zhong-Min","A series of coordination compounds containing rigid multi-pyridine based ligands: syntheses, structures and properties","CrystEngComm","2014","16","13","2754","","10.1039/c3ce41841c","","","0.71069","MoKα","","0.126","0.0553","","","0.1135","0.1351","","","","","","0.869","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214149","12.036","0.003","10.259","0.003","17.392","0.004","90","","103.406","0.004","90","","2089","0.9","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C36 H44 Cd N12 O15 -","- C36 H26 Cd N12 O15 -","- C72 H52 Cd2 N24 O30 -","2","0.5","","Wang, Hai-Ning; Shan, Guo-Gang; Li, Hai-Bin; Wang, Xin-Long; Cao, Hong-Tao; Su, Zhong-Min","A series of coordination compounds containing rigid multi-pyridine based ligands: syntheses, structures and properties","CrystEngComm","2014","16","13","2754","","10.1039/c3ce41841c","","","0.71069","MoKα","","0.151","0.0965","","","0.265","0.293","","","","","","0.994","","","","has coordinates,has disorder","180472","2020-10-21","18:00:00",""
"7214403","11.4622","0.0015","9.4091","0.0012","22.611","0.003","90","","91.698","0.002","90","","2437.5","0.6","291","2","291","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C41 H60 Cd2 N4 O20 -","- C41 H60 Cd2 N4 O20 -","- C82 H120 Cd4 N8 O40 -","2","0.5","","Ju, Zemin; Cao, Dapeng; Qin, Ling; Zhang, Chuanlei; Zhang, Mingdao; Shi, Zhiqiang; Zheng, Hegen","Syntheses, characterization, and properties of five coordination compounds based on the ligand tetrakis(4-pyridyloxymethylene)methane","CrystEngComm","2014","16","19","3917","","10.1039/c3ce42477d","","","0.71073","MoKα","","0.0554","0.0459","","","0.1212","0.1302","","","","","","1.051","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214428","6.065","0.003","4.463","0.002","11.55","0.006","90","","90.081","0.006","90","","312.6","0.3","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- B3 Be4 K O9 -","- B3 Be4 K O9 -","- B6 Be8 K2 O18 -","2","0.5","","Wang, Shichao; Ye, Ning; Zou, Guohong","A new alkaline beryllium borate KBe4B3O9 with ribbon alveolate [Be2BO5]∞layers and the structural evolution of ABe4B3O9(A = K, Rb and Cs)","CrystEngComm","2014","16","19","3971","","10.1039/c4ce00085d","","","0.71073","MoKα","","0.02","0.0194","","","0.0544","0.0548","","","","","","1.131","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214516","11.4377","0.0005","10.9909","0.0004","23.6256","0.001","90","","101.327","0.002","90","","2912.1","0.2","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C30 H20 Cd N4 O6 -","- C30 H20 Cd N4 O6 -","- C120 H80 Cd4 N16 O24 -","4","1","","Huang, Shu-Yun; Li, Jian-Qiang; Liu, Shu-Juan; Ning, Yang; Meng, Li-Na; Li, Jin-Yuan; Luo, Ming-Biao; Luo, Feng","Construction and modulation of structural diversity in acylamide-MOFs","CrystEngComm","2014","16","25","5608","","10.1039/c4ce00490f","","","0.71073","MoKα","","0.0692","0.0655","","","0.166","0.1683","","","","","","1.113","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214527","4.664","0.002","13.625","0.006","6.339","0.002","90","","115.82","0.03","90","","362.6","0.3","296","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C8 H4 Mn O4 -","- C8 H4 Mn O4 -","- C16 H8 Mn2 O8 -","2","0.5","","Li, Ya-Min; Xiao, Chang-Yu; Zhang, Xu-Dong; Xu, Yan-Qing; Lun, Hui-Jie; Niu, Jing-Yang","MnII, CuII and CoII coordination polymers showing antiferromagnetism, and the coexistence of spin frustration and long range magnetic ordering","CrystEngComm","2013","15","38","7756","","10.1039/c3ce41046c","","","0.71073","MoKα","","0.0459","0.0435","","","0.1193","0.1199","","","","","","1.218","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214728","9.738","0.002","11.204","0.003","17.566","0.004","90","","102.186","0.003","90","","1873.3","0.8","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C32 H46.5 Co N4 O17.25 -","- C32 H46.5 Co N4 O17.25 -","- C64 H93 Co2 N8 O34.5 -","2","0.5","","Qin, Jie; Qin, Na; Geng, Cui-Hong; Ma, Jian-Ping; Liu, Qi-Kui; Wu, Dan; Zhao, Chao-Wei; Dong, Yu-Bin","Coordination polymer-templated photoinduced [2 + 2] dimerization of pyridine-based derivative","CrystEngComm","2012","14","24","8499","","10.1039/c2ce25561h","","","0.71073","MoKα","","0.0631","0.0498","","","0.1132","0.1192","","","","","","1.064","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214812","16.4076","0.0003","10.4683","0.0002","21.8806","0.0004","90","","119.305","0.001","90","","3277.25","0.11","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C60 H86 Fe Mn2 N11 O13 -","- C60 H86.001 Fe Mn2 N11 O13 -","- C120 H172.002 Fe2 Mn4 N22 O26 -","2","0.5","","Kara, Hulya; Azizoglu, Akın; Karaoglu, Ayse; Yahsi, Yasemin; Gungor, Elif; Caneschi, Andrea; Sorace, Lorenzo","Synthesis, crystal structure, magnetic properties and computational study of a series of cyano-bridged MnIII-FeIII complexes","CrystEngComm","2012","14","21","7320","","10.1039/c2ce25646k","","","0.71073","MoKα","","0.0516","0.035","","","0.0798","0.0877","","","","","","1.012","","","","has coordinates,has disorder","180479","2020-10-21","18:00:00",""
"7214827","12.9687","0.0012","7.9248","0.0007","14.4847","0.0014","90","","106.222","0.001","90","","1429.4","0.2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C25 H38 Cl Co N4 O11 -","- C25 H38 Cl Co N4 O11 -","- C50 H76 Cl2 Co2 N8 O22 -","2","0.5","","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","","0.0801","0.0607","","","0.1545","0.1687","","","","","","1.067","","","","has coordinates,has disorder","180479","2020-10-21","18:00:00",""
"7215044","15.529","0.002","7.9238","0.0011","28.524","0.003","90","","119.779","0.005","90","","3046.4","0.7","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C24 H83 Mn4 N16 O5 S12 Sb3 -","- C24 H83 Mn4 N16 O5 S12 Sb3 -","- C48 H166 Mn8 N32 O10 S24 Sb6 -","2","0.5","","Yue, Cheng-Yang; Lei, Xiao-Wu; Zang, Hui-Ping; Zhai, Xiu-Rong; Feng, Li-Juan; Zhao, Zhi-Fei; Zhao, Jian-Qiang; Liu, Xin-Yue","Two manganese‒amine complexes incorporating thioantimonates and exhibiting diversiform roles of amine ligands","CrystEngComm","2014","16","16","3424","","10.1039/c3ce42240b","","","0.71073","MoKα","","0.0492","0.0304","","","0.0752","0.1026","","","","","","1.079","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215090","25.5955","0.0003","10.439","0.0001","13.5467","0.0001","90","","90.954","0.001","90","","3619.06","0.06","173","0.14","173","0.14","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C50 H38 Si -","- C50 H38 Si -","- C200 H152 Si4 -","4","1","","Jiang, Tao; Jiang, Yibing; Qin, Wei; Chen, Shuming; Lu, Yahong; Lam, Jacky W. Y.; He, Bairong; Lu, Ping; Sung, Herman H. Y.; Williams, Ian D.; Kwok, Hoi Sing; Zhao, Zujin; Qiu, Huayu; Tang, Ben Zhong","Naphthalene-substituted 2,3,4,5-tetraphenylsiloles: synthesis, structure, aggregation-induced emission and efficient electroluminescence","Journal of Materials Chemistry","2012","22","38","20266","","10.1039/c2jm34621d","","x-ray","1.5418","CuKα","","0.0421","0.0363","","","0.1002","0.1041","","","","","","1.013","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215123","14.0195","0.0013","13.7541","0.0013","7.7115","0.0007","90","","102.829","0.002","90","","1449.9","0.2","293","2","293","2","","","","","","","synthesis as described","7","P 1 2/c 1","-P 2yc","13","","","","- C12 H12 Cs2 Li4 Mo2 N2 O22 -","- C12 H12 Cs2 Li4 Mo2 N2 O22 -","- C24 H24 Cs4 Li8 Mo4 N4 O44 -","2","0.5","","Deb, Dibakar; Duley, Soma; Radenković, Slavko; Bultinck, Patrick; Chattaraj, Pratim K.; Bhattacharjee, Manish","Heterotrimetallic compounds containing Mo-M-Li [M = K, Rb and Cs] clusters: synthesis, structure, bonding, aromaticity and theoretical investigations of Li2M2 [M = K and Rb] and Cs4 rings.","Physical chemistry chemical physics : PCCP","2012","14","44","15579","15592","10.1039/c2cp42105d","","","0.71073","MoKα","","0.0403","0.032","","","0.0823","0.0859","","","","","","1.065","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215135","14.5329","0.0007","13.9697","0.0007","25.1208","0.0018","90","","97.713","0.007","90","","5053.9","0.5","200","","200","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C60 H116 Cl4 N O44 Ru4 V10 -","- C60 H116 Cl4 N O44 Ru4 V10 -","- C120 H232 Cl8 N2 O88 Ru8 V20 -","2","0.5","","Hashikawa, Akihiro; Sawada, Yuki; Yamamoto, Yuma; Nishio, Masaki; Kosaka, Wataru; Hayashi, Yoshihito; Miyasaka, Hitoshi","Polyoxometalate-based frameworks with a linker of paddlewheel diruthenium(ii, iii) complexes","CrystEngComm","2013","15","24","4852","","10.1039/c3ce40426a","","","0.6988","","","","0.0708","","","","0.199","","","","","","0.864","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215670","13.013","0.002","8.7755","0.0016","8.4187","0.0013","90","","103.902","0.005","90","","933.2","0.3","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H15 La N10 O10 -","- C14 H15 La N10 O10 -","- C28 H30 La2 N20 O20 -","2","0.5","","Vilela, Sérgio M. F.; Ananias, Duarte; Silva, Patrícia; Nolasco, Mariela; Carlos, Luís D.; de Zea Bermudez, Verónica; Rocha, João; Tomé, João P. C.; Almeida Paz, Filipe A.","Coordination polymers based on a glycine-derivative ligand","CrystEngComm","2014","16","35","8119","","10.1039/C4CE00465E","","","0.71073","MoKα","","0.0766","0.0454","","","0.069","0.0766","","","","","","0.995","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215918","8.315","0.002","10.205","0.003","20.279","0.005","90","","113.12","0.012","90","","1582.6","0.7","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C30 H18 Cu N4 O10 S4 -","- C30 H18 Cu N4 O10 S4 -","- C60 H36 Cu2 N8 O20 S8 -","2","0.5","","Sanda, Suresh; Goswami, Soumyabrata; Jena, Himanshu Sekhar; Parshamoni, Srinivasulu; Konar, Sanjit","A family of three magnetic metal organic frameworks: their synthesis, structural, magnetic and vapour adsorption study","CrystEngComm","2014","16","22","4742","","10.1039/c3ce42451k","","","0.71073","MoKα","","0.0582","0.0567","","","0.1696","0.1713","","","","","","1.009","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7216603","14.6815","0.0005","10.149","0.0003","35.2706","0.0011","90","","99.88","0.002","90","","5177.5","0.3","150","2","150","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C50 H47 B2 Cu F8 N5 S4 -","- C50 H47 B2 Cu F8 N5 S4 -","- C200 H188 B8 Cu4 F32 N20 S16 -","4","1","","Holmes, Kathryn E.; Kelly, Paul F.; Elsegood, Mark R. J.","Structural diversity within the products of the reaction of Ph2SNH with copper(ii) tetrafluoroborate","CrystEngComm","2002","4","90","545","547","10.1039/b209185m","","","0.71073","MoKα","","0.0592","0.0432","","","0.1094","0.1197","","","","","","1.044","","","","has coordinates,has disorder","180497","2020-10-21","18:00:00",""
"7217014","15.061","0.005","4.938","0.002","20.805","0.003","90","","130.93","0.02","90","","1169","0.7","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","1,3-bis(1-uracilyl)-propan-2-one","","- C11 H10 N4 O5 -","- C11 H10 N4 O5 -","- C44 H40 N16 O20 -","4","1","","Roviello, Giovanni N.; Roviello, Giuseppina; Musumeci, Domenica; Capasso, Domenica; Di Gaetano, Sonia; Costanzo, Michele; Pedone, Carlo","Synthesis and supramolecular assembly of 1,3-bis(1′-uracilyl)-2-propanone","RSC Advances","2014","4","54","28691","","10.1039/c4ra03713h","","","0.71073","MoKα","","0.1173","0.071","","","0.2209","0.2947","","","","","","1.114","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217272","9.991","0.003","10.612","0.003","24.958","0.006","90","","104.45","0.009","90","","2562.5","1.2","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C54 H50 Cd Cl2 O6 P2 -","- C54 H46 Cd Cl2 O6.01 P2 -","- C108 H92 Cd2 Cl4 O12.02 P4 -","2","0.5","","Galkina, Irina; Tufatullin, Artem; Krivolapov, Dmitry; Bakhtiyarova, Yuliya; Chubukaeva, Dinara; Stakheev, Vitaly; Galkin, Vladimir; Cherkasov, Rafael; Büchner, Bernd; Kataeva, Olga","Crystal structure of phosphonium carboxylate complexes. The role of the metal coordination geometry, ligand conformation and hydrogen bonding","CrystEngComm","2014","16","38","9010","","10.1039/C4CE01361A","","","0.71073","MoKα","","0.0584","0.0471","","","0.1583","0.1653","","","","","","1.162","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217782","28.1637","0.0009","6.4411","0.0002","24.8679","0.0008","90","","115.445","0.002","90","","4073.6","0.2","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C60 H74 Mg6 O43 S4 -","- C60 H74 Mg6 O43 S4 -","- C120 H148 Mg12 O86 S8 -","2","0.5","","Wu, Cheng-You; Raja, Duraisamy Senthil; Yang, Chun-Chuen; Yeh, Chun-Ting; Chen, Yu-Ru; Li, Chen-Yu; Ko, Bao-Tsan; Lin, Chia-Her","Evaluation of structural transformation in 2D metal‒organic frameworks based on a 4,4′-sulfonyldibenzoate linker: microwave-assisted solvothermal synthesis, characterization and applications","CrystEngComm","2014","16","39","9308","","10.1039/C4CE01201A","","","0.71073","MoKα","","0.1118","0.0541","","","0.1468","0.1672","","","","","","1.037","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7218224","10.771","0.002","6.4406","0.0013","19.57","0.004","90","","98.21","0.03","90","","1343.7","0.5","223","2","223","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C32 H28 N2 O4 Zn -","- C32 H28 N2 O4 Zn -","- C64 H56 N4 O8 Zn2 -","2","0.5","","Ge, Yu; Li, Ni-Ya; Ma, Wei; Liu, Dong; Tang, Xiao-Yan","Structural diversity and photoluminescence properties of zinc coordination polymers constructed from 1,4-bis[2-(4-pyridyl)ethenyl]-2,3,5,6-tetramethylbenzene and para-dicarboxylates","CrystEngComm","2014","16","48","10949","","10.1039/C4CE01635A","","","0.71073","MoKα","","0.0299","0.0277","","","0.0763","0.0777","","","","","","1.085","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218228","15.063","0.003","6.1809","0.0012","23.546","0.008","90","","117.92","0.02","90","","1937","0.9","223","2","223","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C42 H38 N2 O5 Zn -","- C42 H38 N2 O5 Zn -","- C84 H76 N4 O10 Zn2 -","2","0.5","","Ge, Yu; Li, Ni-Ya; Ma, Wei; Liu, Dong; Tang, Xiao-Yan","Structural diversity and photoluminescence properties of zinc coordination polymers constructed from 1,4-bis[2-(4-pyridyl)ethenyl]-2,3,5,6-tetramethylbenzene and para-dicarboxylates","CrystEngComm","2014","16","48","10949","","10.1039/C4CE01635A","","","0.71073","MoKα","","0.078","0.0691","","","0.1995","0.2073","","","","","","1.067","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218269","8.204","0.003","12.534","0.003","18.02","0.005","90","","102.77","0.03","90","","1807.1","1","250","2","250","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C21 H16 N2 O7 -","- C21 H16 N2 O7 -","- C84 H64 N8 O28 -","4","1","","Sowa, Michał; Ślepokura, Katarzyna; Matczak-Jon, Ewa","Improving solubility of fisetin by cocrystallization","CrystEngComm","2014","16","46","10592","","10.1039/C4CE01713G","","","0.71073","MoKα","","0.1207","0.0584","","","0.1188","0.1316","","","","","","1","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218646","11.082","0.002","9.182","0.001","16.959","0.002","90","","92.36","0.01","90","","1724.2","0.4","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C9 H20.4 La O13.2 -","- C9 H15 La O13.2 -","- C36 H60 La4 O52.8 -","4","1","","Michaelides, Adonis; Aravia, Maria; Siskos, Michael G.; Skoulika, Stavroula","Photochemical reactivity of a lamellar lanthanum MOF","CrystEngComm","2015","17","1","124","","10.1039/C4CE01396D","","","0.71073","MoKα","","0.054","0.0407","","","0.0996","0.1077","","","","","","1.035","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218664","27.319","0.003","8.7331","0.0007","55.699","0.008","90","","95.685","0.009","90","","13223","3","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Hexamethylenetetramine 5,10,15,20-tetra(perfluoro-4'-iodophenyl)porphyrin","","- C50 H22 F16 I4 N8 -","- C50 H22 F16 I4 N8 -","- C400 H176 F128 I32 N64 -","8","2","","Syssa-Magalé, Jean-Laurent; Boubekeur, Kamal; Leroy, Jacques; Chamoreau, Lise-Marie; Fave, Claire; Schöllhorn, Bernd","Directed synthesis of a halogen-bonded open porphyrin network","CrystEngComm","2014","16","45","10380","","10.1039/C4CE01704H","","","0.71073","MoKα","","0.1201","0.0565","","","0.0818","0.1058","","","","","","0.992","","","","has coordinates","180517","2020-10-21","18:00:00",""
"7218947","11.6671","0.0008","10.8103","0.0007","12.2636","0.0009","90","","103.876","0.002","90","","1501.61","0.18","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H28 N14 O4 Zn3 -","- C24 H28 N14 O4 Zn3 -","- C48 H56 N28 O8 Zn6 -","2","0.5","","Mandal, Haridas; Chakrabartty, Sukanta; Ray, Debashis","Isothiocyanato and azido coordination induced structural diversity in zinc(ii) complexes with Schiff base containing tetrahydrofuran group: synthesis, characterization, crystal structure and fluorescence study","RSC Adv.","2014","4","110","65044","","10.1039/C4RA11352G","","","0.71073","MoKα","","0.0691","0.0579","","","0.1278","0.1356","","","","","","1.02","","","","has coordinates","180520","2020-10-21","18:00:00",""
"7219530","20.193","0.003","9.5523","0.0016","16.433","0.003","90","","104.235","0.003","90","","3072.4","0.9","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C68 H62 Cl2 N4 O4 P2 Sn2 -","- C68 H62 Cl2 N4 O4 P2 Sn2 -","- C136 H124 Cl4 N8 O8 P4 Sn4 -","2","0.5","","Gholivand, K.; Gholami, A.; Ebrahimi, A. A. V.; Abolghasemi, S. T.; Esrafili, M. D.; Fadaei, F. T.; Schenk, K. J.","Triphenyltin(iv) adducts of diphosphoryl ligands: structural, electronic and energy aspects from X-ray crystallography and theoretical calculations","RSC Adv.","2015","5","23","17482","","10.1039/C4RA12925C","","","0.71073","MoKα","","0.0876","0.0545","","","0.1141","0.1259","","","","","","1.032","","","","has coordinates","180526","2020-10-21","18:00:00",""
"7219531","19.1057","0.0008","10.0612","0.0004","16.6443","0.0006","90","","99.54","0.003","90","","3155.2","0.2","292","2","292","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","Mu-(1,3-phenylenebis(methylene) tetraphenyl diphosphoramidate) Bis(chlorotriphenyltin(IV))","","- C68 H60 Cl2 N2 O6 P2 Sn2 -","- C68 H60 Cl2 N2 O6 P2 Sn2 -","- C136 H120 Cl4 N4 O12 P4 Sn4 -","2","0.5","","Gholivand, K.; Gholami, A.; Ebrahimi, A. A. V.; Abolghasemi, S. T.; Esrafili, M. D.; Fadaei, F. T.; Schenk, K. J.","Triphenyltin(iv) adducts of diphosphoryl ligands: structural, electronic and energy aspects from X-ray crystallography and theoretical calculations","RSC Adv.","2015","5","23","17482","","10.1039/C4RA12925C","","","0.71073","MoKα","","0.0436","0.0262","","","0.056","0.0618","","","","","","1","","","","has coordinates","180526","2020-10-21","18:00:00",""
"7219763","20.1807","0.001","14.3707","0.0007","29.3758","0.0012","90","","111.272","0.003","90","","7938.9","0.7","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C79 H71 Cd5 Cl4 N12 O7.5 -","- C79 H70 Cd5 Cl4 N12 O7.5 -","- C316 H280 Cd20 Cl16 N48 O30 -","4","1","","Zheng, Zhi-Peng; Wei, Qin; Yin, Wen-Xia; Wan, Lin-Tao; Huang, Xia; Yu, Ying; Cai, Prof. Yue-Peng","Two Schiff base ligands for distiguishing ZnII/CdIIsensing — effect of substituent on fluorecent sensing","RSC Adv.","2015","","","","","10.1039/C5RA00987A","","","0.71073","MoKα","","0.0688","0.0389","","","0.0793","0.092","","","","","","1.047","","","","has coordinates","208944","2020-10-21","18:00:00",""
"7219921","11.563","0.002","15.735","0.003","23.079","0.004","90","","116.426","0.007","90","","3760.3","1.2","","","","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C80 H68 Cl Hg2 I3 N12 O4 -","- C80 H70 Cl Hg2 I3 N12 O4 -","- C160 H140 Cl2 Hg4 I6 N24 O8 -","2","0.5","","liu, qingxiang; Wei, Qing; Liu, Rui; Zhao, Xiao-Jun; Zhao, Zhi-Xiang","NHC Macrometallocycles of Mercury(II) and Silver(I): Synthesis, Structural Studies and Recognition of Hg(II) Complex 4 for Silver ion","RSC Adv.","2015","","","","","10.1039/C4RA14340J","","","","","","0.036","","","","","","","","","","","","","","","has coordinates","212110","2020-10-21","18:00:00",""
"7220010","16.7488","0.0009","12.8214","0.0009","30.458","0.002","90","","116.084","0.004","90","","5874.5","0.7","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C112 H98 Mn5 O44 -","- C108 H74 Mn5 O38 -","- C216 H148 Mn10 O76 -","2","0.5","","Zhang, Hong-Mei; Yang, Jin; Liu, Ying-Ying; Kang, Da-Wei; Ma, Jian-Fang","A family of coordination polymers assembled with a flexible hexacarboxylate ligand and auxiliary N-donor ligands: syntheses, structures, and physical properties","CrystEngComm","2015","17","16","3181","","10.1039/C5CE00181A","","","0.71073","MoKα","","0.1612","0.083","","","0.1674","0.1875","","","","","","1.085","","","","has coordinates","180531","2020-10-21","18:00:00",""
"7220097","16.476","0.006","19.474","0.008","18.238","0.007","90","","95.004","0.004","90","","5829","4","293","2","293","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C83 H96 Au6 F18 N3 P6 S6 Sb3 -","- C83 H96 Au6 F18 N3 P6 S6 Sb3 -","- C166 H192 Au12 F36 N6 P12 S12 Sb6 -","2","0.5","","Chen, Zhong-Ning; Li, Jia; Zhu, Xiaofeng; Zhang, Li-Yi","Structures and Luminescent Properties of Diethyldithiocarbamate-Bridged Polynuclear Gold(I) Cluster Complexes with Diphosphine/Triphosphine","RSC Adv.","2015","","","","","10.1039/C5RA01831E","","","0.71073","MoKα","","0.1083","0.0782","","","0.2076","0.2294","","","","","","0.983","","","","has coordinates,has disorder","180531","2020-10-21","18:00:00",""
"7220821","5.8438","0.0013","12.088","0.003","15.288","0.003","90","","99.975","0.005","90","","1063.6","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C10 H10 N O5 Zn -","- C10 H10 N O5 Zn -","- C40 H40 N4 O20 Zn4 -","4","1","","Bello, Lizaira; Quintero, Marilyn; Mora, Asiloé J.; González, Teresa; Escalona, Ana; Añez, Rafael; Ávila, Edward E.; Briceño, Alexander","Study of temperature and ligand flexibility effects on coordination polymer formation from cyclobutanetetracarboxylic acid","CrystEngComm","2015","17","31","5921","","10.1039/C5CE00646E","","","0.7107","MoKα","","0.0482","0.0363","","","0.0837","0.0922","","","","","","1.103","","","","has coordinates","153110","2020-10-21","18:00:00",""
"7220822","12.956","0.002","9.8991","0.001","16.96","0.002","90","","109.75","0.002","90","","2047.2","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C16 H22 N2 Ni O8 -","- C16 H22 N2 Ni O8 -","- C64 H88 N8 Ni4 O32 -","4","1","","Bello, Lizaira; Quintero, Marilyn; Mora, Asiloé J.; González, Teresa; Escalona, Ana; Añez, Rafael; Ávila, Edward E.; Briceño, Alexander","Study of temperature and ligand flexibility effects on coordination polymer formation from cyclobutanetetracarboxylic acid","CrystEngComm","2015","17","31","5921","","10.1039/C5CE00646E","","","0.7107","MoKα","","0.0422","0.033","","","0.0812","0.0879","","","","","","1.058","","","","has coordinates","153110","2020-10-21","18:00:00",""
"7221552","11.787","0.002","7.459","0.0015","11.559","0.002","90","","103.14","0.03","90","","989.7","0.3","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C8 H12 Cu2 Dy N9 O14 -","- C8 H12 Cu2 Dy N9 O14 -","- C16 H24 Cu4 Dy2 N18 O28 -","2","0.5","","Jiang, Xue; Han, Song-De; Zhao, Ran; Xu, Jian; Bu, Xian-He","Ln(III) ion dependent magnetism in heterometallic Cu-Ln complexes based on azide and 1,2,3-triazole-4,5-dicarboxylate as co-ligands","RSC Adv.","2015","","","","","10.1039/C5RA07972A","","","0.71073","MoKα","","0.0596","0.0549","","","0.1221","0.1244","","","","","","1.177","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7221553","11.827","0.002","7.4867","0.0015","11.557","0.002","90","","103.03","0.03","90","","997","0.3","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C8 H12 Cu2 Gd N9 O14 -","- C8 H12 Cu2 Gd N9 O14 -","- C16 H24 Cu4 Gd2 N18 O28 -","2","0.5","","Jiang, Xue; Han, Song-De; Zhao, Ran; Xu, Jian; Bu, Xian-He","Ln(III) ion dependent magnetism in heterometallic Cu-Ln complexes based on azide and 1,2,3-triazole-4,5-dicarboxylate as co-ligands","RSC Adv.","2015","","","","","10.1039/C5RA07972A","","","0.71073","MoKα","","0.0574","0.0448","","","0.0657","0.0685","","","","","","1.143","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7221554","11.878","0.002","7.4838","0.0015","11.582","0.002","90","","103.09","0.03","90","","1002.8","0.3","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C8 H12 Cu2 N9 O14 Sm -","- C8 H12 Cu2 N9 O14 Sm -","- C16 H24 Cu4 N18 O28 Sm2 -","2","0.5","","Jiang, Xue; Han, Song-De; Zhao, Ran; Xu, Jian; Bu, Xian-He","Ln(III) ion dependent magnetism in heterometallic Cu-Ln complexes based on azide and 1,2,3-triazole-4,5-dicarboxylate as co-ligands","RSC Adv.","2015","","","","","10.1039/C5RA07972A","","","0.71073","MoKα","","0.0523","0.0476","","","0.1052","0.1066","","","","","","1.336","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7221555","11.819","0.002","7.3367","0.0015","11.533","0.002","90","","103.19","0.03","90","","973.7","0.3","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C8 H12 Cu2 N9 O14 Tb -","- C8 H12 Cu2 N9 O14 Tb -","- C16 H24 Cu4 N18 O28 Tb2 -","2","0.5","","Jiang, Xue; Han, Song-De; Zhao, Ran; Xu, Jian; Bu, Xian-He","Ln(III) ion dependent magnetism in heterometallic Cu-Ln complexes based on azide and 1,2,3-triazole-4,5-dicarboxylate as co-ligands","RSC Adv.","2015","","","","","10.1039/C5RA07972A","","","0.71073","MoKα","","0.0801","0.0634","","","0.1344","0.143","","","","","","1.058","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7221657","26.01","0.011","10.83","0.005","15.972","0.007","90","","90.758","0.007","90","","4499","3","294","2","294","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C40 H52 Cu2 N8 O16 -","- C40 H52 Cu2 N8 O16 -","- C160 H208 Cu8 N32 O64 -","4","1","","Zhang, Zhong; Feng, Yan-Fang; Wei, Qiu-Yu; Hu, Kun; Chen, Zi-Lu; Liang, Fu-Pei","Metal-controlled structural variations of coordination architectures constructed from flexible 1H-benzimidazole-1-propionic acid","CrystEngComm","2015","17","35","6724","","10.1039/C5CE01250C","","","0.71073","MoKα","","0.058","0.0396","","","0.1037","0.1122","","","","","","1.032","","","","has coordinates","287938","2023-12-01","16:11:17",""
"7221661","14.897","0.008","10.377","0.006","8.216","0.005","90","","90.647","0.008","90","","1270","1.3","294","2","294","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C10 H10 Cl2 Hg N2 O2 -","- C10 H10 Cl2 Hg N2 O2 -","- C40 H40 Cl8 Hg4 N8 O8 -","4","1","","Zhang, Zhong; Feng, Yan-Fang; Wei, Qiu-Yu; Hu, Kun; Chen, Zi-Lu; Liang, Fu-Pei","Metal-controlled structural variations of coordination architectures constructed from flexible 1H-benzimidazole-1-propionic acid","CrystEngComm","2015","17","35","6724","","10.1039/C5CE01250C","","","0.71073","MoKα","","0.0268","0.0221","","","0.0654","0.0676","","","","","","1.043","","","","has coordinates","287938","2023-12-01","16:11:17",""
"7221662","12.8075","0.0005","9.6355","0.0003","15.8732","0.0007","90","","96.659","0.0018","90","","1945.64","0.13","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C23 H29 N O -","- C23 H29 N O -","- C92 H116 N4 O4 -","4","1","","Thériault, K D; Radford, C.; Parvez, M.; Heyne, B.; Sutherland, T. C.","Structure-property relationship of donor-acceptor acridones - an optical, electrochemical and computational study.","Physical chemistry chemical physics : PCCP","2015","17","32","20903","20911","10.1039/c5cp03222a","","","0.71073","MoKα","","0.0902","0.0675","","","0.1603","0.18","","","","","","1.064","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7222238","11.119","0.0002","11.0743","0.0003","21.2441","0.0005","90","","99.941","0.001","90","","2576.62","0.1","200","2","200","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C54 H64 N2 O6 P2 Pd2 -","- C54 H64 N2 O6 P2 Pd2 -","- C108 H128 N4 O12 P4 Pd4 -","2","0.5","","Pandey, Dilip K.; Khake, Shrikant M.; Gonnade, Rajesh G.; PUNJI, BENUDHAR","Mono- and binuclear palladacycles via regioselective C‒H bond activation: syntheses, mechanistic insights and catalytic activity in direct arylation of azoles","RSC Adv.","2015","","","","","10.1039/C5RA18289A","","","0.71073","MoKα","","0.062","0.0452","","","0.0744","0.0805","","","","","","1","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7222641","11.41","","13.73","","22.53","","90","","90.94","","90","","3529.06","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Ba8 (Sb6 S17)","","- Ba8 S17 Sb6 -","- Ba8 S17 Sb6 -","- Ba32 S68 Sb24 -","4","1","","Doerrscheidt, W.; Schaefer, H.","Zur Kenntnis des Bariumthioantimonats(III) Ba8 Sb6 S17","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986)","1981","36","","410","414","","","","","","","","","","","","","","","","","","","","","","has coordinates","163278","2020-10-21","18:00:00",""
"7222985","10.399","","6.422","","17.242","","90","","117.3","","90","","1023.21","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Ba4 Li Mo2 N7 -","- Ba4 Li Mo2 N7 -","- Ba16 Li4 Mo8 N28 -","4","1","","Hoehn, P.; Kniep, R.; Maier, J.","Li Ba4 [Mo2 N7] und Li Ba4 [W2 N7]: Neue Nitridomolybdate/wolframate(VI) mit dimeren Tetraeder-Anionen","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1994","49","","5","8","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7222986","10.424","","6.444","","17.266","","90","","117.36","","90","","1030.06","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Ba4 Li W2 N7","","- Ba4 Li N7 W2 -","- Ba4 Li N7 W2 -","- Ba16 Li4 N28 W8 -","4","1","","Hohn, P.; Maier, J.; Kniep, R.","Li Ba4 [Mo2 N7] und Li Ba4 [W2 N7]: Neue Nitridomolybdate/wolframate(VI) mit dimeren Tetraeder-Anionen","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1994","49","","5","8","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7223061","16.6795","0.0012","8.7264","0.0008","26.906","0.002","90","","101.297","0.007","90","","3840.3","0.5","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C27 H20 N2 O -","- C27 H20 N2 O -","- C216 H160 N16 O8 -","8","2","","Tomashenko, Olesya A.; Khlebnikov, Alexander F.; Mosiagin, Ivan P.; Novikov, Mikhail S.; Grachova, Elena Valeri; Shakirova, Julia R.; Tunik, Sergey P.","A new heterocyclic skeleton with highly tunable absorbtion/emission wavelength via H-bonding","RSC Adv.","2015","","","","","10.1039/C5RA17755C","","","1.54184","CuKα","","0.1812","0.0723","","","0.1604","0.24","","","","","","1.01","","","","has coordinates","192220","2020-10-21","18:00:00",""
"7223185","17.345","0.007","5.1415","0.0017","19.447","0.007","90","","112.506","0.005","90","","1602.2","1","110","","110","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Triflusal-Isonicotinamide cocrystal","","- C16 H13 F3 N2 O5 -","- C16 H13 F3 N2 O5 -","- C64 H52 F12 N8 O20 -","4","1","","Aitipamula, Srinivasulu; Mapp, Lucy K.; Wong, Annie B. H.; Chow, Pui Shan; Tan, Reginald B. H.","Novel pharmaceutical cocrystals of triflusal: crystal engineering and physicochemical characterization","CrystEngComm","2015","17","48","9323","","10.1039/C5CE01756D","","","0.71075","MoKα","","0.0686","0.0559","","","0.1566","0.1782","","","","","","1.108","","","","has coordinates,has disorder","173752","2020-10-21","18:00:00",""
"7223456","14.861","0.003","14.142","0.003","22.798","0.005","90","","106.37","0.03","90","","4597.1","1.8","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C48 H46 As8 N18 Ni5 O43 V14 -","- C48 H36 As8 N18 Ni5 O43 V14 -","- C96 H72 As16 N36 Ni10 O86 V28 -","2","0.5","","Guo, Hai-Yang; Li, Zhi-Fang; Zhang, Xiao; Fu, Li-Wei; Hu, Yang-Yang; Guo, Lan-Lan; Cui, Xiao-Bing; Huo, Qi-Sheng; Xu, Ji-Qing","New self-assembly hybrid compounds based on arsenic‒vanadium clusters and transition metal mixed-organic-ligand complexes","CrystEngComm","2016","18","4","566","","10.1039/C5CE01983D","","","0.71073","MoKα","","0.1144","0.074","","","0.1909","0.2334","","","","","","1.004","","","","has coordinates","175946","2020-10-21","18:00:00",""
"7223773","11.365","0.005","9.329","0.004","20.985","0.01","90","","97.4147","0.0015","90","","2206.3","1.7","153","2","153","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C36 H56 Ag5 N15 -","- C36 H56 Ag5 N15 -","- C72 H112 Ag10 N30 -","2","0.5","","Yang, Xiao; Wang, Yu; Zhou, Hao-Long; Liu, Yi-Jiang; He, Chun-Ting; Lin, Rui-Biao; Zhang, Jie-Peng","Guest-containing supramolecular isomers of silver(i) 3,5-dialkyl-1,2,4-triazolates: syntheses, structures, and structural transformation behaviours","CrystEngComm","2015","17","46","8843","","10.1039/C5CE00004A","","","0.71073","MoKα","","0.0392","0.0352","","","0.087","0.0905","","","","","","1.079","","","","has coordinates,has disorder","173652","2020-10-21","18:00:00",""
"7223810","14.827","0.004","14.635","0.004","15.017","0.004","90","","114.983","0.009","90","","2953.7","1.4","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C48 H88 Br2 N4 O10 Pd -","- C48 H80 Br2 N4 O10 Pd -","- C96 H160 Br4 N8 O20 Pd2 -","2","0.5","","Fortea-Pérez, Francisco Ramón; Marino, Nadia; De Munno, G.; Armentano, Donatella; Julve, Miguel; Stiriba, Salah-Eddine","Intermolecular interactions in dictating the self-assembly of halogen derivatives of bis-(N-substituted oxamato)palladate(II) complexes","RSC Adv.","2016","","","","","10.1039/C5RA25136B","","","0.71073","MoKα","","0.0554","0.0433","","","0.1189","0.1276","","","","","","1.045","","","","has coordinates,has disorder","173683","2020-10-21","18:00:00",""
"7223993","26.7698","0.0003","7.3672","0.0001","15.5539","0.0002","90","","97.758","0.001","90","","3039.44","0.07","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C32 H26 Ag N7 O9 -","- C32 H26 Ag N7 O9 -","- C128 H104 Ag4 N28 O36 -","4","1","","Wadhwa, Natasha R.; Hughes, Neil C.; Hachem, Jaafar A.; Mezei, Gellert","Metal-templated synthesis of intertwined, functionalized strands as precursors to molecularly woven materials","RSC Adv.","2016","","","","","10.1039/C5RA25584H","","","0.71073","MoKα","","0.0718","0.0389","","","0.0682","0.0778","","","","","","1.007","","","","has coordinates,has disorder","174843","2020-10-21","18:00:00",""
"7224093","10.7467","0.0005","15.8854","0.0007","19.3945","0.001","90","","91.363","0.002","90","","3310","0.3","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C37 H34 Dy N O8 -","- C37 H33 Dy N O8 -","- C148 H132 Dy4 N4 O32 -","4","1","","Cao, Xiao-Man; Wei, Na; Liu, Lin; Li, Li; Han, Zheng-Bo","Luminescent Lanthanide-Organic Polyrotaxane Framework as a Turn-Off Sensor for nitrobenzene and Fe3+","RSC Adv.","2016","","","","","10.1039/C5RA25872C","","","0.71073","MoKα","","0.1015","0.0525","","","0.1124","0.1329","","","","","","1.014","","","","has coordinates,has disorder","175409","2020-10-21","18:00:00",""
"7224094","10.8481","0.001","15.9105","0.0013","19.5148","0.0016","90","","92.135","0.002","90","","3365.9","0.5","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C37 H34 N O8 Tb -","- C37 H24 N O8 Tb -","- C148 H96 N4 O32 Tb4 -","4","1","","Cao, Xiao-Man; Wei, Na; Liu, Lin; Li, Li; Han, Zheng-Bo","Luminescent Lanthanide-Organic Polyrotaxane Framework as a Turn-Off Sensor for nitrobenzene and Fe3+","RSC Adv.","2016","","","","","10.1039/C5RA25872C","","","0.71073","MoKα","","0.1151","0.0513","","","0.1168","0.1452","","","","","","1.038","","","","has coordinates,has disorder","175409","2020-10-21","18:00:00",""
"7224095","10.8349","0.0005","15.8724","0.0008","19.5158","0.0012","90","","92.229","0.002","90","","3353.7","0.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C37 H34 Er N O8 -","- C37 H33 Er N O8 -","- C148 H132 Er4 N4 O32 -","4","1","","Cao, Xiao-Man; Wei, Na; Liu, Lin; Li, Li; Han, Zheng-Bo","Luminescent Lanthanide-Organic Polyrotaxane Framework as a Turn-Off Sensor for nitrobenzene and Fe3+","RSC Adv.","2016","","","","","10.1039/C5RA25872C","","","0.71073","MoKα","","0.1049","0.0527","","","0.1262","0.1516","","","","","","1.022","","","","has coordinates","175409","2020-10-21","18:00:00",""
"7224116","11.4479","0.0004","10.027","0.0003","18.5359","0.0007","90","","114.92","0.003","90","","1929.61","0.12","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","(1,10-phenanthroline)-bis(flumequinato)-cobalt(II)‒methanol‒water(1/1.6/0.4)","(1,10-phenanthroline)-bis(7-fluoro-12-methyl-4-oxo-1-azatricyclo[7.3.1.05,13]trideca-2,5,7,9(13)-tetraene-3-carboxylato)-cobalt(II)‒methanol‒water(1/1.6/0.4)","","- C41.6 H37.2 Co F2 N4 O8 -","- C41.6 H36.4 Co F2 N4 O8 -","- C83.2 H72.8 Co2 F4 N8 O16 -","2","0.5","","Tsitsa, Ifigenia; Tarushi, Alketa; Doukoume, Panagiota; Perdih, Franc; de Almeida, Andreia; Papadopoulos, Athanasios; Kalogiannis, Stavros; Casini, Angela; Turel, Iztok; Psomas, George L.","Structure and biological perspectives of metal complexes of flumequine","RSC Adv.","2016","","","","","10.1039/C5RA25776J","","","0.71073","MoKα","","0.0754","0.0612","","","0.1766","0.1887","","","","","","1.058","","","","has coordinates,has disorder","175459","2020-10-21","18:00:00",""
"7224291","22.1305","0.0004","5.90728","0.00009","33.8663","0.0006","90","","106.709","0.0018","90","","4240.45","0.13","293","2","293.15","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","","","- C30 H22 -","- C30 H22 -","- C240 H176 -","8","2","","Li, Ye-Xin; Yang, Xiao-Feng; Miao, Jin-Ling; Zhang, Zhen-Wei; Sun, Guo-Xin","Effects of substitution position on crystal packing, polymorphism and crystallization-induced emission of (9-anthryl)vinylstyrylbenzene isomers","CrystEngComm","2016","18","12","2098","","10.1039/C5CE02406D","","x-ray","1.54184","CuKα","","0.0677","0.0448","","","0.1089","0.122","","","","","","1.023","","","","has coordinates","181604","2020-10-21","18:00:00",""
"7224538","12.4152","0.0009","9.8806","0.0007","27.299","0.002","90","","97.276","0.002","90","","3321.8","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C80 H58 N10 O8 Zn2 -","- C80 H58 N10 O8 Zn2 -","- C160 H116 N20 O16 Zn4 -","2","0.5","","Guo, Xianmin; Yan, Yongnian; Guo, Huadong; Qi, Yanjuan; Liu, Chunming","Seven entangled coordination polymers assembled from triphenylamine-based bisimidazole and dicarboxylates: interpenetration, self-penetration and mixed entanglement","CrystEngComm","2016","18","14","2546","","10.1039/C6CE00102E","","","0.71073","MoKα","","0.1373","0.0545","","","0.1286","0.1844","","","","","","1.035","","","","has coordinates","181619","2020-10-21","18:00:00",""
"7225103","17.3778","0.0004","11.64042","0.00019","18.3475","0.0004","90","","110.413","0.003","90","","3478.36","0.14","150","0.1","150","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C27 H28 N3 O14.5 S3 Tb2 -","- C28 H28 N2 O14.5 S3 Tb2 -","- C112 H112 N8 O58 S12 Tb8 -","4","1","","Yawer, Mohd; Kariem, Mukaddus; Sood, Puneet; Sheikh, Haq Nawaz","Lanthanide-based entangled coordination polymers connected by thiophene-2,5-dicarboxylate: solvothermal syntheses, crystal structures, luminescence and magnetic properties","CrystEngComm","2016","18","20","3617","","10.1039/C6CE00321D","","x-ray","0.71073","MoKα","","0.0323","0.0271","","","0.0698","0.0728","","","","","","1.088","","","","has coordinates","185240","2020-10-21","18:00:00",""
"7225104","17.2053","0.0008","11.6462","0.0004","18.2629","0.0009","90","","110.462","0.005","90","","3428.6","0.3","150","0.1","150","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C23.5 H27 N8 O13.5 S3 Yb2 -","- C28 H28 N2 O14.5 S3 Yb2 -","- C112 H112 N8 O58 S12 Yb8 -","4","1","","Yawer, Mohd; Kariem, Mukaddus; Sood, Puneet; Sheikh, Haq Nawaz","Lanthanide-based entangled coordination polymers connected by thiophene-2,5-dicarboxylate: solvothermal syntheses, crystal structures, luminescence and magnetic properties","CrystEngComm","2016","18","20","3617","","10.1039/C6CE00321D","","x-ray","0.71073","MoKα","","0.0624","0.0566","","","0.1091","0.1118","","","","","","1.165","","","","has coordinates","185240","2020-10-21","18:00:00",""
"7225105","17.3974","0.0003","11.64531","0.00019","18.375","0.0004","90","","110.319","0.002","90","","3491.09","0.12","150","0.1","150","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C28 H28 Gd2 N2 O15 S3 -","- C28 H28 Gd2 N2 O15 S3 -","- C112 H112 Gd8 N8 O60 S12 -","4","1","","Yawer, Mohd; Kariem, Mukaddus; Sood, Puneet; Sheikh, Haq Nawaz","Lanthanide-based entangled coordination polymers connected by thiophene-2,5-dicarboxylate: solvothermal syntheses, crystal structures, luminescence and magnetic properties","CrystEngComm","2016","18","20","3617","","10.1039/C6CE00321D","","x-ray","0.71073","MoKα","","0.0379","0.0323","","","0.0791","0.0827","","","","","","1.105","","","","has coordinates","185240","2020-10-21","18:00:00",""
"7225106","17.3358","0.0004","11.6348","0.0002","18.3198","0.0004","90","","110.426","0.003","90","","3462.74","0.14","150","0.1","150","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C28 H28 Dy2 N2 O15 S3 -","- C28 H28 Dy2 N2 O15 S3 -","- C112 H112 Dy8 N8 O60 S12 -","4","1","","Yawer, Mohd; Kariem, Mukaddus; Sood, Puneet; Sheikh, Haq Nawaz","Lanthanide-based entangled coordination polymers connected by thiophene-2,5-dicarboxylate: solvothermal syntheses, crystal structures, luminescence and magnetic properties","CrystEngComm","2016","18","20","3617","","10.1039/C6CE00321D","","x-ray","0.71073","MoKα","","0.0384","0.0327","","","0.0733","0.0775","","","","","","1.045","","","","has coordinates","185240","2020-10-21","18:00:00",""
"7225500","15.703","0.005","3.7767","0.0011","16.028","0.005","90","","100.331","0.005","90","","935.1","0.5","153","2","153","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C3 H11 N11 O -","- C3 H11 N11 O -","- C12 H44 N44 O4 -","4","1","","chen, fuxue; Wang, Qi; Lu, Huijie; Pang, Fu-Qing; Huang, Jinglun; Nie, Fude","Nitrogen-rich hypergolic ionic salts based on (2-methyltetrazol-5-yl)diazotates","RSC Adv.","2016","","","","","10.1039/C6RA11494F","","","0.71073","MoKα","","0.0597","0.0414","","","0.1033","0.1157","","","","","","1.001","","","","has coordinates","198632","2020-10-21","18:00:00",""
"7225569","7.935","0.001","6.8376","0.0009","21.605","0.003","90","","105.871","0.004","90","","1127.5","0.3","296","2","296","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C22 H18 Cd O11 -","- C22 H10 Cd O11 -","- C44 H20 Cd2 O22 -","2","0.5","","Wu, Yunlong; Yang, Guo-Ping; Liu, Jiao; Yan, Yangtian; Luan, Xinjun; Zhang, Wen-Yan; Wang, Yao-Yu","Crystal structures from 1D to 3D: triggered by the different coordination morphologies of ligands in different reaction systems","CrystEngComm","2016","18","31","5901","","10.1039/C6CE00731G","","","0.71073","MoKα","","0.0485","0.0354","","","0.1051","0.1396","","","","","","1.07","","","","has coordinates","185251","2020-10-21","18:00:00",""
"7226035","26.818","0.006","6.8919","0.0008","9.7465","0.0012","90","","100.459","0.017","90","","1771.5","0.5","293","","293","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C24 H16 N2 -","- C24 H16 N2 -","- C96 H64 N8 -","4","1","","Xu, Yuanxiang; Xie, Zengqi; Zhang, Houyu; Shen, Fangzhong; Ma, Yuguang","Conformational polymorphism of a twisted conjugated molecule: controllable torsional motion for crystal growth selectivity","CrystEngComm","2016","18","36","6824","","10.1039/C6CE01057A","","","0.71073","MoKα","","0.1426","0.079","","","0.2134","0.2549","","","","","","1.06","","","","has coordinates,has disorder","187040","2020-10-21","18:00:00",""
"7226264","8.8698","0.0002","10.69","0.0003","17.5273","0.0005","90","","96.988","0.003","90","","1649.56","0.08","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C31 H36 Au2 Cl2 N4 O P2 -","- C31 H36 Au2 Cl2 N4 O P2 -","- C62 H72 Au4 Cl4 N8 O2 P4 -","2","0.5","","Strelnik, Igor D.; Gurzhiy, Vladislav V.; Sizov, Vladimir V.; Musina, Elvira I.; Karasik, Andrey A.; Tunik, Sergey P.; Grachova, Elena V.","A stimuli-responsive Au(i) complex based on an aminomethylphosphine template: synthesis, crystalline phases and luminescence properties","CrystEngComm","2016","18","39","7629","","10.1039/C6CE01272H","","","0.71073","MoKα","","0.0342","0.0262","","","0.0472","0.0494","","","","","","1.053","","","","has coordinates,has disorder","188067","2020-10-21","18:00:00",""
"7226266","15.3277","0.0005","8.872","0.0002","14.8008","0.0006","90","","112.309","0.004","90","","1862.07","0.12","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C28 H30 Au2 Cl2 N4 P2 -","- C28 H30 Au2 Cl2 N4 P2 -","- C56 H60 Au4 Cl4 N8 P4 -","2","0.5","","Strelnik, Igor D.; Gurzhiy, Vladislav V.; Sizov, Vladimir V.; Musina, Elvira I.; Karasik, Andrey A.; Tunik, Sergey P.; Grachova, Elena V.","A stimuli-responsive Au(i) complex based on an aminomethylphosphine template: synthesis, crystalline phases and luminescence properties","CrystEngComm","2016","18","39","7629","","10.1039/C6CE01272H","","","1.54184","CuKα","","0.0508","0.0444","","","0.1093","0.1137","","","","","","1.052","","","","has coordinates","188067","2020-10-21","18:00:00",""
"7226609","21.8891","0.0018","9.107","0.0008","32.038","0.003","90","","124.121","0.002","90","","5287.2","0.8","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C42 H26 N2 O8 Tb -","- C42 H26 N2 O8 Tb -","- C168 H104 N8 O32 Tb4 -","4","1","","Yao, Qingxia; Fan, Yerong; Wang, Zhan; Duan, Wenzeng; Wang, Suna; Li, Yunwu; Li, Dacheng; Zhang, Qingfu; Du, Yuchang; Dou, Jianmin","Coexistence of self- and interpenetration in two (3,6)-connected porous coordination polymers","CrystEngComm","2016","18","44","8574","","10.1039/C6CE01705C","","","0.71073","MoKα","","0.1024","0.0548","","","0.0992","0.1051","","","","","","1.01","","","","has coordinates,has disorder","190090","2020-10-21","18:00:00",""
"7226633","9.3607","0.0004","8.3293","0.0004","15.9905","0.001","90","","113.611","0.004","90","","1142.38","0.11","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C10 H13 Cd N2 O4 -","- C10 H13 Cd N2 O4 -","- C40 H52 Cd4 N8 O16 -","4","1","","Yang, Jin-Xia; Qin, Ye-Yan; Ye, Run-Ping; Zhang, Xin; Yao, Yuan-Gen","Employing mixed-ligand strategy to construct a series of luminescent Cd(ii) compounds with structural diversities","CrystEngComm","2016","18","42","8309","","10.1039/C6CE01607C","","","0.71073","MoKα","","0.0453","0.0316","","","0.0796","0.0931","","","","","","1.042","","","","has coordinates","188104","2020-10-21","18:00:00",""
"7226766","10.7602","0.0007","10.3933","0.0006","21.0922","0.0011","90","","113.25","0.003","90","","2167.3","0.2","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C18 H12.5 Eu N2.5 O13.5 Zn -","- C18 H11.5 Eu N2.5 O13.5 Zn -","- C72 H46 Eu4 N10 O54 Zn4 -","4","1","","Zheng, Sheng-Run; Tan, Jing-Bo; Cai, Song-Liang; Fan, Jun; Zhang, Wei-Guang","Construction of six new luminescent Ln(iii)‒Zn(ii) heterometallic coordination polymers based on heterometallic secondary building units","CrystEngComm","2016","18","44","8672","","10.1039/C6CE01184E","","","0.71073","MoKα","","0.0236","0.0207","","","0.0499","0.0515","","","","","","1.006","","","","has coordinates,has disorder","190087","2020-10-21","18:00:00",""
"7227507","11.53665","0.00013","7.59398","0.0001","35.9275","0.0004","90","","95.6775","0.001","90","","3132.14","0.06","110","2","110","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C50 H20 Ag B Cl20 F4 N10 -","- C50 H20 Ag B Cl20 F4 N10 -","- C100 H40 Ag2 B2 Cl40 F8 N20 -","2","0.5","","Aubert, E.; Abboud, M.; Doudouh, A.; Durand, P.; Peluso, P.; Ligresti, A.; Vigolo, B.; Cossu, S.; Pale, P.; Mamane, V.","Silver(i) coordination polymers with 3,3′,5,5′-tetrasubstituted 4,4′-bipyridine ligands: towards new porous chiral materials","RSC Adv.","2017","7","12","7358","","10.1039/C6RA28197D","","","1.54184","CuKα","","0.0277","0.0245","","","0.0672","0.0681","","","","","","1.137","","","","has coordinates","190878","2020-10-21","18:00:00",""
"7227547","28.811","0.006","5.488","0.0011","21.784","0.004","90","","100.25","0.03","90","","3389.4","1.2","293","2","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","1-phenyl-3-(1-pyrenyl) prop-2-en-1-one","","- C25 H16 O -","- C25 H16 O -","- C200 H128 O8 -","8","2","","Yu, Fangfang; Wang, Mingliang; Sun, Hao; Shan, Yaqi; Du, Man; Khan, Arshad; Usman, Rabia; Zhang, Wei; Shan, Hongbin; Xu, Chunxiang","Tuning the solid-state fluorescence of chalcone crystals via molecular coplanarity and J-aggregate formation","RSC Adv.","2017","7","14","8491","","10.1039/C6RA27458G","","","0.71073","MoKα","","0.1715","0.0693","","","0.1072","0.1313","","","","","","1.001","","","","has coordinates","202518","2020-10-21","18:00:00",""
"7227630","19.392","0.005","12.369","0.005","18.099","0.005","90","0.005","110.204","0.005","90","0.005","4074","2","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","SB-NS-371","","- C8 H9 F3 N2 S -","- C8 H9 F3 N2 S -","- C128 H144 F48 N32 S16 -","16","4","","Sharma, N.; Kumari, N.; Chundawat, T. S.; Kumar, S.; Bhagat, S.","Efficient trifluoromethylation of C(sp2)‒H functionalized α-oxoketene dithioacetals: a route to the regioselective synthesis of functionalized trifluoromethylated pyrazoles","RSC Adv.","2017","7","17","10150","","10.1039/C7RA01130J","","","0.71073","MoKα","","0.2134","0.1116","","","0.2682","0.3318","","","","","","1.071","","","","has coordinates","191853","2020-10-21","18:00:00",""
"7227905","16.164","0.005","11.755","0.005","20.199","0.004","90","","120.402","0.017","90","","3310.2","1.9","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C62 H46 Cd3 N6 O16 -","- C62 H46 Cd3 N6 O16 -","- C124 H92 Cd6 N12 O32 -","2","0.5","","Gupta, Anoop K.; Tomar, Kapil; Bharadwaj, Parimal K.","Cd(ii) coordination polymers constructed with a flexible carboxylate linker and pyridyl co-linkers: variation in the network topologies and photoluminescence properties","CrystEngComm","2017","19","16","2253","","10.1039/C7CE00156H","","","0.71069","MoKα","","0.0961","0.0593","","","0.1531","0.1683","","","","","","1.007","","","","has coordinates","196381","2020-10-21","18:00:00",""
"7228204","19.431","0.004","20.455","0.004","25.426","0.005","90","","91.9","0.03","90","","10100","3","110","2","110","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C109 H98 Cu3 F N4 O3 P6 -","- C109 H98 Cu3 F N4 O3 P6 -","- C436 H392 Cu12 F4 N16 O12 P24 -","4","1","","Zhou, Yu-Peng; Wei, Zhang-Wen; Lin, Zhuo-Jia; Ling, Hui-Tao; Guo, Zhengang; Zhang, Mei; Lam, Chi-Keung; Ye, Bao-Hui; Chao, Hsiu-Yi","Diverse binding of important anions in 1-D tricopper anion coordination polymer (ACP) architectures","CrystEngComm","2017","19","17","2349","","10.1039/C7CE00087A","","","0.71073","MoKα","","0.0916","0.0519","","","0.1371","0.1536","","","","","","1.05","","","","has coordinates","196235","2020-10-21","18:00:00",""
"7228420","90.6159","0.0013","4.96125","0.00011","7.30027","0.00018","90","","90.463","0.003","90","","3281.86","0.12","298","","298","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Lead(II) palmitate","Lead(II) hexadecanoate","","- C32 H62 O4 Pb -","- C32 H62 O4 Pb -","- C128 H248 O16 Pb4 -","4","1","","Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka","Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases","Phys. Chem. Chem. Phys.","2017","","","","","10.1039/C7CP02351K","powder diffraction","","1.54056","CuKα","","","","","","","","","3.2389","3.88","","","","","","","has coordinates","197642","2020-10-21","18:00:00",""
"7228423","75.2787","0.0017","4.96255","0.00012","7.2836","0.0002","90","","90.581","0.003","90","","2720.83","0.12","298","","298","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Lead(II) tridecanoate","","","- C26 H50 O4 Pb -","- C26 H50 O4 Pb -","- C104 H200 O16 Pb4 -","4","1","","Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka","Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases","Phys. Chem. Chem. Phys.","2017","","","","","10.1039/C7CP02351K","powder diffraction","","1.54056","CuKα","","","","","","","","","7.6664","5.94","","","","","","","has coordinates","197642","2020-10-21","18:00:00",""
"7228425","95.649","0.002","4.9544","0.0002","7.2989","0.0004","90","","90.492","0.006","90","","3458.7","0.2","298","","298","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Lead(II) heptadecanoate","Lead(II) heptadecanoate","","- C34 H66 O4 Pb -","- C34 H66 O4 Pb -","- C136 H264 O16 Pb4 -","4","1","","Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka","Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases","Phys. Chem. Chem. Phys.","2017","","","","","10.1039/C7CP02351K","powder diffraction","","1.54056","CuKα","","","","","","","","","5.7876","8.47","","","","","","","has coordinates","197642","2020-10-21","18:00:00",""
"7228426","54.9422","0.0003","4.98011","0.0001","7.25685","0.00016","90","","90.5625","0.0015","90","","1985.51","0.06","298","","298","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Lead(II) nonanoate, polymorph B","'Lead(II) nonanoate, polymorph B'","","- C18 H34 O4 Pb -","- C18 H34 O4 Pb -","- C72 H136 O16 Pb4 -","4","1","","Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka","Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases","Phys. Chem. Chem. Phys.","2017","","","","","10.1039/C7CP02351K","powder diffraction","","1.54056","CuKα","","","","","","","","","4.339","4.33","","","","","","","has coordinates","197642","2020-10-21","18:00:00",""
"7228429","70.263","0.002","4.96672","0.00015","7.2705","0.0002","90","","90.564","0.003","90","","2537.11","0.13","298","","298","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Lead(II) laurate","","","- C24 H46 O4 Pb -","- C24 H46 O4 Pb -","- C96 H184 O16 Pb4 -","4","1","","Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka","Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases","Phys. Chem. Chem. Phys.","2017","","","","","10.1039/C7CP02351K","powder diffraction","","0.8266","","","","","","","","","","6.5444","2.4","","","","","","","has coordinates","197642","2020-10-21","18:00:00",""
"7228430","85.4764","0.0013","4.96236","0.00012","7.2959","0.0002","90","","90.59","0.003","90","","3094.5","0.12","298","","298","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Lead(II) pentadecanoate","","","- C30 H58 O4 Pb -","- C30 H58 O4 Pb -","- C120 H232 O16 Pb4 -","4","1","","Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka","Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases","Phys. Chem. Chem. Phys.","2017","","","","","10.1039/C7CP02351K","powder diffraction","","1.54056","CuKα","","","","","","","","","5.2174","1.95","","","","","","","has coordinates","197642","2020-10-21","18:00:00",""
"7228431","80.5448","0.0019","4.96393","0.00016","7.2966","0.0003","90","","90.514","0.003","90","","2917.2","0.17","298","","298","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Lead(II) myristate","","","- C28 H54 O4 Pb -","- C28 H54 O4 Pb -","- C112 H216 O16 Pb4 -","4","1","","Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka","Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases","Phys. Chem. Chem. Phys.","2017","","","","","10.1039/C7CP02351K","powder diffraction","","1.54056","CuKα","","","","","","","","","7.2463","7.35","","","","","","","has coordinates","197642","2020-10-21","18:00:00",""
"7228432","60.021","0.002","4.9611","0.0002","7.2496","0.0004","90","","90.272","0.008","90","","2158.69","0.16","298","","298","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Lead(II) decanoate, polymorph B","'Lead(II) decanoate, polymorph B'","","- C20 H38 O4 Pb -","- C20 H38 O4 Pb -","- C80 H152 O16 Pb4 -","4","1","","Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka","Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases","Phys. Chem. Chem. Phys.","2017","","","","","10.1039/C7CP02351K","powder diffraction","","0.9941","","","","","","","","","","6.3563","0.405","","","","","","","has coordinates","197642","2020-10-21","18:00:00",""
"7228433","65.15169","","4.97107","","7.27081","","90","","90.4984","","90","","2354.73","","298","","298","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Lead(II) undecanoate","","","- C22 H42 O4 Pb -","- C22 H42 O4 Pb -","- C88 H168 O16 Pb4 -","4","1","","Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka","Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases","Phys. Chem. Chem. Phys.","2017","","","","","10.1039/C7CP02351K","powder diffraction","","1.54056","CuKα","","","","","","","","","6.7044","4.04","","","","","","","has coordinates","197642","2020-10-21","18:00:00",""
"7228434","100.8473","0.0019","4.95888","0.00018","7.303","0.0004","90","","90.488","0.004","90","","3652","0.2","298","","298","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Lead(II) stearate","Lead(II) octadecanoate","","- C36 H70 O4 Pb -","- C36 H70 O4 Pb -","- C144 H280 O16 Pb4 -","4","1","","Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka","Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases","Phys. Chem. Chem. Phys.","2017","","","","","10.1039/C7CP02351K","powder diffraction","","1.54056","CuKα","","","","","","","","","4.4806","8.05","","","","","","","has coordinates","197642","2020-10-21","18:00:00",""
"7228481","14.85237","0.00016","7.94141","0.00008","24.9573","0.0002","90","","91.3906","0.0009","90","","2942.82","0.05","123","","123","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C56 H74 Br4 N2 O16 -","- C56 H74 Br4 N2 O16 -","- C112 H148 Br8 N4 O32 -","2","0.5","","Puttreddy, Rakesh; Beyeh, Ngong Kodiah; Ras, Robin H.A.; Trant, John; Rissanen, Kari","Endo-/Exo- and Halogen Bonded Complexes of Conformationally Rigid Cethyl-2-bromoresorcinarene and aromatic N-oxides","CrystEngComm","2017","","","","","10.1039/C7CE00975E","","x-ray","1.54184","CuKα","","0.0288","0.0269","","","0.0664","0.0679","","","","","","1.028","","","","has coordinates,has disorder","197869","2020-10-21","18:00:00",""
"7228482","15.3678","0.0008","7.9991","0.0003","22.9088","0.0011","90","","104.628","0.005","90","","2724.9","0.2","120","","120","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C50 H61 Br4 N O12 -","- C50 H61 Br4 N O12 -","- C100 H122 Br8 N2 O24 -","2","0.5","","Puttreddy, Rakesh; Beyeh, Ngong Kodiah; Ras, Robin H.A.; Trant, John; Rissanen, Kari","Endo-/Exo- and Halogen Bonded Complexes of Conformationally Rigid Cethyl-2-bromoresorcinarene and aromatic N-oxides","CrystEngComm","2017","","","","","10.1039/C7CE00975E","","x-ray","0.71073","MoKα","","0.0599","0.0467","","","0.1334","0.1434","","","","","","1.044","","","","has coordinates,has disorder","197869","2020-10-21","18:00:00",""
"7228566","19.2714","0.0008","9.2919","0.0004","24.3117","0.0009","90","","92.9513","0.0014","90","","4347.7","0.3","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C46 H28 B F24 N -","- C46 H28 B F24 N -","- C184 H112 B4 F96 N4 -","4","1","","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","","0.0965","0.0548","","","0.1304","0.149","","","","","","1.043","","","","has coordinates,has disorder","198199","2020-10-21","18:00:00",""
"7229288","22.492","0.003","3.945","0.0005","20.893","0.003","90","","112.82","0.009","90","","1708.8","0.4","200","2","200","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C25 H17 N -","- C25 H17 N -","- C100 H68 N4 -","4","1","","Bandi, Vijayalakshmi; Kavala, Veerababurao; Hsu, Che-Hao; Konala, Ashok; Villuri, Bharath Kumar; Kotipalli, Trimurtulu; Kuo, Chun-Wei; Yao, Ching-Fa","Synthesis of functionalized unsymmetrical 1,3-butadiene-3-yne derivatives from β-halo styrene derivatives and their application in the synthesis of trisubstituted pyridines","RSC Adv.","2017","7","74","46704","","10.1039/C7RA07128K","","","0.71073","MoKα","","0.1852","0.0943","","","0.2358","0.2966","","","","","","1.043","","","","has coordinates,has disorder","201693","2020-10-21","18:00:00",""
"7229402","16.643","0.005","12.983","0.005","18.688","0.004","90","","119.996","0.018","90","","3497","2","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C28 H48 Dy O7 -","- C28 H48 Dy O7 -","- C112 H192 Dy4 O28 -","4","1","","Shi, Chao; Nie, Rong; Yao, Xu; Fan, Siqi; An, Guanghui; Dong, Yanping; Li, Guangming","Asymmetry-unit-dominated double slow-relaxation modes of 2,6-dimethyl-3,5-heptanedione dysprosium SMMs","RSC Adv.","2017","7","78","49701","","10.1039/C7RA09711E","","","0.71069","MoKα","","0.1075","0.0667","","","0.1504","0.1791","","","","","","0.995","","","","has coordinates","202350","2020-10-21","18:00:00",""
"7230131","14.2315","0.0015","11.3053","0.0012","15.4276","0.0016","90","","93.737","0.002","90","","2476.9","0.5","100","","100","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","3,5-Dimethyl-8-(anthracen-9-yl)-4,4-difluoro-4-bora-3a,4a-diaza-s-indacene","","- C26 H20 B Cl3 F2 N2 -","- C26 H20 B Cl3 F2 N2 -","- C104 H80 B4 Cl12 F8 N8 -","4","1","","Filatov, Mikhail A.; Karuthedath, Safakath; Polestshuk, Pavel M.; Callaghan, Susan; Flanagan, Keith J.; Telitchko, Maxime; Wiesner, Thomas; Laquai, Frédéric; Senge, Mathias O.","Control of triplet state generation in heavy atom-free BODIPY-anthracene dyads by media polarity and structural factors.","Physical chemistry chemical physics : PCCP","2018","20","12","8016","8031","10.1039/c7cp08472b","","x-ray","0.71073","MoKα","","0.0849","0.048","","","0.1102","0.1289","","","","","","1.013","","","","has coordinates,has disorder","230948","2020-10-21","18:00:00",""
"7230463","11.2469","0.0011","10.287","0.0009","20.5641","0.0018","90","","122.25","0.004","90","","2012.2","0.3","298","2","298.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C40 H42 Fe3 O17 Yb2 -","- C40 H42 Fe3 O17 Yb2 -","- C80 H84 Fe6 O34 Yb4 -","2","0.5","","Du, Xue-Dong; Zheng, Weiwei; Yi, Xiao-Hong; Zhao, Jiong-Peng; Wang, Peng; Wang, Chong-Chen","General strategy for lanthanide coordination polymers constructed from 1,1′-ferrocenedicarboxylic acid under hydrothermal conditions","CrystEngComm","2018","20","18","2608","","10.1039/C8CE00233A","","","0.71073","MoKα","","0.0671","0.0453","","","0.1153","0.1301","","","","","","0.805","","","","has coordinates,has disorder","229101","2020-10-21","18:00:00",""
"7230976","14.89","0.008","10.564","0.005","23.285","0.011","90","","107.455","0.006","90","","3494","3","293","2","293","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C21 H14 Eu O8 P -","- C21 H14 Eu O8 P -","- C84 H56 Eu4 O32 P4 -","4","1","","Hu, Tuoping; Zhao, Qiannan; Huo, Liangqin; Gao, Lingling; Zhang, Jie; Wang, Xiaoqing; Fan, Liming","Two lanthanide metal‒organic frameworks constructed from tris(4-carboxyphenyl)phosphane oxide with gas adsorption and magnetic properties","CrystEngComm","2018","20","30","4291","","10.1039/C8CE00661J","","","0.71073","MoKα","","0.1846","0.0714","","","0.1614","0.2032","","","","","","0.913","","","","has coordinates,has disorder","229081","2020-10-21","18:00:00",""
"7231146","12.212","0.005","14.092","0.005","16.78","0.006","90","","95.617","0.009","90","","2873.8","1.9","173","","173","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C25 H24 Co N4 O4 S -","- C25 H24 Co N4 O4 S -","- C100 H96 Co4 N16 O16 S4 -","4","1","","Fan, Chuanbin; Zong, Ziao; Zhang, Xia; Xu, Cungang; Zhu, Zheng; Meng, Xiangmin; Bi, Shuangyu; Fan, Yuhua","Rational assembly of functional Co-MOFs via a mixed-ligand strategy: synthesis, structure, topological variation, photodegradation properties and dye adsorption","CrystEngComm","2018","20","34","4973","","10.1039/C8CE00868J","","","0.71073","MoKα","","0.1463","0.0966","","","0.2684","0.3101","","","","","","1.073","","","","has coordinates,has disorder","229142","2020-10-21","18:00:00",""
"7231398","16.2604","0.0006","17.381","0.0006","30.3417","0.001","90","","101.28","0.002","90","","8409.6","0.5","100","2","99.99","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","catena-[(2,4,6-tri(pyridin-2-yl)-1,3,5-triazine)-(μ~5~-hydrogen benzene-1,3,5-tris(4-benzoato))]-manganese(II)-N,N'-dimethylformamide solvate]","","- C48.75 H36.75 Mn N7.25 O7.25 -","- C48.75 H36.75 Mn N7.25 O7.25 -","- C390 H294 Mn8 N58 O58 -","8","2","","Sensharma, Debobroto; Wix, Paul; Kathalikkattil, Amal Cherian; Schmitt, Wolfgang","Passing it up the ranks: hierarchical ion-size dependent supramolecular response in 1D coordination polymers","CrystEngComm","2018","20","35","5127","","10.1039/C8CE01211C","","","1.54178","CuKα","","0.0781","0.0636","","","0.1723","0.1847","","","","","","1.029","","","","has coordinates,has disorder","229124","2020-10-21","18:00:00",""
"7231400","16.281","0.003","17.516","0.003","30.291","0.004","90","","100.546","0.003","90","","8492","2","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H35 Cd N7 O7 -","- C48 H35 Cd N7 O7 -","- C384 H280 Cd8 N56 O56 -","8","2","","Sensharma, Debobroto; Wix, Paul; Kathalikkattil, Amal Cherian; Schmitt, Wolfgang","Passing it up the ranks: hierarchical ion-size dependent supramolecular response in 1D coordination polymers","CrystEngComm","2018","20","35","5127","","10.1039/C8CE01211C","","x-ray","0.71073","MoKα","","0.1881","0.1267","","","0.251","0.2798","","","","","","1.185","","","","has coordinates,has disorder","229124","2020-10-21","18:00:00",""
"7231556","22.9944","0.0014","9.5069","0.0006","14.6854","0.001","90","","93.394","0.002","90","","3204.7","0.4","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C80 H48 N6 O17 Zn2 -","- C80 H48 N6 O17 Zn2 -","- C160 H96 N12 O34 Zn4 -","2","0.5","","Tsai, Meng-Jung; Li, Chih-Yu; Wu, Jing-Yun","Luminescent Zn(ii) coordination polymers as efficient fluorescent sensors for highly sensitive detection of explosive nitroaromatics","CrystEngComm","2018","20","42","6762","","10.1039/C8CE01371C","","","0.71073","MoKα","","0.1564","0.1435","","","0.3024","0.3086","","","","","","1.173","","","","has coordinates","228967","2020-10-21","18:00:00",""
"7231837","11.1935","0.0006","9.2331","0.0005","16.7061","0.0008","90","","94.587","0.002","90","","1721.06","0.15","100","2","99.99","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C35 H34 Cl2 N4 O7 Zn -","- C35 H34 Cl2 N4 O7 Zn -","- C70 H68 Cl4 N8 O14 Zn2 -","2","0.5","","Lovitt, June I.; Hawes, Chris S.; Gunnlaugsson, Thorfinnur","Crystallographic studies of 2-picolyl substituted naphthalene diimide and bis-phthalimide ligands and their supramolecular coordination chemistry","CrystEngComm","2019","21","2","207","","10.1039/C8CE01756E","","x-ray","0.71073","MoKα","","0.0363","0.027","","","0.0734","0.0785","","","","","","1.059","","","","has coordinates,has disorder","223590","2020-10-21","18:00:00",""
"7231911","33.5945","0.0006","17.1635","0.0002","15.368","0.0002","90","","93.849","0.001","90","","8841.2","0.2","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C54 H38 Cu N10 O2 -","- C48 H24 Cu N8 -","- C384 H192 Cu8 N64 -","8","2","","Huang, Zhaodi; Zhang, Meixi; Lin, Huan; Ding, Shuo; Dong, Bin; Liu, Di; Wang, Hong; Dai, Fangna; Sun, Daofeng","Comparison of two water oxidation electrocatalysts by copper or zinc supermolecule complexes based on porphyrin ligand","RSC Advances","2018","8","70","40054","","10.1039/C8RA08338J","","","1.54184","CuKα","","0.1328","0.1025","","","0.3421","0.3772","","","","","","1.132","","","","has coordinates","212275","2020-10-21","18:00:00",""
"7232069","11.5188","0.0005","5.9468","0.0003","21.01","0.001","90","","99.854","0.001","90","","1417.95","0.12","296","2","296.15","","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C7 H20 Cr Cu2 K Mo6 N6 O26 -","- C7 H20 Cr Cu2 K Mo6 N6 O26 -","- C14 H40 Cr2 Cu4 K2 Mo12 N12 O52 -","2","0.5","","Ying, Jun; Chen, Ya-Guang; Wang, Xiu-Yan","A series of 0D to 3D Anderson-type polyoxometalate-based compounds obtained under ambient and hydrothermal conditions","CrystEngComm","2019","21","7","1168","","10.1039/C8CE01971A","","","0.71073","MoKα","","0.0292","0.0249","","","0.0615","0.0631","","","","","","1.085","","","","has coordinates","223658","2020-10-21","18:00:00",""
"7232452","11.9283","0.0006","6.5439","0.0003","6.8123","0.0003","90","","105.114","0.002","90","","513.36","0.04","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C10 H12 N4 O -","- C10 H12 N4 O -","- C20 H24 N8 O2 -","2","0.5","","Baudron, Stéphane A.; Chevreau, Hubert","Revisiting Ag‒π interactions with bis((pyrrol-2-yl)methylene)hydrazine: CC versus CN bond complexation","CrystEngComm","2019","21","12","1853","","10.1039/C9CE00168A","","","0.71073","MoKα","","0.0483","0.0437","","","0.1189","0.1223","","","","","","1.079","","","","has coordinates","223736","2020-10-21","18:00:00",""
"7232562","29.844","0.009","13.822","0.004","19.654","0.007","90","","107.719","0.009","90","","7723","4","293","2","293","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","Tetrabromovanadylporphyrin dimer","2,3,12,13-bromo-5,10,15,20-tetraphenylporphyrinatovanadium ?-oxodimer","","- C44 H24 Br4 N4 O0.5 V -","- C44 H24 Br4 N4 O0.5 V -","- C352 H192 Br32 N32 O4 V8 -","8","2","","Dar, Tawseef Ahmad; Tomar, Reshu; Mian, Rasel Mohammad; Sankar, Muniappan; Maurya, Mannar Ram","Vanadyl β-tetrabromoporphyrin: synthesis, crystal structure and its use as an efficient and selective catalyst for olefin epoxidation in aqueous medium","RSC Advances","2019","9","18","10405","","10.1039/C8RA09825E","","","0.71073","MoKα","","0.083","0.0475","","","0.0982","0.1144","","","","","","1.0924","","","","has coordinates","214461","2020-10-21","18:00:00",""
"7232808","11.61","0.0005","15.8524","0.0008","16.6978","0.0006","90","","90.443","0.003","90","","3073.1","0.2","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","[tetraaquabis(5-bromonicotinato-kO)ytterbium(III)] [diaquabis(5-bromonicotinato-k2O,O')bis(5-bromonicotinato-kO)dysprosium(III)] bis(5-bromonicotinic acid)","","- C24 H19 Br4 N4 O11 Yb -","- C24 H19 Br4 N4 O11 Yb -","- C96 H76 Br16 N16 O44 Yb4 -","4","1","","Ruiz, Cristina; García-Valdivia, Antonio A.; Fernández, Belén; Cepeda, Javier; Oyarzabal, Itziar; Abas, Elisa; Laguna, Mariano; García, Jose Angel; Fernández, Ignacio; San Sebastian, Eider; Rodríguez-Diéguez, Antonio","Multifunctional coordination compounds based on lanthanide ions and 5-bromonicotinic acid: magnetic, luminescence and anti-cancer properties","CrystEngComm","2019","21","25","3881","","10.1039/C9CE00292H","","","0.71073","MoKα","","0.1166","0.0558","","","0.0721","0.0847","","","","","","1.023","","","","has coordinates","223614","2020-10-21","18:00:00",""
"7232810","11.686","0.0006","15.9703","0.0009","16.7415","0.0009","90","","90.246","0.002","90","","3124.4","0.3","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","[tetraaquabis(5-bromonicotinato-kO)terbium(III)][diaquabis(5-bromonicotinato-k2O,O')bis(5-bromonicotinato-kO)terbium(III)] bis(5-bromonicotinic acid)","","- C24 H19 Br4 N4 O11 Tb -","- C24 H19 Br4 N4 O11 Tb -","- C96 H76 Br16 N16 O44 Tb4 -","4","1","","Ruiz, Cristina; García-Valdivia, Antonio A.; Fernández, Belén; Cepeda, Javier; Oyarzabal, Itziar; Abas, Elisa; Laguna, Mariano; García, Jose Angel; Fernández, Ignacio; San Sebastian, Eider; Rodríguez-Diéguez, Antonio","Multifunctional coordination compounds based on lanthanide ions and 5-bromonicotinic acid: magnetic, luminescence and anti-cancer properties","CrystEngComm","2019","21","25","3881","","10.1039/C9CE00292H","","","0.71073","MoKα","","0.0613","0.0355","","","0.0597","0.0666","","","","","","1.03","","","","has coordinates","223614","2020-10-21","18:00:00",""
"7233137","16.5479","0.0018","10.9047","0.001","17.9038","0.0018","90","","103.448","0.004","90","","3142.2","0.5","93","2","93","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C33 H33 F4 Ir N4 O2 -","- C33 H33 F4 Ir N4 O2 -","- C132 H132 F16 Ir4 N16 O8 -","4","1","","Florian Kessler; Yuichiro Watanabe; Hisahiro Sasabe; Hiroshi Katagiri; Md. K. Nazeeruddin; Michael Gratzel; Junji Kidobc","High-performance pure blue phosphorescent OLED using a novel bis-heteroleptic iridium(III) complex with fluorinated bipyridyl ligands","Journal of Materials Chemistry C","2013","1","","1070","1075","10.1039/C2TC00836J","","","0.71075","MoKα","","0.0532","0.0474","","","0.0696","0.0714","","","","","","1.24","","","","has coordinates","217054","2020-10-21","18:00:00",""
"7233164","7.9083","0.0008","8.4393","0.0008","19.2066","0.0019","90","","92.076","0.002","90","","1281","0.2","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","2,7-Bis-(pentafluorobenzoyl)-benzo[1,2-b:6,5-b'] dithiophene-4,5-bis-(ethyleneoxolane)","2,7-Bis-(pentafluorobenzoyl)-benzo[1,2-b:6,5-b'] dithiophene-4,5-bis-(ethyleneoxolane)","","- C28 H10 F10 O6 S2 -","- C28 H10 F10 O6 S2 -","- C56 H20 F20 O12 S4 -","2","0.5","","Yulia A. Getmanenko; Marina Fonari; Chad Risko; Bhupinder Sandhu; Elena Galan; Lingyun Zhu; Paul Tongwa; Do Kyung Hwang; Sanjeev Singh; He Wang; Shree Prakash Tiwari; Yueh-Lin Loo; Jean-Luc Bredas; Bernard Kippelen; Tatiana Timofeeva; Seth R. Marder","Benzo[1,2-b:6,5-b']dithiophene(dithiazole)-4,5-dione derivatives: synthesis, electronic properties, crystal packing and charge transport","Journal of Materials Chemistry C","2013","1","","1467","1481","10.1039/C2TC00805J","","","0.71073","MoKα","","0.1061","0.0432","","","0.0593","0.0716","","","","","","0.816","","","","has coordinates","217081","2020-10-21","18:00:00",""
"7233595","6.7867","0.0014","3.5336","0.0007","22.719","0.004","90","","90.69","0.03","90","","544.8","0.18","110","2","110","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","AgTCNQCl2","","","- C12 H2 Ag Cl2 N4 -","- C12 H2 Ag Cl2 N4 -","- C24 H4 Ag2 Cl4 N8 -","2","0.5","","Zhongyue Zhang; Hanhua Zhao; Michio M. Matsushita; Kunio Awaga; Kim R. Dunbar","A new metal-organic hybrid material with intrinsic resistance-based bistability: monitoring in situ room temperature switching behavior","Journal of Materials Chemistry C","2014","2","","399","404","10.1039/C3TC31577K","","","0.41328","Synchrotron","","0.042","0.0392","","","0.0906","0.0914","","","","","","1.396","","","","has coordinates","217902","2020-10-21","18:00:00",""
"7234274","12.47","0.0005","13.7514","0.0005","16.2964","0.0006","90","","105.061","0.0008","90","","2698.52","0.18","103","","103","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","C6-BADTDK","2,8-Dihexyl-6,12-dihydro-6,12-ethanoanthra[1,2-b:5,6-b']dithiophene-13,14-dione","","- C32 H34 O2 S2 -","- C32 H34 O2 S2 -","- C128 H136 O8 S8 -","4","1","","Cassandre Quinton; Mitsuharu Suzuki; Yoshitaka Kaneshige; Yuki Tatenaka; Chiho Katagiri; Yuji Yamaguchi; Daiki Kuzuhara; Naoki Aratani; Ken-ichi Nakayama; Hiroko Yamada","Evaluation of semiconducting molecular thin films solution-processed via the photoprecursor approach: the case of hexyl-substituted thienoanthracenes","Journal of Materials Chemistry C","2015","3","","5995","6005","10.1039/C5TC00794A","","","0.71075","MoKα","","","0.0589","","","","0.1559","","","","","","1.05","","","","has coordinates,has disorder","218962","2020-10-21","18:00:00",""
"7234355","9.5746","0.0004","4.6618","0.0002","16.122","0.0007","90","","107.035","0.002","90","","688.03","0.05","150","2","150","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C15 H14 N2 O4 -","- C15 H14 N2 O4 -","- C30 H28 N4 O8 -","2","0.5","","Devogelaer, Jan-Joris; Brugman, Sander J.T.; meekes, hugo; Tinnemans, Paul T.; Vlieg, Elias; de Gelder, Rene","Cocrystal design by network-based link prediction","CrystEngComm","2019","","","","","10.1039/C9CE01110B","","","0.71073","MoKα","","0.0682","0.0497","","","0.1577","0.1687","","","","","","1.247","","","","has coordinates,has disorder","219081","2020-10-21","18:00:00",""
"7234562","26.93","0.006","6.9117","0.0014","9.772","0.002","90","","100.45","0.03","90","","1788.7","0.7","293","2","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C24 H16 N2 -","- C24 H16 N2 -","- C96 H64 N8 -","4","1","","Yuanxiang Xu; Kai Wang; Yujian Zhang; Zengqi Xie; Bo Zou; Yuguang Ma","Fluorescence mutation and structural evolution of a pi-conjugated molecular crystal during phase transition","Journal of Materials Chemistry C","2016","4","","1257","1262","10.1039/C5TC03745J","","","0.71073","MoKα","","0.1382","0.0924","","","0.3063","0.3333","","","","","","1.063","","","","has coordinates","219293","2020-10-21","18:00:00",""
"7234589","8.7593","0.0004","13.946","0.0005","15.6865","0.0005","90","","95.93","0.003","90","","1905.96","0.13","110","2","110","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C32 H64 O6 P2 Ru -","- C32 H64 O6 P2 Ru -","- C64 H128 O12 P4 Ru2 -","2","0.5","","Janine Jeschke; Stefan Mockel; Marcus Korb; Tobias Ruffer; Khaybar Assim; Marcel Melzer; Gordon Herwig; Colin Georgi; Stefan E. Schulz; Heinrich Lang","Chemical vapor deposition of ruthenium-based layers by a single-source approach","Journal of Materials Chemistry C","2016","4","","2319","2328","10.1039/C5TC03930D","","","0.71073","MoKα","","0.0376","0.0318","","","0.0696","0.0715","","","","","","1.082","","","","has coordinates","219333","2020-10-21","18:00:00",""
"7234765","16.8716","0.0006","11.2042","0.0004","18.2255","0.0008","90","","111.644","0.001","90","","3202.3","0.2","273.15","","273.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C68 H62 N2 O25 Tb2 -","- C68 H62 N2 O25 Tb2 -","- C136 H124 N4 O50 Tb4 -","2","0.5","","Zhang, Jie; Gao, Lingling; Wang, Yang; Zhai, Lijun; Niu, Xiao-Yan; Hu, Tuoping","A Bifunctional 3D Tb-Based Metal−Organic Framework for Sensing and Removal of Antibiotics in Aqueous Medium","CrystEngComm","2019","","","","","10.1039/C9CE01303B","","","0.71076","MoKα","","0.0535","0.0297","","","0.055","0.0605","","","","","","1.011","","","","has coordinates,has disorder","219520","2020-10-21","18:00:00",""
"7234803","8.5231","0.0005","12.7666","0.0006","21.774","0.0016","90","","94.182","0.005","90","","2362.9","0.2","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C15 H26 Ag N7 O11 -","- C15 H22 Ag N7 O11 -","- C60 H88 Ag4 N28 O44 -","4","1","","Zhu, Li-Na; Deng, Zhaopeng; Huo, Li-Hua; Gao, Shan","A series of helical coordination polymers based on two racemic bis(pyridylmethylene) propane-1,2-diamine ligands: Relationship of conformations, structures and properties","CrystEngComm","2019","","","","","10.1039/C9CE01210A","","","0.71073","MoKα","","0.1359","0.1005","","","0.2688","0.3008","","","","","","1.046","","","","has coordinates,has disorder","220343","2020-10-21","18:00:00",""
"7234883","21.49","0.02","7.949","0.009","15.222","0.017","90","","90.696","0.013","90","","2600","5","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- H4 La2 N10 Na4 O32 -","- H4 La2 N10 Na4 O32 -","- H16 La8 N40 Na16 O128 -","4","1","","Bing-Hua Lei; Qingrong Kong; Zhihua Yang; Yun Yang; Ying Wang; Shilie Pan","Hierarchized band gap and enhanced optical responses of trivalent rare-earth metal nitrates due to (d-p)pi conjugation interactions","Journal of Materials Chemistry C","2016","4","","6295","6301","10.1039/C6TC01512C","","","0.71073","MoKα","","0.0994","0.0449","","","0.0833","0.1053","","","","","","0.932","","","","has coordinates","220589","2020-10-21","18:00:00",""
"7234926","12.5378","0.0017","12.7153","0.0017","21.843","0.003","90","","102.085","0.004","90","","3405.1","0.8","173","","173","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C41 H26 Cd N4 O7 -","- C41 H26 Cd N4 O7 -","- C164 H104 Cd4 N16 O28 -","4","1","","Fan, Chuanbin; Zong, Ziao; Meng, Xiangmin; Zhang, Xia; Zhang, Xiaoyin; Zhang, Dongmei; Xu, Cungang; Wang, Hu; Fan, Yuhua","Rational synthesis, crystal structure, and sensing and adsorption properties of luminescent metal‒organic frameworks","CrystEngComm","2019","21","33","4880","","10.1039/C9CE00545E","","","0.71073","MoKα","","0.0756","0.0467","","","0.0989","0.1119","","","","","","0.974","","","","has coordinates","223245","2020-10-21","18:00:00",""
"7235234","13.36","0.004","17.2","0.004","14.314","0.004","90","","94.69","0.01","90","","3278.2","1.5","150","2","150","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C26.5 H14 O5 Zn -","- C26.5 H14 O5 Zn -","- C106 H56 O20 Zn4 -","4","1","","Moreau, Florian; Audebrand, Nathalie; Poriel, Cyril","9,9′-Spirobifluorene based zinc coordination polymers: a study on linker geometry and topology","CrystEngComm","2020","22","2","293","303","10.1039/C9CE01567A","","","0.71069","MoKα","","0.0763","0.0566","","","0.1568","0.1682","","","","","","0.951","","","","has coordinates","257465","2020-10-21","18:00:00",""
"7235403","12.328","0.005","16.545","0.007","12.821","0.005","90","","109.19","0.005","90","","2469.7","1.7","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C50 H70 N4 O20 S -","- C50 H70 N4 O20 S -","- C100 H140 N8 O40 S2 -","2","0.5","","Fowler, Drew A.; Pfeiffer, Constance R.; Teat, Simon J.; Beavers, Christine M.; Baker, Gary A.; Atwood, Jerry L.","Illuminating host‒guest cocrystallization between pyrogallol[4]arenes and the ionic liquid 1-ethyl-3-methylimidazolium ethylsulfate","CrystEngComm","2014","16","27","6010","","10.1039/C4CE00359D","","","0.7749","synchrotron","","0.085","0.0668","","","0.2","0.2194","","","","","","1.068","","","","has coordinates,has disorder","232764","2020-10-21","18:00:00",""
"7236277","13.2348","0.001","5.427","0.0004","29.837","0.002","90","","96.396","0.002","90","","2129.7","0.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18 H18 Mo11 N6 O35 -","- C18 H18 Mo11 N6 O35 -","- C36 H36 Mo22 N12 O70 -","2","0.5","","Zhao, Y. H.; Jin, X. C.; Chen, L.; Ding, Y. F.; Mao, Z.; Fu, H.; Ao, Y. H.","Two new molybdates based on ∞[MonO3n+1]2− units (n = 11, 4) with proton conduction under ionothermal","RSC Advances","2017","7","12","7210","","10.1039/C6RA26729G","","","0.71073","MoKα","","0.0426","0.0341","","","0.1367","0.1503","","","","","","0.948","","","","has coordinates","235347","2020-10-21","18:00:00",""
"7236289","17.7764","0.0015","13.6685","0.0012","15.2008","0.0013","90","","102.863","0.002","90","","3600.8","0.5","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C33 H24 Cd N4 O4 -","- C33 H24 Cd N4 O4 -","- C132 H96 Cd4 N16 O16 -","4","1","","Meng, Xiang-min; Zhang, Xia; Qi, Peng-fei; Zong, Zi-ao; Jin, Fan; Fan, Yu-hua","Syntheses, structures, luminescent and photocatalytic properties of various polymers based on a “V”-shaped dicarboxylic acid","RSC Advances","2017","7","9","4855","","10.1039/C6RA27509E","","","0.71073","MoKα","","0.1115","0.0764","","","0.2214","0.2346","","","","","","1.096","","","","has coordinates,has disorder","235354","2020-10-21","18:00:00",""
"7237247","15.504","0.007","9.443","0.004","15.975","0.007","90","","99.277","0.014","90","","2308.2","1.8","173","","173","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C32 H20 N2 O11 Sc2 -","- C32 H16 N2 O11 Sc2 -","- C64 H32 N4 O22 Sc4 -","2","0.5","","Prasad, Ram R. R.; Seidner, Sarah E.; Cordes, David B.; Lozinska, Magdalena M.; Dawson, Daniel M.; Thompson, Megan J.; Düren, Tina; Chakarova, Kristina K.; Mihaylov, Mihail Y.; Hadjiivanov, Konstantin I.; Hoffmann, Frank; Slawin, Alexandra M. Z.; Ashbrook, Sharon E.; Clarke, Matthew L.; Wright, Paul A.","STA-27, a porous Lewis acidic scandium MOF with an unexpected topology type prepared with 2,3,5,6-tetrakis(4-carboxyphenyl)pyrazine","Journal of Materials Chemistry A","2019","7","10","5685","","10.1039/C8TA10610J","","","1.54187","CuKα","","0.1725","0.1409","","","0.4052","0.4218","","","","","","1.56","","","","has coordinates","237520","2020-10-21","18:00:00",""
"7237249","12.625","0.004","9.35","0.003","26.835","0.007","90","","107.011","0.012","90","","3029.1","1.6","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H18 Co N4 O6 -","- C26 H18 Co N4 O6 -","- C104 H72 Co4 N16 O24 -","4","1","","Parmar, Bhavesh; Patel, Parth; Pillai, Renjith S.; Kureshy, Rukhsana I.; Khan, Noor-ul H.; Suresh, Eringathodi","Efficient catalytic conversion of terminal/internal epoxides to cyclic carbonates by porous Co(ii) MOF under ambient conditions: structure‒property correlation and computational studies","Journal of Materials Chemistry A","2019","7","6","2884","","10.1039/C8TA10631B","","","0.71073","MoKα","","0.0903","0.0716","","","0.163","0.1699","","","","","","1.096","","","","has coordinates","237522","2020-10-21","18:00:00",""
"7237435","24.979","0.002","8.94","0.001","19.1","0.0005","90","","104.664","0.012","90","","4126.3","0.6","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","TME","","- C24 H24 B N O2 -","- C24 H24 B N O2 -","- C192 H192 B8 N8 O16 -","8","2","","Zhang, Kai; Sun, Qikun; Tang, Liangliang; Wang, Yanhui; Fan, Xiaojing; Liu, Linxi; Xue, Shanfeng; Yang, Wenjun","Cyclic boron esterification: screening organic room temperature phosphorescent and mechanoluminescent materials","Journal of Materials Chemistry C","2018","6","32","8733","","10.1039/C8TC02938E","","","0.71073","MoKα","","0.1477","0.0719","","","0.1607","0.1866","","","","","","1.016","","","","has coordinates","237664","2020-10-21","18:00:00",""
"7237686","19.636","0.002","16.5479","0.0017","28.621","0.003","90","","91.415","0.005","90","","9297.1","1.7","173","2","173.15","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C86 H66 B2 Cd2 F4 N8 O8 -","- C86 H66 B2 Cd2 F4 N8 O8 -","- C344 H264 B8 Cd8 F16 N32 O32 -","4","1","","Yang, Heng; Zhao, Ming; Zhang, Jing; Ma, Ji; Wu, Pengyan; Liu, Wenlong; Wen, Lili","A noble-metal-free photocatalyst system obtained using BODIPY-based MOFs for highly efficient visible-light-driven H2 evolution","Journal of Materials Chemistry A","2019","7","36","20742","","10.1039/C9TA06989E","","","0.71076","MoKα","","0.1951","0.137","","","0.3291","0.3631","","","","","","1.088","","","","has coordinates","238516","2020-10-21","18:00:00",""
"7237803","14.4699","0.0009","8.9409","0.0004","12.7644","0.0009","90","","102.94","0.007","90","","1609.44","0.17","293","2","293.15","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C30 H46 N6 O6 -","- C30 H46 N6 O6 -","- C60 H92 N12 O12 -","2","0.5","","Wang, Man; Cheng, Caiqi; Li, Chunbo; Wu, Dehua; Song, Jintong; Wang, Jun; Zhou, Xiangge; Xiang, Haifeng; Liu, Jin","Smart, chiral, and nonconjugated cyclohexane-based bis-salicylaldehyde hydrazides: multi-stimuli-responsive, turn-on, ratiometric, and thermochromic fluorescence, single-crystal structures via DFT calculations","Journal of Materials Chemistry C","2019","7","22","6767","","10.1039/C9TC01337G","","x-ray","0.71073","MoKα","","0.0863","0.0597","","","0.1448","0.1672","","","","","","1.039","","","","has coordinates","238623","2020-10-21","18:00:00",""
"7237820","19.0001","0.0019","7.868","0.0007","27.69","0.003","90","","105.364","0.003","90","","3991.5","0.7","298","2","298","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C52 H41 F O -","- C52 H41 F O -","- C208 H164 F4 O4 -","4","1","","Song, Tingting; Han, Yanbing; Jin, Pengcheng; Li, Xiaofang; Song, Yinglin; Xiao, Jinchong","The enhanced two-photon absorption behavior of twistfuranacenes to phenylacetylene-functionalized twistacenes","Journal of Materials Chemistry C","2019","7","21","6344","","10.1039/C9TC01568J","","","0.71073","MoKα","","0.2571","0.1393","","","0.3505","0.3836","","","","","","1.092","","","","has coordinates,has disorder","238637","2020-10-21","18:00:00",""
"7238146","19.03","0.004","7.23","0.0014","23.644","0.009","90","","123.76","0.02","90","","2704.5","1.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C51 H26 Co2 F18 O12 -","- C51 H26 Co2 F18 O12 -","- C102 H52 Co4 F36 O24 -","2","0.5","","Jiang, Hai-Long; Xu, Qiang","Counterion-induced controllable assembly of 2D and 3D metal‒organic frameworks: effect of coordination modes of dinuclear Cu(ii) paddle-wheel motifs","CrystEngComm","2010","12","11","3815","","10.1039/b921532h","","","0.71073","MoKα","","0.0531","0.0393","","","0.0906","0.0982","","","","","","1.029","","","","has coordinates","244082","2020-10-21","18:00:00",""
"7238147","12.71","0.003","6.98","0.0014","23.624","0.007","90","","118.5","0.02","90","","1841.8","0.9","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C17 H10 Cu F6 O5 -","- C17 H10 Cu F6 O5 -","- C68 H40 Cu4 F24 O20 -","4","1","","Jiang, Hai-Long; Xu, Qiang","Counterion-induced controllable assembly of 2D and 3D metal‒organic frameworks: effect of coordination modes of dinuclear Cu(ii) paddle-wheel motifs","CrystEngComm","2010","12","11","3815","","10.1039/b921532h","","","0.71073","MoKα","","0.0981","0.0704","","","0.1264","0.141","","","","","","1.049","","","","has coordinates","244082","2020-10-21","18:00:00",""
"7238148","18.76","0.004","7.28","0.0015","23.402","0.009","90","","123.12","0.02","90","","2676.8","1.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C51 H26 Cu2 F18 O12 -","- C51 H26 Cu2 F18 O12 -","- C102 H52 Cu4 F36 O24 -","2","0.5","","Jiang, Hai-Long; Xu, Qiang","Counterion-induced controllable assembly of 2D and 3D metal‒organic frameworks: effect of coordination modes of dinuclear Cu(ii) paddle-wheel motifs","CrystEngComm","2010","12","11","3815","","10.1039/b921532h","","","0.71073","MoKα","","0.1051","0.0418","","","0.0862","0.1219","","","","","","1.085","","","","has coordinates","244082","2020-10-21","18:00:00",""
"7238284","20.223","0.003","7.9438","0.0012","14.875","0.002","90","","97.797","0.009","90","","2367.5","0.6","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Zn(OH2)2 (Ac2N-(CH2)6-NAc2)","","- C14 H28 Cl2 N2 O14 Zn -","- C14 H28 Cl2 N2 O14 Zn -","- C56 H112 Cl8 N8 O56 Zn4 -","4","1","","Aakeröy, Christer B.; Desper, John; Haque, Naheed; Hussain, Izhar","Effective double-ended chelating agents: crystal structures of N,N,N′,N′-tetraacetyl diamino derivatives and their chelates","CrystEngComm","2010","12","10","3218","","10.1039/c004168h","","","0.71073","MoKα","","0.1386","0.0714","","","0.1623","0.1895","","","","","","0.874","","","","has coordinates,has disorder","244105","2020-10-21","18:00:00",""
"7238501","9.66","0.009","9.651","0.009","13.59","0.012","90","","128.17","0.05","90","","996.1","1.7","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","1,8-Bis(4-hydroxysalicylaldiminato)-3,6-diazaoctane) -iron(iii) chloride","","- C20 H24 Cl Fe N4 O4 -","- C20 H24 Cl Fe N4 O4 -","- C40 H48 Cl2 Fe2 N8 O8 -","2","0.5","","Nemec, Ivan; Herchel, Radovan; Šalitroš, Ivan; Trávníček, Zdeněk; Moncoľ, Ján; Fuess, Hartmut; Ruben, Mario; Linert, Wolfgang","Anion driven modulation of magnetic intermolecular interactions and spin crossover properties in an isomorphous series of mononuclear iron(iii) complexes with a hexadentate Schiff base ligand","CrystEngComm","2012","14","20","7015","","10.1039/c2ce25862e","","","0.71073","MoKα","","0.057","0.0306","","","0.0604","0.0657","","","","","","0.98","","","","has coordinates","244196","2020-10-21","18:00:00",""
"7238502","9.9131","0.0004","9.6378","0.0004","13.735","0.0007","90","","129.198","0.003","90","","1016.95","0.09","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","1,8-Bis(4-hydroxysalicylaldiminato)-3,6-diazaoctane) -iron(iii) chloride","","- C20 H24 Br Fe N4 O4 -","- C20 H24 Br Fe N4 O4 -","- C40 H48 Br2 Fe2 N8 O8 -","2","0.5","","Nemec, Ivan; Herchel, Radovan; Šalitroš, Ivan; Trávníček, Zdeněk; Moncoľ, Ján; Fuess, Hartmut; Ruben, Mario; Linert, Wolfgang","Anion driven modulation of magnetic intermolecular interactions and spin crossover properties in an isomorphous series of mononuclear iron(iii) complexes with a hexadentate Schiff base ligand","CrystEngComm","2012","14","20","7015","","10.1039/c2ce25862e","","","0.71073","MoKα","","0.0416","0.0297","","","0.0774","0.08","","","","","","1.036","","","","has coordinates","244196","2020-10-21","18:00:00",""
"7238503","10.168","0.003","9.68","0.003","13.871","0.004","90","","130.17","0.02","90","","1043.2","0.6","160","2","160","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","1,8-Bis(4-hydroxysalicylaldiminato)-3,6-diazaoctane) -iron(iii) iodide","","- C20 H24 Fe I N4 O4 -","- C20 H24 Fe I N4 O4 -","- C40 H48 Fe2 I2 N8 O8 -","2","0.5","","Nemec, Ivan; Herchel, Radovan; Šalitroš, Ivan; Trávníček, Zdeněk; Moncoľ, Ján; Fuess, Hartmut; Ruben, Mario; Linert, Wolfgang","Anion driven modulation of magnetic intermolecular interactions and spin crossover properties in an isomorphous series of mononuclear iron(iii) complexes with a hexadentate Schiff base ligand","CrystEngComm","2012","14","20","7015","","10.1039/c2ce25862e","","","0.71073","MoKα","","0.083","0.062","","","0.154","0.1624","","","","","","1.107","","","","has coordinates","244196","2020-10-21","18:00:00",""
"7238587","37.5021","0.0011","15.4876","0.0004","42.453","0.0012","90","","114.594","0.001","90","","22420.5","1.1","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C202 H182 Cl8 Cu8 N50 O38 -","- C202 H182 Cl8 Cu8 N50 O38 -","- C808 H728 Cl32 Cu32 N200 O152 -","4","1","","Najar, Adel M.; Tidmarsh, Ian S.; Ward, Michael D.","An octanuclear helical ‘molecular wheel’ from hierarchical assembly of four dinuclear Cu2 units in a mixed-ligand array","RSC Advances","2012","2","4","1326","","10.1039/c2ra01177h","","","0.71073","MoKα","","0.1656","0.1097","","","0.3292","0.3609","","","","","","1.187","","","","has coordinates,has disorder","244244","2020-10-21","18:00:00",""
"7238660","11.767","0.002","6.7984","0.0014","13.303","0.003","90","","115.03","0.03","90","","964.3","0.4","291","2","291","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C6 H8 F3 N3 O S -","- C6 H8 F3 N3 O S -","- C24 H32 F12 N12 O4 S4 -","4","1","","Safaei, Shirin; Mohammadpoor-Baltork, Iraj; Khosropour, Ahmad Reza; Moghadam, Majid; Tangestaninejad, Shahram; Mirkhani, Valiollah; Kia, Reza","Application of a multi-SO3H Brønsted acidic ionic liquid in water: a highly efficient and reusable catalyst for the regioselective and scaled-up synthesis of pyrazoles under mild conditions","RSC Advances","2012","2","13","5610","","10.1039/c2ra20624b","","","0.71073","MoKα","","0.0713","0.0323","","","0.0605","0.0662","","","","","","0.795","","","","has coordinates","244275","2020-10-21","18:00:00",""
"7239207","4.7249","0.0007","6.2811","0.0009","28.965","0.004","90","","94.639","0.003","90","","856.8","0.2","296","2","296","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C21 H19 N3 -","- C21 H19 N3 -","- C42 H38 N6 -","2","0.5","","Wong, Wing-Yan; Lee, Siu-Fung; Chan, Hoi-Shan; Mak, Thomas C. W.; Wong, Chi-Hin; Huang, Lau-Shan; Stoddart, J. Fraser; Cham-Fai Leung, Ken","Recognition between V- and dumbbell-shaped molecules","RSC Advances","2013","3","48","26382","","10.1039/c3ra43470b","","","0.71073","MoKα","","0.181","0.1742","","","0.6124","0.6184","","","","","","3.356","","","","has coordinates","244598","2020-10-21","18:00:00",""
"7239301","16.6389","0.0022","7.1141","0.0012","9.104","0.0017","90","","95.46","0.01","90","","1072.8","0.3","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C16 H22 Ca O13 P2 -","- C16 H22 Ca O13 P2 -","- C32 H44 Ca2 O26 P4 -","2","0.5","","Dobrzyńska, Danuta; Kubiak, Joanna; Janczak, Jan; Zoń, Jerzy","Supramolecular networks formation in crystals of 3-carboxybenzylphosphonic acid, its complexes and salts: from coordination bonds to weak intermolecular interactions","RSC Advances","2013","3","45","23119","","10.1039/c3ra44614j","","","0.71073","MoKα","","0.0961","0.0392","","","0.0586","0.0689","","","","","","1.001","","","","has coordinates","244643","2020-10-21","18:00:00",""
"7239468","12.3922","0.0011","9.0079","0.001","20.4967","0.0015","90","","92.244","0.001","90","","2286.2","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H9 F10 N3 O -","- C26 H9 F10 N3 O -","- C104 H36 F40 N12 O4 -","4","1","","Hong, Tao; Song, Heli; Li, Xin; Zhang, Weibing; Xie, Yongshu","Syntheses of mono- and diacylated bipyrroles with rich substitution modes and development of a prodigiosin derivative as a fluorescent Zn(ii) probe","RSC Advances","2014","4","12","6133","","10.1039/c3ra47277a","","","0.71073","MoKα","","0.1207","0.0512","","","0.0864","0.1211","","","","","","1.032","","","","has coordinates","244723","2020-10-21","18:00:00",""
"7239506","10.064","0.003","11.475","0.003","15.916","0.005","90","","103.182","0.005","90","","1789.6","0.9","223","2","223","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18 H12 Fe N2 O4 -","- C18 H12 Fe N2 O4 -","- C72 H48 Fe4 N8 O16 -","4","1","","Horike, Satoshi; Sugimoto, Masayuki; Kongpatpanich, Kanokwan; Hijikata, Yuh; Inukai, Munehiro; Umeyama, Daiki; Kitao, Shinji; Seto, Makoto; Kitagawa, Susumu","Fe2±based layered porous coordination polymers and soft encapsulation of guests via redox activity","Journal of Materials Chemistry A","2013","1","11","3675","","10.1039/c3ta01414b","","","0.71075","MoKα","","0.1087","0.0987","","","0.2965","0.3074","","","","","","1.161","","","","has coordinates","244737","2020-10-21","18:00:00",""
"7239914","19.329","0.004","18.257","0.004","23.014","0.004","90","","107.892","0.003","90","","7729","3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C144 H98 Dy8 N24 O61 -","- C144 H98 Dy8 N24 O61 -","- C288 H196 Dy16 N48 O122 -","2","0.5","","Li, Rong-fang; Li, Rui-hao; Liu, Xin-fang; Chang, Xin-hong; Feng, Xun","Lanthanide complexes based on a conjugated pyridine carboxylate ligand: structures, luminescence and magnetic properties","RSC Advances","2020","10","11","6192","6199","10.1039/C9RA10975G","","","0.71073","MoKα","","0.0676","0.0495","","","0.1336","0.1502","","","","","","1.009","","","","has coordinates","258135","2020-10-21","18:00:00",""
"7239916","19.3527","0.0003","18.2613","0.0003","23.1008","0.0004","90","","107.756","0.002","90","","7775","0.2","296.8","0.4","296.8","0.4","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C144 H98 N24 O61 Tb8 -","- C144 H98 N24 O61 Tb8 -","- C288 H196 N48 O122 Tb16 -","2","0.5","","Li, Rong-fang; Li, Rui-hao; Liu, Xin-fang; Chang, Xin-hong; Feng, Xun","Lanthanide complexes based on a conjugated pyridine carboxylate ligand: structures, luminescence and magnetic properties","RSC Advances","2020","10","11","6192","6199","10.1039/C9RA10975G","","x-ray","0.71073","MoKα","","0.0349","0.0279","","","0.0603","0.0626","","","","","","1.048","","","","has coordinates","258135","2020-10-21","18:00:00",""
"7240173","24.671","0.005","8.876","0.0018","23.946","0.005","90","","101.26","0.03","90","","5142.8","1.9","100","","100","","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C42 H57 Br1.5 F9 I3 N3 O3 P1.5 -","- C42 H57 Br1.5 F9 I3 N3 O3 P1.5 -","- C168 H228 Br6 F36 I12 N12 O12 P6 -","4","1","","Foyle, Émer M.; White, Nicholas G.","Anion templated crystal engineering of halogen bonding tripodal tris(halopyridinium) compounds","CrystEngComm","2020","","","","","10.1039/D0CE00241K","","","0.71073","Synchrotron","","0.1829","0.0812","","","0.2165","0.2833","","","","","","1.0269","","","","has coordinates","249689","2020-10-21","18:00:00",""
"7240232","7.5505","0.0015","8.4609","0.0017","19.059","0.004","90","","94.78","0.005","90","","1213.3","0.4","99.98","","99.98","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C24 H32 Cl Mn N4 O4 -","- C24 H32 Cl Mn N4 O4 -","- C48 H64 Cl2 Mn2 N8 O8 -","2","0.5","","Villaman, David; McMonagle, Charles J.; Probert, Michael; Peña, Octavio; Moreno, Yanko; Fuentealba, Mauricio","Structural Studies of Manganese(III) Complex with Spin-Crossover and Thermochromic Properties","CrystEngComm","2020","","","","","10.1039/C9CE01962F","","","0.56086","AgKα","","0.0967","0.0579","","","0.1242","0.1467","","","","","","1.048","","","","has coordinates,has disorder","249894","2020-10-21","18:00:00",""
"7240233","8.0387","0.0016","8.3211","0.0016","19.109","0.004","90","","91.225","0.005","90","","1277.9","0.4","349.98","","349.98","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C24 H32 Cl Mn N4 O4 -","- C24 H32 Cl Mn N4 O4 -","- C48 H64 Cl2 Mn2 N8 O8 -","2","0.5","","Villaman, David; McMonagle, Charles J.; Probert, Michael; Peña, Octavio; Moreno, Yanko; Fuentealba, Mauricio","Structural Studies of Manganese(III) Complex with Spin-Crossover and Thermochromic Properties","CrystEngComm","2020","","","","","10.1039/C9CE01962F","","","0.56086","AgKα","","0.1262","0.0535","","","0.1327","0.1611","","","","","","1.051","","","","has coordinates","249894","2020-10-21","18:00:00",""
"7240234","7.8657","0.0004","8.3573","0.0005","19.1322","0.0011","90","","92.729","0.002","90","","1256.25","0.12","289.99","","289.99","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C24 H32 Cl Mn N4 O4 -","- C24 H32 Cl Mn N4 O4 -","- C48 H64 Cl2 Mn2 N8 O8 -","2","0.5","","Villaman, David; McMonagle, Charles J.; Probert, Michael; Peña, Octavio; Moreno, Yanko; Fuentealba, Mauricio","Structural Studies of Manganese(III) Complex with Spin-Crossover and Thermochromic Properties","CrystEngComm","2020","","","","","10.1039/C9CE01962F","","","0.56086","AgKα","","0.1082","0.0426","","","0.1148","0.1458","","","","","","1.102","","","","has coordinates","249894","2020-10-21","18:00:00",""
"7240235","8.1041","0.0017","8.3084","0.0017","19.127","0.004","90","","90.843","0.005","90","","1287.7","0.5","400","","400","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C24 H32 Cl Mn N4 O4 -","- C24 H32 Cl Mn N4 O4 -","- C48 H64 Cl2 Mn2 N8 O8 -","2","0.5","","Villaman, David; McMonagle, Charles J.; Probert, Michael; Peña, Octavio; Moreno, Yanko; Fuentealba, Mauricio","Structural Studies of Manganese(III) Complex with Spin-Crossover and Thermochromic Properties","CrystEngComm","2020","","","","","10.1039/C9CE01962F","","","0.56086","AgKα","","0.1389","0.0469","","","0.1227","0.1641","","","","","","1.055","","","","has coordinates","249894","2020-10-21","18:00:00",""
"7240334","7.574","0.0008","12.2366","0.0012","15.0059","0.0015","90","","93.741","0.003","90","","1387.8","0.2","273","2","273","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C28 H21 Cl2 N5 O5 Zn -","- C28 H21 Cl2 N5 O5 Zn -","- C56 H42 Cl4 N10 O10 Zn2 -","2","0.5","","Hao, Pengfei; Zhu, Huihui; Pang, Yue; Shen, Junju; Fu, Yunlong","The impact of positional isomerism on electronic and photochromic properties of 1-D zinc-based naphthalene diimide coordination polymers","CrystEngComm","2020","","","","","10.1039/D0CE00025F","","","0.71073","MoKα","","0.0392","0.032","","","0.0839","0.0879","","","","","","1.046","","","","has coordinates","250908","2020-10-21","18:00:00",""
"7240509","10.5864","0.0011","4.3468","0.0005","15.0822","0.0014","90","","90.518","0.008","90","","694.01","0.13","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C5 H5 Cl I N -","- C5 H5 Cl I N -","- C20 H20 Cl4 I4 N4 -","4","1","","Fotović, Luka; Stilinovic, Vladimir","Halogenide anions as halogen and hydrogen bond acceptors in iodopyridinium halogenides","CrystEngComm","2020","","","","","10.1039/D0CE00534G","","","1.54184","CuKα","","0.0564","0.0506","","","0.137","0.1498","","","","","","1.116","","","","has coordinates","252006","2020-10-21","18:00:00",""
"7240527","9.5603","0.0006","6.7219","0.0008","17.1475","0.0012","90","","91.675","0.007","90","","1101.49","0.17","150","0.1","150","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C24 H22 Cl N3 O4 Zn -","- C24 H22 Cl N3 O4 Zn -","- C48 H44 Cl2 N6 O8 Zn2 -","2","0.5","","Podjed, Nina; Modec, Barbara; Alcaide, María M.; López-Serrano, Joaquín","From cyclic amines and acetonitrile to amidine zinc(ii) complexes","RSC Advances","2020","10","31","18200","18221","10.1039/D0RA03192E","","x-ray","0.71073","MoKα","","0.0436","0.035","","","0.0819","0.0867","","","","","","1.033","","","","has coordinates","258103","2020-10-21","18:00:00",""
"7240567","14.625","0.0012","16.5741","0.0014","16.2669","0.0014","90","","107.071","0.003","90","","3769.3","0.6","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C56 H98 N16 Ni2 O13 V4 -","- C56 H98 N16 Ni2 O13 V4 -","- C112 H196 N32 Ni4 O26 V8 -","2","0.5","","Dou, Ming-Yu; Zhong, Dan-Dan; Huang, Xianqiang; Yang, Guo-Yu","Imidazole-induced self-assembly of polyoxovanadate cluster organic framework for efficient Knoevenagel condensation under mild conditions","CrystEngComm","2020","","","","","10.1039/D0CE00660B","","","0.71073","MoKα","","0.1794","0.0755","","","0.1968","0.2369","","","","","","0.853","","","","has coordinates","252294","2020-10-21","18:00:00",""
"7240713","10.952","0.002","10.209","0.002","19.122","0.006","90","","110.35","0.03","90","","2004.6","0.9","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C46 H28 Cd N10 O8 -","- C46 H28 Cd N10 O8 -","- C92 H56 Cd2 N20 O16 -","2","0.5","","wang, junjie; Wu, Fei-Fan; Su, Ning; Li, Pan-Pan; Wang, Si-Yin; Ma, Huiyan; Li, Yun-Wu; Yu, Mei-Hui","Luminescent coordination polymers constructed from mixed-ligand strategy for highly selective luminescence sensing of nitrobenzene, Fe3+ and Cr2O72- ions and photodegradation of rhodamine B","CrystEngComm","2020","","","","","10.1039/D0CE00677G","","","0.71073","MoKα","","0.0404","0.0348","","","0.1197","0.1244","","","","","","0.979","","","","has coordinates","253164","2020-10-21","18:00:00",""
"7241069","18.4741","0.0012","10.7522","0.0012","19.8687","0.0014","90","","110.119","0.008","90","","3705.8","0.6","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C56 H66 Eu N8 O28 S2 -","- C56 H66 Eu N8 O28 S2 -","- C112 H132 Eu2 N16 O56 S4 -","2","0.5","","Coban, Mustafa Burak; Yahsi, Yasemin; Gungor, Elif; Kuru Alpaslan, Fatma; Kara Subasat, Hulya","Eu@PMMA and Sm@PMMA nanofibers prepared by electrospinning: structural, morphology, photoluminescence and magnetic properties","CrystEngComm","2020","","","","","10.1039/D0CE00507J","","x-ray","0.71073","MoKα","","0.1079","0.0606","","","0.1104","0.1283","","","","","","0.95","","","","has coordinates","255332","2020-10-21","18:00:00",""
"7241303","10.372","0.0003","16.8173","0.0004","16.8664","0.0004","90","","98.482","0.001","90","","2909.81","0.13","150","","150","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C65 H48 Co2 N9 O14 -","- C65 H48 Co2 N9 O14 -","- C130 H96 Co4 N18 O28 -","2","0.5","","Gao, Lingling; Bian, Yongjun; Tian, Yuan; chen, yongqiang; Hu, Tuoping","Structural Diversity, Gas Adsorption and Magnetic Property of Three Coordination Polymers based on Rigid Multicarboxylate Ligand","CrystEngComm","2020","","","","","10.1039/D0CE01201G","","","0.71073","MoKα","","0.0823","0.0731","","","0.158","0.1613","","","","","","1.31","","","","has coordinates,has disorder","256753","2020-10-21","18:00:00",""
"7241683","12.3238","0.0012","21.6586","0.0019","9.7902","0.0011","90","","111.208","0.003","90","","2436.2","0.4","300","2","300","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C22 H16 Cu N4 O5 -","- C22 H16 Cu N4 O5 -","- C88 H64 Cu4 N16 O20 -","4","1","","Li, Jingyang; He, Ying; Wang, Li; Li, Guanghua; Zou, Yongcun; Yan, Yan; Li, Dandan; Shi, Xinli; Song, Zhiguang; Shi, Xiaodong","Construction of fluorescence active MOFs with symmetrical and conformationally rigid N-2-aryl-triazole ligands","RSC Advances","2020","10","68","41921","41925","10.1039/D0RA09305J","","","0.71073","MoKα","","0.0749","0.0685","","","0.2026","0.2099","","","","","","1.035","","","","has coordinates","259589","2020-12-06","08:43:24",""
"7241753","13.706","0.003","10.943","0.002","23.695","0.005","90","","106.11","0.03","90","","3414.3","1.3","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C78 H57 Mn3 N6 O22 -","- C78 H48.988 Mn3 N6 O18 -","- C156 H97.976 Mn6 N12 O36 -","2","0.5","","Yang, Dongdong; Liu, Xiaxia; Lu, Liping; Zhu, Miaoli","Effects of two different solvents on the syntheses, structural diversity, and magnetic properties of six Mn(ii) complexes derived from 3,3′-((5-carboxy-1,3-phenylene)bis(oxy))dibenzoate and variable N-donor ligands","CrystEngComm","2020","22","46","8088","8099","10.1039/D0CE01383H","","","0.71","synchrotron","","0.0482","0.0443","","","0.108","0.1108","","","","","","1.032","","","","has coordinates,has disorder","259738","2020-12-10","03:41:12",""
"7242121","17.9505","0.0008","8.6914","0.0004","18.8483","0.0007","90","","90.616","0.004","90","","2940.4","0.2","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H40 Br I2 N -","- C26 H22 Br I2 N -","- C104 H88 Br4 I8 N4 -","4","1","","González, Lucia; Graus, Sara; Gaspar, Blanca; Espasa, Sheila; Velázquez-Campoy, Adrián; Munarriz, Julen; Serrano, José Luis; Tejedor, Rosa M.; Uriel, Santiago","Interplay between non-covalent interactions in 1D supramolecular polymers based on 1,4-bis(iodoethynyl)benzene.","Physical chemistry chemical physics : PCCP","2021","23","5","3531","3542","10.1039/d0cp05917j","","","0.71073","MoKα","","0.0785","0.0553","","","0.1564","0.1699","","","","","","1.066","","","","has coordinates","262727","2021-03-05","02:27:31",""
"7242417","18.6837","0.0005","14.4095","0.0004","18.9429","0.0005","90","","112.067","0.003","90","","4726.3","0.2","169.99","0.1","169.99","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C53 H36 Ir N4 O4 -","- C53 H36 Ir N4 O4 -","- C212 H144 Ir4 N16 O16 -","4","1","","Ma, Zequn; Jing, Chaojun; Hang, Deyu; Fan, Hongtao; Duan, Lumeng; Fang, Shuqing; Yan, Li","Synthesis, characterization, and photoelectric properties of iridium(iii) complexes containing an N hetero-dibenzofuran C^N ligand","RSC Advances","2021","11","18","11004","11010","10.1039/D0RA10584H","","x-ray","1.54184","CuKα","","0.0709","0.055","","","0.1469","0.1682","","","","","","1.002","","","","has coordinates","263109","2021-03-18","05:29:42",""
"7242427","10.1136","0.001","9.7173","0.001","24.005","0.003","90","","92.928","0.004","90","","2356.1","0.4","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C54 H32 Cd2 N6 O9 S2 -","- C54 H32 Cd2 N6 O9 S2 -","- C108 H64 Cd4 N12 O18 S4 -","2","0.5","","Liu, Liangjuan; Ran, Yungen; Du, Jianlong; Wang, Zhichao; Liu, Mei; Mu, Yajuan","A luminescent Cd(ii) coordination polymer as a multi-responsive fluorescent sensor for Zn2+, Fe3+ and Cr2O72− in water with fluorescence enhancement or quenching","RSC Advances","2021","11","19","11266","11272","10.1039/D0RA10203B","","","0.71073","MoKα","","0.0732","0.0414","","","0.0786","0.0871","","","","","","1.049","","","","has coordinates","263111","2021-03-18","05:34:15",""
"7242484","40.4192","0.0006","11.2901","0.0001","17.8001","0.0003","90","","102.217","0.002","90","","7938.9","0.2","150","2","150.01","0.1","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C46 H56 Zr -","- C46 H56 Zr -","- C368 H448 Zr8 -","8","2","","Angpanitcharoen, Phakpoom; Lamb, Jessica V.; Buffet, Jean-Charles; Turner, Zoë R.; O'Hare, Dermot","Synthesis of zirconocene complexes and their use in slurry-phase polymerisation of ethylene","RSC Advances","2021","11","19","11529","11535","10.1039/D1RA01912K","","x-ray","1.54184","CuKα","","0.106","0.105","","","0.2535","0.254","","","","","","1.206","","","","has coordinates","263202","2021-03-20","05:31:12",""
"7242499","34.9669","0.0003","14.8136","0.0001","30.7587","0.0002","90","","101.597","0.001","90","","15607.3","0.2","100.15","","100","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C112.5 H93 Cl5 I12 N24 O8 Zn6 -","- C112.5 H93 Cl5 I12 N24 O8 Zn6 -","- C450 H372 Cl20 I48 N96 O32 Zn24 -","4","1","","Ismiyarto,; Kishi, Nobuki; Adachi, Yuki; Jiang, Rui; Doi, Takahiro; Zhou, Da-Yang; Asano, Kaori; Obora, Yasushi; Suzuki, Takayoshi; Sasai, Hiroaki; Suzuki, Takeyuki","Catalytic enantioselective intramolecular Tishchenko reaction of meso-dialdehyde: synthesis of (S)-cedarmycins","RSC Advances","2021","11","19","11606","11609","10.1039/D1RA00915J","","x-ray","1.54184","CuKα","","0.0976","0.0884","","","0.2857","0.3029","","","","","","1.225","","","","has coordinates,has disorder","263233","2021-03-23","05:38:11",""
"7242794","14.366","0.002","24.779","0.004","11.2288","0.0019","90","","90.011","0.002","90","","3997.2","1.1","143","2","143","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C44 H29 N4 O4 Zn -","- C44 H29 N4 O4 Zn -","- C176 H116 N16 O16 Zn4 -","4","1","","Ni, Jian-Ling; Liang, Yu; Shao, Juan-Juan; Li, Jun-Feng; Zhou, Ze-Yu; Wang, Fang-Ming; Chen, Li-Zhuang","Selective fluorescent sensing of LMOFs constructed from tri(4-pyridylphenyl)amine ligand","RSC Advances","2021","11","28","16989","16995","10.1039/D1RA00726B","","","0.71073","MoKα","","0.1413","0.0949","","","0.2634","0.3028","","","","","","1.037","","","","has coordinates,has disorder","265055","2021-05-08","04:11:27",""
"7243152","21.497","0.005","9.893","0.002","22.324","0.005","90","","116.199","0.002","90","","4259.9","1.6","93.15","","93.15","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C43 H54 F6 Fe N O8 P -","- C43 H54 F6 Fe N O8 P -","- C172 H216 F24 Fe4 N4 O32 P4 -","4","1","","Suzaki, Yuji; Fukuchi, Yugo; Tadami, Hiroko; Koizumi, Take-aki; Osakada, Kohtaro; Ide, Tomohito; Horie, Masaki; Hoshino, Norihisa; Akutagawa, Tomoyuki","Further investigations of the crystal-to-crystal phase transition of a [2]pseudorotaxane composed of ferrocene-terminated dialkylammonium and dibenzo[24]crown-8-ether","CrystEngComm","2021","23","34","5944","5952","10.1039/D1CE00457C","","","0.71073","MoKα","","0.1267","0.0762","","","0.1466","0.1637","","","","","","1.092","","","","has coordinates","268679","2021-09-06","10:30:53",""
"7243168","9.9904","0.0006","6.0482","0.0005","21.616","0.002","90","","101.289","0.008","90","","1280.85","0.18","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H26 N4 O7 Zn -","- C24 H26 N4 O7 Zn -","- C48 H52 N8 O14 Zn2 -","2","0.5","","Alamgir,; Talha, Khalid; Wang, Ying-Jie; Ullah, Raza; Wang, Bin; Wang, Lu; Wu, Wei; Chen, Sha; Xie, Lin-Hua; Li, Jian-Rong","Construction of a mixed ligand MOF as “green catalyst” for the photocatalytic degradation of organic dye in aqueous media","RSC Advances","2021","11","38","23838","23845","10.1039/D1RA02994K","","","1.54178","CuKα","","0.1008","0.0711","","","0.171","0.1948","","","","","","1.055","","","","has coordinates","267367","2021-07-08","04:39:06",""
"7243692","13.6568","0.001","4.4427","0.0003","18.6786","0.0014","90","","101.195","0.001","90","","1111.72","0.14","223","2","223","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C19 H19 N2 O8 Pb2 -","- C19 H19 N2 O8 Pb2 -","- C38 H38 N4 O16 Pb4 -","2","0.5","","Peedikakkal, Abdul Malik P.; Jalilov, Almaz S.; Shaikh, Abdul Rajjak; Kalanthoden, Abdul Nasar; Al-Saadi, Abdulaziz A.","Blue- and white-light-emitting 2D-coordination polymers and their solid-state photodimerization reaction","CrystEngComm","2021","23","43","7663","7670","10.1039/D1CE00991E","","","0.71073","MoKα","","0.0582","0.0534","","","0.1291","0.1327","","","","","","1.128","","","","has coordinates,has disorder","271169","2021-12-07","03:05:41",""
"7243693","18.508","0.002","4.0982","0.0005","18.984","0.002","90","","96.68","0.002","90","","1430.2","0.3","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C28 H24 N4 O8 Pb2 -","- C28 H24 N4 O8 Pb2 -","- C56 H48 N8 O16 Pb4 -","2","0.5","","Peedikakkal, Abdul Malik P.; Jalilov, Almaz S.; Shaikh, Abdul Rajjak; Kalanthoden, Abdul Nasar; Al-Saadi, Abdulaziz A.","Blue- and white-light-emitting 2D-coordination polymers and their solid-state photodimerization reaction","CrystEngComm","2021","23","43","7663","7670","10.1039/D1CE00991E","","","0.71073","MoKα","","0.062","0.0489","","","0.1202","0.1274","","","","","","1.057","","","","has coordinates,has disorder","271169","2021-12-07","03:05:44",""
"7244250","16.9814","0.0009","5.7781","0.0003","20.4176","0.0008","90","","118.519","0.003","90","","1760.29","0.16","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C42 H28 N5 O6 Zn -","- C42 H28 N5 O6 Zn -","- C84 H56 N10 O12 Zn2 -","2","0.5","","Yang, Zhan-Yong; Chen, Cao; Sang, Xiao; Hong, Yu-Xuan; Yu, Hong; Ni, Chun-Yan; Lang, Jian-Ping","Assembly of a Zn(II) coordination polymer of tetrapyridyl tetraene ligands for selective sensing of CrO42- and Fe3+ in water via luminescence quenching and enhancement","CrystEngComm","2022","","","","","10.1039/D1CE01706C","","","0.71073","MoKα","","0.1017","0.0739","","","0.1931","0.2118","","","","","","1.041","","","","has coordinates,has disorder","272112","2022-01-18","23:35:13",""
"7244351","16.9814","0.0009","5.7781","0.0003","20.4176","0.0008","90","","118.519","0.003","90","","1760.29","0.16","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C42 H28 N5 O6 Zn -","- C42 H28 N5 O6 Zn -","- C84 H56 N10 O12 Zn2 -","2","0.5","","Mei, Houshan; Xie, Jiayue; Li, Zishuo; Lou, Chengming; Lei, Guanglu; Liu, Xianghong; Zhang, Jun","Rational design of ZnO@ZIF-8 nanoarrays for improved electrochemical detection of H2O2","CrystEngComm","2022","","","","","10.1039/D1CE01704G","","","0.71073","MoKα","","0.1017","0.0739","","","0.1931","0.2118","","","","","","1.041","","","","has coordinates,has disorder","272810","2022-02-05","23:30:31",""
"7244432","17.0714","0.0002","6.5183","0.0001","19.804","0.0002","90","","101.613","0.001","90","","2158.61","0.05","100.01","0.1","100.01","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C32 H64 N8 Na2 O24 Sb2 -","- C32 H64 N8 Na2 O24 Sb2 -","- C64 H128 N16 Na4 O48 Sb4 -","2","0.5","","Chen, Catherine; Sommer, Charlotte; Thisgaard, Helge; McKee, Vickie; McKenzie, Christine J.","Facile transmetallation of [SbIII(DOTA)]− renders it unsuitable for medical applications","RSC Advances","2022","12","10","5772","5781","10.1039/D2RA00642A","","x-ray","0.71073","MoKα","","0.0222","0.0192","","","0.0496","0.051","","","","","","1.116","","","","has coordinates","273001","2022-02-17","02:19:42",""
"7244433","17.1003","0.0002","6.5597","0.0001","19.8702","0.0003","90","","101.62","0.001","90","","2183.22","0.05","100.01","0.1","100.01","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C32 H64 Bi2 N8 Na2 O24 -","- C32 H64 Bi2 N8 Na2 O24 -","- C64 H128 Bi4 N16 Na4 O48 -","2","0.5","","Chen, Catherine; Sommer, Charlotte; Thisgaard, Helge; McKee, Vickie; McKenzie, Christine J.","Facile transmetallation of [SbIII(DOTA)]− renders it unsuitable for medical applications","RSC Advances","2022","12","10","5772","5781","10.1039/D2RA00642A","","x-ray","0.71073","MoKα","","0.0169","0.0139","","","0.0272","0.028","","","","","","1.065","","","","has coordinates","273001","2022-02-17","02:19:43",""
"7244472","22.444","0.0002","8.0639","0.0001","27.9872","0.0003","90","","92.354","0.001","90","","5061.02","0.09","100","1","100","1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C44 H52 Cu6 O24 -","- C44 H52 Cu6 O24 -","- C176 H208 Cu24 O96 -","4","1","","Abrahams, Brendan F.; Commons, Christopher J.; Dharma, A. David; Hudson, Timothy A.; Robson, Richard; Sanchez Arlt, Robin W.; Stewart, Thomas C.; White, Keith F.","Synthesis, structure and properties of coordination polymers formed from bridging 4-hydroxybenzoic acid anions","CrystEngComm","2022","","","","","10.1039/D2CE00163B","","x-ray","1.54184","CuKα","","0.0419","0.0394","","","0.1135","0.1156","","","","","","1.056","","","","has coordinates,has disorder","273116","2022-02-22","23:37:29",""
"7244536","18.6073","0.0015","8.0235","0.0007","27.301","0.002","90","","90.501","0.002","90","","4075.8","0.6","296","2","296.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C46 H28 N4 O18 Zn3 -","- C46 H28 N4 O18 Zn3 -","- C184 H112 N16 O72 Zn12 -","4","1","","Zhu, Baili; Jin, Yunpeng; Chu, Jingying; Zuo, Minghui; Cui, Shuxin","Metal–organic framework bearing new viologen ligand for ammonia and Cr2O72− sensing","RSC Advances","2022","12","12","6951","6957","10.1039/D2RA00599A","","","0.71073","MoKα","","0.0733","0.0402","","","0.0773","0.088","","","","","","1.009","","","","has coordinates","273202","2022-03-02","02:16:44",""
"7244537","18.566","0.002","8.0029","0.0009","27.231","0.003","90","","90.472","0.002","90","","4045.9","0.8","296.15","","296.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C46 H28 N4 O18 Zn3 -","- C46 H28 N4 O18 Zn3 -","- C184 H112 N16 O72 Zn12 -","4","1","","Zhu, Baili; Jin, Yunpeng; Chu, Jingying; Zuo, Minghui; Cui, Shuxin","Metal–organic framework bearing new viologen ligand for ammonia and Cr2O72− sensing","RSC Advances","2022","12","12","6951","6957","10.1039/D2RA00599A","","","0.71073","MoKα","","0.1187","0.0693","","","0.1396","0.1551","","","","","","1.091","","","","has coordinates","273202","2022-03-02","02:16:45",""
"7244538","18.5771","0.0017","8.0007","0.0007","27.235","0.003","90","","90.504","0.002","90","","4047.8","0.7","296","2","296.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C46 H28 N4 O18 Zn3 -","- C46 H28 N4 O18 Zn3 -","- C184 H112 N16 O72 Zn12 -","4","1","","Zhu, Baili; Jin, Yunpeng; Chu, Jingying; Zuo, Minghui; Cui, Shuxin","Metal–organic framework bearing new viologen ligand for ammonia and Cr2O72− sensing","RSC Advances","2022","12","12","6951","6957","10.1039/D2RA00599A","","","0.71073","MoKα","","0.1392","0.0611","","","0.0829","0.1004","","","","","","1.056","","","","has coordinates","273202","2022-03-02","02:16:47",""
"7244539","18.5787","0.0017","8.0072","0.0008","27.24","0.002","90","","90.531","0.002","90","","4052.1","0.6","296.15","","296.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C46 H28 N4 O18 Zn3 -","- C46 H28 N4 O18 Zn3 -","- C184 H112 N16 O72 Zn12 -","4","1","","Zhu, Baili; Jin, Yunpeng; Chu, Jingying; Zuo, Minghui; Cui, Shuxin","Metal–organic framework bearing new viologen ligand for ammonia and Cr2O72− sensing","RSC Advances","2022","12","12","6951","6957","10.1039/D2RA00599A","","","0.71073","MoKα","","0.1029","0.0486","","","0.0853","0.1016","","","","","","1.006","","","","has coordinates","273202","2022-03-02","02:16:48",""
"7244540","18.577","0.002","8.0124","0.001","27.266","0.004","90","","90.554","0.002","90","","4058.3","0.9","273","2","273","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C46 H28 N4 O18 Zn3 -","- C46 H28 N4 O18 Zn3 -","- C184 H112 N16 O72 Zn12 -","4","1","","Zhu, Baili; Jin, Yunpeng; Chu, Jingying; Zuo, Minghui; Cui, Shuxin","Metal–organic framework bearing new viologen ligand for ammonia and Cr2O72− sensing","RSC Advances","2022","12","12","6951","6957","10.1039/D2RA00599A","","","0.71073","MoKα","","0.0565","0.0347","","","0.0702","0.0755","","","","","","0.992","","","","has coordinates","273202","2022-03-02","02:16:50",""
"7244541","18.5619","0.0016","8.0153","0.0007","27.22","0.002","90","","90.582","0.001","90","","4049.6","0.6","296.15","","296.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C46 H28 N4 O18 Zn3 -","- C46 H28 N4 O18 Zn3 -","- C184 H112 N16 O72 Zn12 -","4","1","","Zhu, Baili; Jin, Yunpeng; Chu, Jingying; Zuo, Minghui; Cui, Shuxin","Metal–organic framework bearing new viologen ligand for ammonia and Cr2O72− sensing","RSC Advances","2022","12","12","6951","6957","10.1039/D2RA00599A","","","0.71073","MoKα","","0.0535","0.0355","","","0.0776","0.0838","","","","","","1.013","","","","has coordinates","273202","2022-03-02","02:16:50",""
"7244907","6.7682","0.0007","3.9248","0.0004","13.5199","0.0015","90","","92.765","0.01","90","","358.72","0.07","270","2","270","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","[HImidazole][(NbOF4]","","- C3 H5 F4 N2 Nb O -","- C3 H5 F4 N2 Nb O -","- C6 H10 F8 N4 Nb2 O2 -","2","0.5","","Feng, Yan; Wang, Ze-Jie; Li, Long-He; Liao, Rong-Meng; Hu, Zhao-Bo; Li, Jian-Rong; Shi, Chao; Ye, Heng-Yun","Structural Phase Transition and Switchable Dielectric Behaviour of a One-Dimensional Chains Niobium Oxyfluoride","CrystEngComm","2022","","","","","10.1039/D2CE00428C","","","0.71073","MoKα","","0.092","0.0895","","","0.2225","0.2241","","","","","","1.242","","","","has coordinates,has disorder","275307","2022-05-10","22:30:48",""
"7245116","12.892","0.017","9.895","0.013","17.43","0.02","90","0.04","105.86","0.03","90","0.04","2139","5","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C16 H18 Cl2 Cu2 N4 O2 -","- C16 H18 Cl2 Cu2 N4 O2 -","- C64 H72 Cl8 Cu8 N16 O8 -","4","1","","Zhu, Jinjiao; Sun, Yajun; Ding, Weilinsen; Li, Peiyuan; Pang, Qingyang; Dou, Xinwen; Bian, Li; Ju, Qiang; Fang, Zhenlan","Coordination networks constructed from a flexible ligand: single-crystal-to-single-crystal transformations, thermoresponsive and electrochemical performances","CrystEngComm","2022","","","","","10.1039/D2CE00661H","","","0.71073","MoKα","","0.0863","0.0429","","","0.1119","0.1393","","","","","","1","","","","has coordinates","276413","2022-06-29","22:42:31",""
"7245117","12.3785","0.0014","9.4933","0.001","16.918","0.002","90","","106.036","0.003","90","","1910.7","0.4","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C16 H18 Cl2 Cu2 N4 O2 -","- C16 H18 Cl2 Cu2 N4 O2 -","- C64 H72 Cl8 Cu8 N16 O8 -","4","1","","Zhu, Jinjiao; Sun, Yajun; Ding, Weilinsen; Li, Peiyuan; Pang, Qingyang; Dou, Xinwen; Bian, Li; Ju, Qiang; Fang, Zhenlan","Coordination networks constructed from a flexible ligand: single-crystal-to-single-crystal transformations, thermoresponsive and electrochemical performances","CrystEngComm","2022","","","","","10.1039/D2CE00661H","","","0.71073","MoKα","","0.0507","0.0343","","","0.0914","0.108","","","","","","1.022","","","","has coordinates","276413","2022-06-29","22:42:32",""
"7245118","12.3916","0.0009","9.4953","0.0007","16.9063","0.0012","90","","106.072","0.002","90","","1911.5","0.2","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C16 H18 Cl2 Cu2 N4 O2 -","- C16 H18 Cl2 Cu2 N4 O2 -","- C64 H72 Cl8 Cu8 N16 O8 -","4","1","","Zhu, Jinjiao; Sun, Yajun; Ding, Weilinsen; Li, Peiyuan; Pang, Qingyang; Dou, Xinwen; Bian, Li; Ju, Qiang; Fang, Zhenlan","Coordination networks constructed from a flexible ligand: single-crystal-to-single-crystal transformations, thermoresponsive and electrochemical performances","CrystEngComm","2022","","","","","10.1039/D2CE00661H","","","0.71073","MoKα","","0.0451","0.0329","","","0.0868","0.1017","","","","","","1.063","","","","has coordinates","276413","2022-06-29","22:42:32",""
"7245119","13.097","0.002","9.6809","0.0015","16.8","0.003","90","","107.535","0.005","90","","2031.1","0.6","297","2","297","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C16 H18 Br2 Cu2 N4 O2 -","- C16 H18 Br2 Cu2 N4 O2 -","- C64 H72 Br8 Cu8 N16 O8 -","4","1","","Zhu, Jinjiao; Sun, Yajun; Ding, Weilinsen; Li, Peiyuan; Pang, Qingyang; Dou, Xinwen; Bian, Li; Ju, Qiang; Fang, Zhenlan","Coordination networks constructed from a flexible ligand: single-crystal-to-single-crystal transformations, thermoresponsive and electrochemical performances","CrystEngComm","2022","","","","","10.1039/D2CE00661H","","","0.71073","MoKα","","0.0745","0.039","","","0.0817","0.0959","","","","","","1.015","","","","has coordinates","276413","2022-06-29","22:42:32",""
"7245120","12.5432","0.0015","9.5412","0.0011","16.985","0.002","90","","106.366","0.004","90","","1950.4","0.4","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C16 H18 Cl2 Cu2 N4 O2 -","- C16 H18 Cl2 Cu2 N4 O2 -","- C64 H72 Cl8 Cu8 N16 O8 -","4","1","","Zhu, Jinjiao; Sun, Yajun; Ding, Weilinsen; Li, Peiyuan; Pang, Qingyang; Dou, Xinwen; Bian, Li; Ju, Qiang; Fang, Zhenlan","Coordination networks constructed from a flexible ligand: single-crystal-to-single-crystal transformations, thermoresponsive and electrochemical performances","CrystEngComm","2022","","","","","10.1039/D2CE00661H","","","0.71073","MoKα","","0.0924","0.0451","","","0.1201","0.1538","","","","","","1.049","","","","has coordinates","276413","2022-06-29","22:42:32",""
"7245121","13.0123","0.0013","9.6529","0.0009","16.7087","0.0018","90","","107.453","0.003","90","","2002.1","0.3","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C16 H18 Br2 Cu2 N4 O2 -","- C16 H18 Br2 Cu2 N4 O2 -","- C64 H72 Br8 Cu8 N16 O8 -","4","1","","Zhu, Jinjiao; Sun, Yajun; Ding, Weilinsen; Li, Peiyuan; Pang, Qingyang; Dou, Xinwen; Bian, Li; Ju, Qiang; Fang, Zhenlan","Coordination networks constructed from a flexible ligand: single-crystal-to-single-crystal transformations, thermoresponsive and electrochemical performances","CrystEngComm","2022","","","","","10.1039/D2CE00661H","","","0.71073","MoKα","","0.088","0.0496","","","0.1059","0.1224","","","","","","1.005","","","","has coordinates","276413","2022-06-29","22:42:32",""
"7245835","11.7677","0.0005","9.7423","0.0007","11.5702","0.0006","90","","107.931","0.005","90","","1262.03","0.13","80","2","80","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H24 Al Br3 N4 -","- C24 H24 Al Br3 N4 -","- C48 H48 Al2 Br6 N8 -","2","0.5","","Gugin, Nikita Y.; Virovets, Alexander V.; Peresypkina, Eugenia; Davydova, Elena I.; Timoshkin, Alexey Y.","Coordination polymers and molecular complexes of group 13 metal halides with bis-pyridylethane: comparison with rigid N-containing ligands","CrystEngComm","2022","","","","","10.1039/D2CE01063A","","x-ray","0.6888","synchrotron","","0.0977","0.0903","","","0.2379","0.2432","","","","","","1.088","","","","has coordinates,has disorder","279300","2022-11-15","23:33:31",""
"7245991","24.4085","0.0008","7.3774","0.0002","16.2629","0.0005","90","","91.409","0.001","90","","2927.6","0.15","170","","170","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C34 H26 N4 O6 Zn -","- C34 H26 N4 O6 Zn -","- C136 H104 N16 O24 Zn4 -","4","1","","Fan, Chuanbin; Huang, Guimei; Xing, Zhiyong; Wang, Junli; Pang, Yaqin; Huang, Qingping; Huang, Shifu; Zong, Ziao; Guo, Feng","Three multi-responsive luminescent Zn-CPs for the detection of antibiotics/cations/anions in aqueous media","CrystEngComm","2023","25","4","593","600","10.1039/D2CE01507B","","","0.71073","MoKα","","0.0681","0.0484","","","0.0977","0.1062","","","","","","1.138","","","","has coordinates","281429","2023-03-04","18:14:03",""
"7246059","12.0496","0.0005","10.0022","0.0003","17.5237","0.0006","90","","100.888","0.002","90","","2073.98","0.13","300","","300","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C36 H28 Cl2 N10 Ni -","- C36 H28 Cl2 N10 Ni -","- C72 H56 Cl4 N20 Ni2 -","2","0.5","","Cai, He-Qun; Xin, Yu; Jiang, Shan; Bai, Feng-Ying; Xing, Yong-Heng","Ni(ii) and Co(ii) complexes for the selective adsorption of anionic dyes from aqueous solutions","CrystEngComm","2023","25","5","848","858","10.1039/D2CE01636B","","","0.71073","MoKα","","0.065","0.0574","","","0.1625","0.1685","","","","","","1.059","","","","has coordinates","281424","2023-03-04","18:12:48",""
"7246062","24.2098","0.0006","10.0344","0.0002","17.4741","0.0004","90","","101.13","0.001","90","","4165.16","0.16","293","","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C36 H41 Cl Co N10 O8 -","- C36 H41 Cl Co N10 O8 -","- C144 H164 Cl4 Co4 N40 O32 -","4","1","","Cai, He-Qun; Xin, Yu; Jiang, Shan; Bai, Feng-Ying; Xing, Yong-Heng","Ni(ii) and Co(ii) complexes for the selective adsorption of anionic dyes from aqueous solutions","CrystEngComm","2023","25","5","848","858","10.1039/D2CE01636B","","","0.71073","MoKα","","0.084","0.0674","","","0.2103","0.2266","","","","","","1.098","","","","has coordinates","281424","2023-03-04","18:12:49",""
"7246358","21.516","0.003","6.3257","0.0008","20.465","0.003","90","","117.404","0.002","90","","2472.8","0.6","296.15","","296.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C23 H26 Cd N4 O6.5 -","- C23 H26 Cd N4 O6.5 -","- C92 H104 Cd4 N16 O26 -","4","1","","Li, Chaoxiong; Sun, Xuancheng; Meng, Xianggao; Wang, Dunjia; Zheng, Chunyang","Construction of ZnII/CdII-CPs and their fluorescent detection for Fe3+, Cr2O72− and TNP in water via luminescence quenching","CrystEngComm","2023","25","18","2728","2738","10.1039/D3CE00135K","","","0.71073","MoKα","","0.0385","0.0272","","","0.0677","0.0748","","","","","","1.036","","","","has coordinates,has disorder","284268","2023-06-05","04:26:16",""
"7246613","15.4865","0.0006","7.7516","0.0003","21.7882","0.0009","90","","107.48","0.001","90","","2494.79","0.17","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C56 H44 N4 O15 Zn3 -","- C56 H44 N4 O15 Zn3 -","- C112 H88 N8 O30 Zn6 -","2","0.5","","Zhang, Kena; Wang, Qiushuang; Gong, Yuanyuan; Wang, Nairong; Li, Xia","Four Zn(ii)-5-(2-carboxy-phenoxy)-1,3-benzenedicarboxylate coordination polymers induced by different N-ligands: synthesis, structure, and fluorescence detection for BPA and IMH","CrystEngComm","2023","25","20","3033","3043","10.1039/D3CE00179B","","","0.71073","MoKα","","0.048","0.0429","","","0.1154","0.12","","","","","","1.085","","","","has coordinates,has disorder","284259","2023-06-05","04:23:37",""
"7246872","11.922","0.004","6.546","0.003","14.62","0.005","90","","108.226","0.016","90","","1083.7","0.7","100","","100","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C9 H11 Cl N4 Se -","- C9 H11 Cl N4 Se -","- C36 H44 Cl4 N16 Se4 -","4","1","","Artemjev, Alexey A.; Kubasov, Alexey S.; Kuznetsov, Maxim L.; Grudova, Mariya V.; Khrustalev, Victor N.; Kritchenkov, Andreii S.; Tskhovrebov, Alexander G.","Mechanistic investigation of 1,3-dipolar cycloaddition between bifunctional 2-pyridylselenyl reagents and nitriles including reactions with cyanamides","CrystEngComm","2023","25","25","3691","3701","10.1039/D3CE00385J","","","0.71073","MoKα","","0.0481","0.0338","","","0.0786","0.0888","","","","","","1.027","","","","has coordinates","284917","2023-07-05","10:08:02",""
"7247814","10.3061","0.0001","8.9312","0.0001","16.601","0.0003","90","","95.428","0.001","90","","1521.2","0.04","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C31 H26 Cd2 N4 O11 -","- C31 H26 Cd2 N4 O11 -","- C62 H52 Cd4 N8 O22 -","2","0.5","","Li, Wen-Ze; Sheng, Yu-Shu; Zhang, Xiao-Sa; Liu, Yu; Li, Jing; Luan, Jian","Fabrication of 5-R-isophthalic acid-modulated cadmium–organic coordination polymers and selectivity for the efficient detection of multiple analytes","CrystEngComm","2023","25","43","6067","6079","10.1039/D3CE00899A","","","1.54178","CuKα","","0.0248","0.0234","","","0.0606","0.0613","","","","","","1.0483","","","","has coordinates,has disorder","288015","2023-12-04","18:10:45",""
"7247848","9.1035","0.0008","5.0596","0.0004","23.3576","0.0019","90","","93.543","0.003","90","","1073.8","0.15","293.15","","293.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H22 Cl6 Cu N4 -","- C14 H22 Cl6 Cu N4 -","- C28 H44 Cl12 Cu2 N8 -","2","0.5","","Li, Haitao; Guo, Zhenwei; Liu, Tie; Xin, Lianxin; Guo, Fang","Solid-state reaction among [CoCl4]2−, [CuCl4]2− and [CuCl4(H2O)]2− ions through transmetalation and liquid-assisted grinding","CrystEngComm","2024","26","3","381","387","10.1039/D3CE01038D","","","0.71073","MoKα","","0.0478","0.0394","","","0.0985","0.1034","","","","","","1.119","","","","has coordinates,has disorder","289453","2024-02-04","11:40:35",""
"7247971","14.3344","0.0008","9.9511","0.0004","34.0401","0.0015","90","","96.508","0.005","90","","4824.3","0.4","120","2","120","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C47 H35 Cu2 N12 O14.48 -","- C47 H35 Cu2 N12 O14.464 -","- C188 H140 Cu8 N48 O57.856 -","4","1","","Oliveira, Willian X. C.; Pinheiro, Carlos B.; Journaux, Yves; Julve, Miguel; Pereira, Cynthia L. M.","Effects on the magnetic interaction caused by molecular recognition in complexes of 1,2-azole-based oxamate and [Cu(bpca)]+ units","CrystEngComm","2024","26","5","647","665","10.1039/D3CE01180A","","","0.71073","MoKα","","0.0845","0.0692","","","0.1647","0.175","","","","","","1.088","","","","has coordinates,has disorder","289436","2024-02-04","11:36:30",""
"7248054","19.1708","0.0008","6.2123","0.0003","9.5258","0.0005","90","","102.172","0.004","90","","1108.97","0.09","213","0.1","213","0.1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C23 H16 Mn O14 -","- C23 H16 Mn O14 -","- C46 H32 Mn2 O28 -","2","0.5","","Wu, Hang; Ghosh, Mithun Kumar; Wang, Guang-Li; Wang, Jun; Muddassir, Mohd.; Ghorai, Tanmay Kumar; Kushwaha, Aparna; Srivastava, Devyani; Kumar, Abhinav","New 3,5-bis(3,4-dicarboxyphenoxy)benzoic acid-appended Mn(ii) coordination polymers: synthesis, characterization and antibiotic photodegradation properties","CrystEngComm","2024","26","10","1453","1463","10.1039/D3CE01285A","","x-ray","0.71073","MoKα","","0.0505","0.0389","","","0.0987","0.1052","","","","","","1.067","","","","has coordinates,has disorder","290880","2024-04-04","23:04:07",""
"7248176","14.3117","0.0004","3.9776","0.0001","26.9681","0.0005","90","","104.512","0.002","90","","1486.21","0.06","299.63","0.1","299.63","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","(E)-1,2-bis(2-pyridyl)ethene and pentachloroiodobenzene cocrystal","","- C24 H10 Cl10 I2 N2 -","- C24 H10 Cl10 I2 N2 -","- C48 H20 Cl20 I4 N4 -","2","0.5","","Andren, Max; Bosch, Eric; Krueger, Herman R.; Groeneman, Ryan H.","Achieving a series of solid-state [2 + 2] cycloaddition reactions involving 1,2-bis(2-pyridyl)ethylene within halogen-bonded co-crystals","CrystEngComm","2024","26","10","1349","1352","10.1039/D4CE00097H","","","1.54184","CuKα","","0.062","0.0539","","","0.1513","0.1583","","","","","","1.0324","","","","has coordinates","290876","2024-04-04","23:03:23",""
"7248278","17.8598","0.0011","7.4112","0.0005","17.6492","0.0011","90","","100.334","0.002","90","","2298.2","0.3","150","2","150","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C12 H16 Cl6 I2 N2 Te -","- C12 H16 Cl6 I2 N2 Te -","- C48 H64 Cl24 I8 N8 Te4 -","4","1","","Korobeynikov, Nikita A.; Usoltsev, Andrey N.; Sokolov, Maxim N.; Novikov, Alexander S.; Adonin, Sergey A.","Polymeric polyiodo-chlorotellurates(iv): new supramolecular hybrids in halometalate chemistry","CrystEngComm","2024","26","14","2018","2024","10.1039/D4CE00088A","","x-ray","0.71073","MoKα","","0.0526","0.0313","","","0.0498","0.055","","","","","","1.04","","","","has coordinates","290892","2024-04-04","23:08:05",""
"7248598","16.9466","0.0012","6.0287","0.0004","13.6214","0.0011","90","","97.621","0.004","90","","1379.35","0.17","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C7 H12 I3 N2 O0.5 -","- C7 H12 I3 N2 O0.5 -","- C28 H48 I12 N8 O2 -","4","1","","Hamdouni, Monia; Hrizi, Chakib; Esghaier, Mohsen Ouled Mohamed; Knorr, Michael; Strohmann, Carsten; Chaabouni, Slaheddine","Molecular self-assembly of 1D linear and 2D T-shape polyiodide arrangements in two organic ammonium triiodide salts: supramolecular structures and density functional theory-based optical properties","CrystEngComm","2024","","","","","10.1039/D4CE00079J","","","0.71073","MoKα","","0.0732","0.0405","","","0.0861","0.1157","","","","","","1.197","","","","has coordinates","291794","2024-05-09","22:33:25",""
"7700066","20.5586","0.001","10.4671","0.0004","20.7828","0.0013","90","","119.05","0.008","90","","3909.6","0.5","120.04","0.1","120.04","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C38 H26 Fe N12 S6 -","- C38 H24 Fe N12 S6 -","- C152 H96 Fe4 N48 S24 -","4","1","","Sun, Xiao-Peng; Liu, Tao; Yao, Zi-Shuo; Tao, Jun","Spin crossover and photomagnetic behaviors in one-dimensional looped coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2019","48","25","9243","9249","10.1039/c9dt01520e","","x-ray","0.71073","MoKα","","0.1221","0.1149","","","0.2749","0.2781","","","","","","1.201","","","","has coordinates","224210","2020-10-21","18:00:00",""
"7700247","21.4502","0.0017","10.4993","0.0007","18.7583","0.0014","90","","114.568","0.002","90","","3842.1","0.5","300","2","300","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C36 H28 F6 N4 O8 S2 Zn -","- C36 H28 F6 N4 O8 S2 Zn -","- C144 H112 F24 N16 O32 S8 Zn4 -","4","1","","Qiao, Di; Wang, Jin-Yun; Zhang, Li-Yi; Dai, Feng-Rong; Chen, Zhong-Ning","Aggregation-induced emission enhancement and reversible mechanochromic luminescence of quinoline-based zinc(ii)-Schiff base complexes.","Dalton transactions (Cambridge, England : 2003)","2019","48","29","11045","11051","10.1039/c9dt02177a","","","0.71073","MoKα","","0.0766","0.0479","","","0.1262","0.1623","","","","","","1.039","","","","has coordinates","223752","2020-10-21","18:00:00",""
"7700395","13.6911","0.0004","18.1247","0.0005","19.8116","0.0005","90","","90.093","0.002","90","","4916.2","0.2","120","","120","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C77 H92 Dy Ga8 N9 O36 -","- C77 H92 Dy Ga8 N9 O36 -","- C154 H184 Dy2 Ga16 N18 O72 -","2","0.5","","Athanasopoulou, Angeliki A.; Baldoví, José J; Carrella, Luca M.; Rentschler, Eva","Field-induced slow magnetic relaxation in the first Dy(iii)-centered 12-metallacrown-4 double-decker.","Dalton transactions (Cambridge, England : 2003)","2019","48","41","15381","15385","10.1039/c9dt02432h","","","0.71073","MoKα","","0.1082","0.0973","","","0.2554","0.2648","","","","","","1.165","","","","has coordinates,has disorder","223886","2020-10-21","18:00:00",""
"7700612","18.3414","0.0005","12.3024","0.0003","24.5778","0.0008","90","","90.347","0.003","90","","5545.7","0.3","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","[Cu(SB-1)](4-tBupy)2","","- C31 H35 Cu N3 O2 -","- C31 H35 Cu N3 O2 -","- C248 H280 Cu8 N24 O16 -","8","2","","Beddoe, Samuel V. F.; Lonergan, Rhona F.; Pitak, Mateusz B.; Price, Jason R.; Coles, Simon J.; Kitchen, Jonathan A.; Keene, Tony D.","All about that base: investigating the role of ligand basicity in pyridyl complexes derived from a copper-Schiff base coordination polymer.","Dalton transactions (Cambridge, England : 2003)","2019","48","41","15553","15559","10.1039/c9dt01527b","","x-ray","0.71073","MoKα","","0.0928","0.0542","","","0.1572","0.1849","","","","","","1.058","","","","has coordinates,has disorder","223909","2020-10-21","18:00:00",""
"7700921","19.601","0.004","9.3797","0.0019","18.63","0.004","90","","95.69","0.03","90","","3408.3","1.2","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C36 H68 Co N6 O17 -","- C24 H6 Co N3 O11 -","- C96 H24 Co4 N12 O44 -","4","1","","Ma, Hui-Yan; Zhang, Yong-Zheng; Yan, Hui; Zhang, Wen-Jie; Li, Yun-Wu; Wang, Su-Na; Li, Da-Cheng; Dou, Jian-Min; Li, Jian-Rong","Two microporous Co<sup>II</sup>-MOFs with dual active sites for highly selective adsorption of CO<sub>2</sub>/CH<sub>4</sub> and CO<sub>2</sub>/N<sub>2</sub>.","Dalton transactions (Cambridge, England : 2003)","2019","48","36","13541","13545","10.1039/c9dt02694k","","","0.71073","MoKα","","0.2352","0.1492","","","0.3669","0.4167","","","","","","1.13","","","","has coordinates","224478","2020-10-21","18:00:00",""
"7701279","8.8873","0.0016","12.724","0.002","19.021","0.003","90","","98.769","0.005","90","","2125.8","0.6","300","2","300","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C12 H12 Bi I5 N2 O -","- C12 H12 Bi I5 N2 O -","- C48 H48 Bi4 I20 N8 O4 -","4","1","","Oswald, Iain W. H.; Ahn, Hyochul; Neilson, James Richmond","Influence of organic cation planarity on structural templating in hybrid metal-halides","Dalton Transactions","2019","","","","","10.1039/C9DT03207J","","","0.71073","MoKα","","0.0554","0.0405","","","0.0962","0.1054","","","","","","1.037","","","","has coordinates","218988","2020-10-21","18:00:00",""
"7701463","10.6293","0.0005","13.9322","0.0007","13.7379","0.0007","90","","112.566","0.002","90","","1878.68","0.16","150","2","150.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C32 H36 Dy N9 O17 -","- C32 H36 Dy N9 O17 -","- C64 H72 Dy2 N18 O34 -","2","0.5","","Cheng, Li-Wei; Zhang, Chi-Lung; Wei, Jun-Yu; Lin, Po-Heng","Mononuclear and Trinuclear DyIII SMMs with Schiff-base Ligands Modified by Nitro- Group: First Triangular Complex with N-N Pathway","Dalton Transactions","2019","","","","","10.1039/C9DT02646K","","","0.71076","MoKα","","0.0401","0.0285","","","0.0699","0.0752","","","","","","1.034","","","","has coordinates,has disorder","220618","2020-10-21","18:00:00",""
"7701611","9.7273","0.0011","12.8613","0.0014","14.2241","0.0017","90","","109.652","0.013","90","","1675.9","0.4","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C28 H11 Cl0 Mn3 N O20 -","- C28 H11 Mn3 N O20 -","- C56 H22 Mn6 N2 O40 -","2","0.5","","Zhao, Ming-Yu; Zhu, Jian-Nan; Li, Peng; Li, Wei; Cai, Ting; Cheng, Fang-Fang; Xiong, Wei-Wei","Structural variation of transition metal-organic frameworks using deep eutectic solvents with different hydrogen bond donors.","Dalton transactions (Cambridge, England : 2003)","2019","48","27","10199","10209","10.1039/c9dt01050e","","","0.71073","MoKα","","0.1237","0.083","","","0.1881","0.2109","","","","","","1.083","","","","has coordinates,has disorder","223319","2020-10-21","18:00:00",""
"7701889","14.288","0.01","7.823","0.01","15.337","0.01","90","","101.241","0.01","90","","1681","3","200","2","200","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C14 H17 B N6 O2 W -","- C14 H17 B N6 O2 W -","- C56 H68 B4 N24 O8 W4 -","4","1","","Abernethy, Robyn J.; Foreman, Mark R St-J; Hill, Anthony F.; Smith, Matthew K.; Willis, Anthony C.","Relative hemilabilities of H<sub>2</sub>B(az)<sub>2</sub> (az = pyrazolyl, dimethylpyrazolyl, methimazolyl) chelates in the complexes [M(η-C<sub>3</sub>H<sub>5</sub>)(CO)<sub>2</sub>{H<sub>2</sub>B(az)<sub>2</sub>}] (M = Mo, W).","Dalton transactions (Cambridge, England : 2003)","2020","49","3","781","796","10.1039/c9dt03744f","","","0.71073","MoKα","","0.0331","0.028","","","0.0686","0.0719","","","","","","1.044","","","","has coordinates","247752","2020-10-21","18:00:00",""
"7702271","22.3591","0.0007","13.4447","0.0003","25.4062","0.0008","90","","102.651","0.003","90","","7452","0.4","130","2","130","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C14.25 H35.25 B20 Cl3.75 N4 O2 S2 -","- C14.25 H35.25 B20 Cl3.75 N4 O2 S2 -","- C114 H282 B160 Cl30 N32 O16 S16 -","8","2","","Kellert, Martin; Hoppenz, Paul; Lönnecke, Peter; Worm, Dennis J.; Riedl, Bernd; Koebberling, Johannes; Beck-Sickinger, Annette G; Hey-Hawkins, Evamarie","Tuning a modular system - synthesis and characterisation of a boron-rich s-triazine-based carboxylic acid and amine bearing a galactopyranosyl moiety.","Dalton transactions (Cambridge, England : 2003)","2020","49","1","57","69","10.1039/c9dt04031e","","","0.71073","MoKα","","0.1813","0.0814","","","0.1792","0.2268","","","","","","1.015","","","","has coordinates,has disorder","247705","2020-10-21","18:00:00",""
"7702308","17.299","0.005","12.324","0.005","17.412","0.006","90","","111.57","0.02","90","","3452","2","293","2","293","2","","","","","","","synthesis","6","P 1 2/c 1","-P 2yc","13","","","","- C26 H35 Mo N5 O6 P4 -","- C26 H30 Mo N5 O6 P4 -","- C104 H120 Mo4 N20 O24 P16 -","4","1","","Thirupathi, Natesan; Krishnamurthy, Setharampattu S.; Nethaji, Munirathinam","Synthesis, reactivity and structural characterisation of bicyclic tetraphosphapentazanes","Journal of the Chemical Society, Dalton Transactions","1998","","9","1469","","10.1039/a801443d","","","0.7107","MoKa","","0.1001","0.0644","","0.1963","0.1588","","","","1.049","1.035","1.035","","","","","has coordinates","243823","2020-10-21","18:00:00",""
"7702312","16.4177","0.0015","9.1699","0.0005","31.597","0.002","90","","91.096","0.011","90","","4756","0.6","220","0.2","220","0.2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C38 H33 Cl6 N10 Na2 Ni2 O7.5 -","- C38 H33 Cl6 N10 Na2 Ni2 O7.5 -","- C152 H132 Cl24 N40 Na8 Ni8 O30 -","4","1","","Brechin, Euan K.; Gilby, Liam M.; Gould, Robert O.; Harris, Steven G.; Parsons, Simon; Winpenny, Richard E. P.","Heterobimetallic nickel–sodium and cobalt–sodium complexes of pyridonate ligands","Journal of the Chemical Society, Dalton Transactions","1998","","16","2657","","10.1039/a803442g","","","1.54184","CuKα","","0.0892","0.0532","","0.1268","0.1019","","","","1.052","1.073","1.073","","","","","has coordinates","291143","2024-04-09","08:50:51",""
"7702446","8.175","0.003","7.147","0.002","14.917","0.004","90","","91.28","0.03","90","","871.3","0.5","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","{[Ag(pybut)]BF4.MeCN}n","'{Ag[1,4-bis(4-pyridyl)butadiyne]tetrafluoroborate}.acetonitrile solvate'","","- C16 H11 Ag B F4 N3 -","- C16 H8 Ag B F4 N3 -","- C32 H16 Ag2 B2 F8 N6 -","2","0.5","","Blake, Alexander J.; Baum, Gerhard; Champness, Neil R.; Chung, Simon S. M.; Cooke, Paul A.; Fenske, Dieter; Khlobystov, Andrei N.; Lemenovskii, Dmitrii A.; Li, Wan-Sheung; Schröder, Martin","Long-range chain orientation in 1-D co-ordination polymers as a function of anions and intermolecular aromatic interactions","Journal of the Chemical Society, Dalton Transactions","2000","","23","4285","","10.1039/b006202m","","","0.71073","MoKα","","0.0575","0.0456","","","0.1115","0.1241","","","","","","1.051","","","","has coordinates,has disorder","243870","2020-10-21","18:00:00",""
"7702448","7.134","0.002","7.322","0.002","31.725","0.004","90","","97.53","0.02","90","","1642.9","0.7","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","AgNO3*Pubut","1,4-bis(4'-Bipyridyl)buta-1,3-diyne silver nitrate complex acetonitrile sollvate","","- C16 H11 Ag N4 O3 -","- C16 H11 Ag N4 O3 -","- C64 H44 Ag4 N16 O12 -","4","1","","Blake, Alexander J.; Baum, Gerhard; Champness, Neil R.; Chung, Simon S. M.; Cooke, Paul A.; Fenske, Dieter; Khlobystov, Andrei N.; Lemenovskii, Dmitrii A.; Li, Wan-Sheung; Schröder, Martin","Long-range chain orientation in 1-D co-ordination polymers as a function of anions and intermolecular aromatic interactions","Journal of the Chemical Society, Dalton Transactions","2000","","23","4285","","10.1039/b006202m","","","0.71073","MoKα","","0.1085","0.0882","","","0.2331","0.2645","","","","","","1.047","","","","has coordinates,has disorder","243870","2020-10-21","18:00:00",""
"7703031","11.5515","0.0004","10.5679","0.0003","21.3676","0.0006","90","","104.168","0.003","90","","2529.11","0.14","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H24 N2 O7 Te2 -","- C24 H24 N2 O7 Te2 -","- C96 H96 N8 O28 Te8 -","4","1","","Deka, Rajesh; Sarkar, Arup; Butcher, Ray J.; Junk, Peter C.; Turner, David R.; Deacon, Glen B.; Singh, Harkesh B.","Isolation of the novel example of a monomeric organotellurinic acid.","Dalton transactions (Cambridge, England : 2003)","2020","49","4","1173","1180","10.1039/c9dt04013g","","","0.71073","MoKα","","0.0699","0.049","","","0.1139","0.1265","","","","","","1.023","","","","has coordinates","247722","2020-10-21","18:00:00",""
"7703281","24.2222","0.0007","10.1613","0.0002","15.4093","0.0004","90","","95.455","0.001","90","","3775.5","0.16","150","2","150","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C30 H54 Ca0.5 Gd N5 O15 P -","- C30 H48 Ca0.5 Gd N5 O15 P -","- C120 H192 Ca2 Gd4 N20 O60 P4 -","4","1","","Urbanovský, Peter; Kotek, Jan; Císařová, Ivana; Hermann, Petr","The solid-state structures and ligand cavity evaluation of lanthanide(iii) complexes of a DOTA analogue with a (dibenzylamino)methylphosphinate pendant arm.","Dalton transactions (Cambridge, England : 2003)","2020","49","5","1555","1569","10.1039/c9dt04056k","","","0.71073","MoKα","","0.0714","0.0616","","","0.1484","0.1548","","","","","","1.058","","","","has coordinates,has disorder","248941","2020-10-21","18:00:00",""
"7703283","24.1798","0.0013","10.1265","0.0005","15.2799","0.0008","90","","95.775","0.002","90","","3722.4","0.3","120","2","120","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C30 H52 Ca0.5 Ho N5 O14 P -","- C30 H47 Ca0.5 Ho N5 O14 P -","- C120 H188 Ca2 Ho4 N20 O56 P4 -","4","1","","Urbanovský, Peter; Kotek, Jan; Císařová, Ivana; Hermann, Petr","The solid-state structures and ligand cavity evaluation of lanthanide(iii) complexes of a DOTA analogue with a (dibenzylamino)methylphosphinate pendant arm.","Dalton transactions (Cambridge, England : 2003)","2020","49","5","1555","1569","10.1039/c9dt04056k","","","0.71073","MoKα","","0.1103","0.1022","","","0.24","0.2429","","","","","","1.338","","","","has coordinates,has disorder","248941","2020-10-21","18:00:00",""
"7703556","18.3465","0.001","9.5046","0.0003","18.6302","0.0012","90","","115.491","0.002","90","","2932.4","0.3","173","2","173","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C26 H36 Cl F6 N2 P Ru S -","- C26 H36 Cl F6 N2 P Ru S -","- C104 H144 Cl4 F24 N8 P4 Ru4 S4 -","4","1","","Chen, Weiguang; Egly, Julien; Poblador-Bahamonde, Amalia I; Maisse-Francois, Aline; Bellemin-Laponnaz, Stéphane; Achard, Thierry","Synthesis, characterization, catalytic and biological application of half-sandwich ruthenium complexes bearing hemilabile (κ2-C,S)-thioether-functionalised NHC ligands.","Dalton transactions (Cambridge, England : 2003)","2020","49","10","3243","3252","10.1039/c9dt04825a","","","0.71073","MoKα","","0.162","0.0646","","","0.1395","0.2089","","","","","","1.059","","","","has coordinates","250272","2020-10-21","18:00:00",""
"7703815","6.91929","0.00013","12.7504","0.0003","9.7223","0.0002","90","","127.503","0.0017","90","","680.47","0.03","298","","298","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C12 Ga2 O8.72 -","- C12 Ga2 O8.723 -","- C24 Ga4 O17.446 -","2","0.5","","Rabe, Timo; Pewe, Harm; Reinsch, Helge; Willhammar, Tom; Svensson Grape, Erik; Stock, Norbert","Influence of the substitution pattern of four naphthalenedicarboxylic acids on the structures and properties of group 13 metal-organic frameworks and coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2020","49","15","4861","4868","10.1039/d0dt00387e","powder diffraction","x-ray","1.5406","CuKα","","","","","","","","","0.0264","2.26557","","","","","","","has coordinates","251660","2020-10-21","18:00:00",""
"7703818","7.5927","0.0018","12.86","0.002","9.7151","0.0014","90","","135.335","0.008","90","","666.8","0.2","298","","298","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C12 Al2 O8.85 -","- C12 Al2 O8.854 -","- C24 Al4 O17.708 -","2","0.5","","Rabe, Timo; Pewe, Harm; Reinsch, Helge; Willhammar, Tom; Svensson Grape, Erik; Stock, Norbert","Influence of the substitution pattern of four naphthalenedicarboxylic acids on the structures and properties of group 13 metal-organic frameworks and coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2020","49","15","4861","4868","10.1039/d0dt00387e","powder diffraction","x-ray","1.5406","CuKα","","","","","","","","","0.0113","2.31117","","","","","","","has coordinates","251660","2020-10-21","18:00:00",""
"7704317","10.995","0.003","9.262","0.003","16.685","0.004","90","","125.483","0.016","90","","1383.6","0.7","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C28 H20 Cl3 N6 O0 Ru2 -","- C28 H20 Cl3 N6 Ru2 -","- C56 H40 Cl6 N12 Ru4 -","2","0.5","","Kang, Shi-Rui; Zhou, Zi-Qin; Xiong, Chang-Feng; Liu, Bin; McGrady, John E.; Obies, Mohammed; Liu, Chao; He, Piao; Yi, Xiao-Yi","Structural, spectroscopic and electronic properties of a family of face-shared bi-octahedral Ru<sub>2</sub><sup>5+/6+</sup> complexes with a bridging 2,5-di(2-pyridyl)pyrrolide ligand.","Dalton transactions (Cambridge, England : 2003)","2020","49","21","7053","7059","10.1039/d0dt01325k","","","0.71073","MoKα","","0.0401","0.0286","","","0.0744","0.0805","","","","","","0.918","","","","has coordinates","252828","2020-10-21","18:00:00",""
"7704495","19.286","0.0011","12.0279","0.0007","29.6486","0.0014","90","","119.834","0.003","90","","5966.1","0.6","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C90 H176 Co4 Dy4 N2 O46 -","- C90 H176 Co4 Dy4 N2 O46 -","- C180 H352 Co8 Dy8 N4 O92 -","2","0.5","","Basak, Dipmalya; van Leusen, Jan; Gupta, Tulika; Kögerler, Paul; Ray, Debashis","Synthetic diversity and change in nuclearity in [Co-Dy] coordination aggregates: bridge removal, solvent induced structural reorganization and AC susceptibility measurements.","Dalton transactions (Cambridge, England : 2003)","2020","49","22","7576","7591","10.1039/d0dt01728k","","","0.71073","MoKα","","0.0735","0.048","","","0.1143","0.1248","","","","","","1.073","","","","has coordinates","253886","2020-10-21","18:00:00",""
"7705696","25.8018","0.001","10.0911","0.0003","20.3821","0.0007","90","","92.472","0.002","90","","5301.9","0.3","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C30 H21 Cu N3 O6 -","- C30 H21 Cu N3 O6 -","- C240 H168 Cu8 N24 O48 -","8","2","","Islam, Sakhiul; Das, Pubali; Maiti, Saswati; Khan, Samim; Maity, Suvendu; Ghosh, Prasanta; Jana, Atish Dipankar; Ray, Partha Pratim; Mir, Mohammad Hedayetullah","Electrically conductive Cu(II)-based 1D coordination polymer with theoretical insight.","Dalton transactions (Cambridge, England : 2003)","2020","49","43","15323","15331","10.1039/d0dt03098h","","","0.71073","MoKα","","0.0838","0.0467","","","0.0981","0.1133","","","","","","1.061","","","","has coordinates","260738","2021-01-07","06:13:27",""
"7707126","20.1987","0.0006","15.7904","0.0004","26.4099","0.0007","90","","95.166","0.001","90","","8389.1","0.4","120","2","120","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C46 H121 Ba N28 Nb2 Ni3 O24.5 -","- C46 H72 Ba N28 Nb2 Ni3 O24.5 -","- C184 H288 Ba4 N112 Nb8 Ni12 O98 -","4","1","","Heczko, Michał; Reczyński, Mateusz; Näther, Christian; Nowicka, Beata","Tuning of magnetic properties of the 2D CN-bridged Ni<sup>II</sup>-Nb<sup>IV</sup> framework by incorporation of guest cations of alkali and alkaline earth metals.","Dalton transactions (Cambridge, England : 2003)","2021","50","22","7537","7544","10.1039/d1dt00367d","","","0.71073","MoKα","","0.1186","0.0764","","","0.1355","0.1497","","","","","","1.147","","","","has coordinates","267151","2021-07-05","17:31:55",""
"7707198","15.5398","0.0013","10.0374","0.0009","19.0268","0.0019","90","","90.593","0.003","90","","2967.6","0.5","296.15","","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C25 H16 Co N6 O4 -","- C25 H16 Co N6 O4 -","- C100 H64 Co4 N24 O16 -","4","1","","Liang, Shuai; Ge, Fa-Yuan; Ren, Shuang-Shuang; Lei, Ming-Yuan; Gao, Xiang-Jing; Zheng, He-Gen","Molecular engineering in a family of pillared-layered metal-organic frameworks for tuning gas adsorption behavior.","Dalton transactions (Cambridge, England : 2003)","2021","50","21","7409","7416","10.1039/d1dt00431j","","","0.71073","MoKα","","0.0877","0.0617","","","0.154","0.1699","","","","","","1.039","","","","has coordinates,has disorder","266095","2021-06-05","18:59:04",""
"7707306","13.393","0.004","11.321","0.004","19.152","0.005","90","","110.223","0.009","90","","2724.9","1.5","120","2","120","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C54 H48 Ag Au2 F6 N8 O2 P3 -","- C54 H48 Ag Au2 F6 N8 O2 P3 -","- C108 H96 Ag2 Au4 F12 N16 O4 P6 -","2","0.5","","Tao, Yanhui; Wang, Yuwei; Hu, Shengnan; Young, David James; Lu, Chengrong; Li, Hong-Xi; Ren, Zhi-Gang","A photoluminescent Au(I)/Ag(I)/PNN coordination complex for relatively rapid and reversible alcohol sensing.","Dalton transactions (Cambridge, England : 2003)","2021","50","20","6773","6777","10.1039/d1dt00931a","","","0.71073","MoKα","","0.033","0.0305","","","0.0832","0.0846","","","","","","1.073","","","","has coordinates","266034","2021-06-05","18:38:56",""
"7707307","13.47","0.0007","11.4324","0.0006","19.0084","0.0011","90","","109.031","0.0015","90","","2767.2","0.3","120","2","120","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C56 H52 Ag Au2 F6 N8 O2 P3 -","- C56 H52 Ag Au2 F6 N8 O2 P3 -","- C112 H104 Ag2 Au4 F12 N16 O4 P6 -","2","0.5","","Tao, Yanhui; Wang, Yuwei; Hu, Shengnan; Young, David James; Lu, Chengrong; Li, Hong-Xi; Ren, Zhi-Gang","A photoluminescent Au(I)/Ag(I)/PNN coordination complex for relatively rapid and reversible alcohol sensing.","Dalton transactions (Cambridge, England : 2003)","2021","50","20","6773","6777","10.1039/d1dt00931a","","","0.71073","MoKα","","0.0251","0.0243","","","0.063","0.0634","","","","","","1.058","","","","has coordinates,has disorder","266034","2021-06-05","18:38:57",""
"7707437","15.2095","0.0004","6.0527","0.0002","19.0567","0.0006","90","","102.175","0.001","90","","1714.87","0.09","296","2","296.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C38 H42 Cd N4 O7 -","- C38 H42 Cd N4 O7 -","- C76 H84 Cd2 N8 O14 -","2","0.5","","Xu, Yong-Kai; Meng, Mei-Mei; Xi, Ji-Ming; Wang, Li-Fei; Zhu, Rui; Liu, Xing-Gui; Zhang, Rui; Dong, Wei; Lu, Zhen-Zhong; Zheng, He-Gen; Huang, Wei","Mixed matrix membranes containing fluorescent coordination polymers for detecting Cr<sub>2</sub>O<sub>7</sub><sup>2-</sup> with high sensitivity, stability and recyclability.","Dalton transactions (Cambridge, England : 2003)","2021","50","23","7944","7948","10.1039/d1dt00894c","","","0.71073","MoKα","","0.0319","0.0272","","","0.0572","0.0587","","","","","","1.05","","","","has coordinates","267186","2021-07-05","17:42:15",""
"7707608","5.1145","0.00015","5.45546","0.00016","5.30199","0.00013","90","","96.4704","0.0021","90","","146.994","0.007","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Ho O4 Ta -","- Ho O4 Ta -","- Ho2 O8 Ta2 -","2","0.5","","Mullens, Bryce G.; Avdeev, Maxim; Brand, Helen E. A.; Mondal, S.; Vaitheeswaran, G.; Kennedy, Brendan J.","Insights into the structural variations in SmNb<sub>1-<i>x</i></sub>Ta<sub><i>x</i></sub>O<sub>4</sub> and HoNb<sub>1-<i>x</i></sub>Ta<sub><i>x</i></sub>O<sub>4</sub> combined experimental and computational studies.","Dalton transactions (Cambridge, England : 2003)","2021","50","26","9103","9117","10.1039/d1dt01051d","powder diffraction","neutron","1.622","","","","","","","","","0.04999","","1.59","","","","","","","has coordinates","268760","2021-09-06","11:11:01",""
"7707816","13.1785","0.0004","9.3729","0.0003","16.2115","0.0005","90","","98.098","0.002","90","","1982.49","0.11","120","2","120","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","msn378","","","- C16 H28 Cl2 Co N8 -","- C16 H28 Cl2 Co N8 -","- C64 H112 Cl8 Co4 N32 -","4","1","","Bhowmick, Indrani; Newell, Brian S.; Shores, Matthew P.","A systematic study of the influence of ligand field on the slow magnetic dynamics of Co(ii)-diimine compounds.","Dalton transactions (Cambridge, England : 2003)","2021","50","31","10737","10748","10.1039/d0dt01597k","","","0.71073","MoKα","","0.0265","0.0229","","","0.0564","0.058","","","","","","1.062","","","","has coordinates","268790","2021-09-06","11:20:56",""
"7708338","20.7441","0.0004","14.2785","0.0002","17.5264","0.0003","90","","106.317","0.002","90","","4982.13","0.15","120","0.13","120","0.13","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C57 H39 D9 N9 Zn3 -","- C57 H39 D9 N9 Zn3 -","- C228 H156 D36 N36 Zn12 -","4","1","","Uzelac, Marina; Yuan, Kang; Nichol, Gary Stephen; Ingleson, Michael James","Formation of a hydride containing amido-zincate using pinacolborane","Dalton Transactions","2021","","","","","10.1039/D1DT02580E","","x-ray","0.71073","MoKα","","0.0586","0.0395","","","0.0814","0.0879","","","","","","1.045","","","","has coordinates,has disorder","269199","2021-09-17","23:10:04",""
"7708476","14.7785","0.0017","15.0645","0.0013","29.008","0.003","90","","92.988","0.01","90","","6449.3","1.1","200","0.1","200","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C100 H119.96 Ag12 N28 O36 S14 -","- C100 H119.964 Ag12 N28 O36 S14 -","- C200 H239.928 Ag24 N56 O72 S28 -","2","0.5","","Li, Na-Na; Yang, Ming; Xu, Xiao-Jie; Dong, Xi-Yan; Li, Si; Zang, Shuang-Quan","Ensembles from Silver Clusters and Cucurbit[6]urils-contained Linkers","Dalton Transactions","2021","","","","","10.1039/D1DT02505H","","x-ray","1.54184","CuKα","","0.1558","0.1317","","","0.343","0.3621","","","","","","1.072","","","","has coordinates,has disorder","269385","2021-09-29","23:14:26",""
"7709170","26.912","0.004","7.1244","0.0009","28.323","0.004","90","","109.957","0.005","90","","5104.3","1.2","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C37 H50 B20 Cu2 N O11 -","- C33 H41 B20 Cu2 O10 -","- C132 H164 B80 Cu8 O40 -","4","1","","Li, Zhen; Choquesillo-Lazarte, Duane; Fraile, Julio; Viñas, Clara; Teixidor, Francesc; Planas, José G.","Rational design of carborane-based Cu2-paddle wheel coordination polymers for increased hydrolytic stability","Dalton Transactions","2022","","","","","10.1039/D1DT04065K","","","1.54178","CuKα","","0.1436","0.0694","","","0.1695","0.2078","","","","","","0.95","","","","has coordinates,has disorder","271612","2021-12-23","23:51:40",""
"7709266","27.777","0.002","10.3493","0.0005","28.717","0.003","90","","117.92","0.012","90","","7294.4","1.3","120","2","120","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C62 H54 Cl4 Fe2 N10 O19 -","- C62 H54 Cl4 Fe2 N10 O19 -","- C248 H216 Cl16 Fe8 N40 O76 -","4","1","","Munshi, Sandip; Sinha, Arup; Yiga, Solomon; Banerjee, Sridhar; Singh, Reena; Hossain, Md. Kamal; Haukka, Matti; Valiati, Andrei Felipe; Huelsmann, Ricardo Dagnoni; Martendal, Edmar; Peralta, Rosely; Xavier, Fernando; Wendt, Ola F.; Paine, Tapan K.; Nordlander, Ebbe","Hydrogen-atom and oxygen-atom transfer reactivities of iron(iv)-oxo complexes of quinoline-substituted pentadentate ligands","Dalton Transactions","2022","","","","","10.1039/D1DT03381F","","","0.71073","MoKα","","0.2001","0.0919","","","0.2302","0.3029","","","","","","0.993","","","","has coordinates,has disorder","271948","2022-01-07","23:47:24",""
"7709349","18.9153","0.0006","13.8331","0.0004","16.2657","0.0005","90","","114.705","0.0012","90","","3866.5","0.2","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C88 H85 B N6 Ni2 O12 P2 -","- C88 H85 B N6 Ni2 O12 P2 -","- C176 H170 B2 N12 Ni4 O24 P4 -","2","0.5","","Simon, Jasmin; Horstmann, Claudia; Mix, Andreas; Stammler, Anja; Oldengott, Jan; Bögge, Hartmut; Glaser, Thorsten","Evaluation of the Binding Mode of a Cytotoxic Dinuclear Nickel Complex to two Neighboring Phosphates of the DNA Backbone","Dalton Transactions","2022","","","","","10.1039/D1DT03813C","","x-ray","1.54178","CuKα","","0.0298","0.0271","","","0.0704","0.072","","","","","","1.051","","","","has coordinates","272215","2022-01-24","23:52:38",""
"7709394","14.5462","0.0009","23.5999","0.0016","15.7122","0.001","90","","105.621","0.002","90","","5194.6","0.6","193","2","193","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C50 H51 N5 O16 Zn2 -","- C44 H29 N3 O10 Zn2 -","- C176 H116 N12 O40 Zn8 -","4","1","","Zhao, Shu-Man; Qiu, Zhao-Feng; Xu, Zou-Hong; huang, ziqing; Zhao, Yue; Sun, Wei-Yin","Fluorescent Zn(II) frameworks with multicarboxylate and pyridyl N-donor ligands for sensing specific anions and organic molecules","Dalton Transactions","2022","","","","","10.1039/D1DT04052A","","x-ray","1.34139","GaKα","","0.097","0.0798","","","0.2426","0.2639","","","","","","1.082","","","","has coordinates,has disorder","272349","2022-01-29","23:44:58",""
"7709405","19.1358","0.0007","15.9715","0.0006","24.4234","0.0008","90","","109.955","0.002","90","","7016.3","0.4","100","","100","","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C34 H32 B Cl2 F2 N6 O4 Pt -","- C34 H32 B Cl2 F2 N6 O4 Pt -","- C272 H256 B8 Cl16 F16 N48 O32 Pt8 -","8","2","","Chakravarty, Akhil R.; Bera, Arpan; Gautam, Srishti; Raza, Md Kausar; Pal, Apurba Kumar; Kondaiah, Paturu","BODIPY-dipicolylamine complexes of platinum(II): X-ray structure, cellular imaging and organelles specific near-IR light type-II PDT","Dalton Transactions","2022","","","","","10.1039/D1DT03200C","","","0.71073","MoKα","","0.0692","0.0436","","","0.1049","0.1217","","","","","","0.963","","","","has coordinates","272406","2022-02-01","23:58:18",""
"7709504","20.8862","0.0005","8.1398","0.0001","13.9252","0.0002","90","","100.044","0.002","90","","2331.13","0.07","100","0.1","100","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C43 H54 Br4 Cl2 N4 S2 -","- C43 H54 Br4 Cl2 N4 S2 -","- C86 H108 Br8 Cl4 N8 S4 -","2","0.5","","Saab, Marina; Nelson, David J.; Leech, Matthew C.; Lam, Kevin; Nolan, Steven P.; Nahra, Fady; Van Hecke, Kristof","Reactions of N-heterocyclic carbene-based chalcogenoureas with halogens: a diverse range of outcomes","Dalton Transactions","2022","","","","","10.1039/D2DT00010E","","x-ray","1.54184","CuKα","","0.0451","0.0364","","","0.0931","0.1002","","","","","","1.025","","","","has coordinates","272982","2022-02-15","23:59:44",""
"7709967","9.5613","0.0002","10.081","0.0002","15.1805","0.0003","90","","106.42","0.002","90","","1403.53","0.05","150","0.1","150","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","rac-2-I","","- C5 H14 I3 N3.5 O0.25 Pb0.5 -","- C5 H17 I3 N2 O1.5 Pb0.5 -","- C20 H68 I12 N8 O6 Pb2 -","4","1","","Jia, Xiaodi; Zheng, Yongshen; Cheng, Puxin; Han, Xiao; Xu, Liang; Xu, Jialiang","Methylpiperazine Based 0D Chiral Hybrid Lead Halides for Second Harmonic Generation","Dalton Transactions","2022","","","","","10.1039/D2DT00557C","","x-ray","0.71073","MoKα","","0.0177","0.017","","","0.0394","0.0397","","","","","","1.12","","","","has coordinates","274458","2022-04-11","23:06:36",""
"7710334","15.7153","0.0005","7.5751","0.0003","31.326","0.0008","90","","116.071","0.001","90","","3349.76","0.19","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C30 H29 Cd N5 O7 -","- C30 H29 Cd N5 O7 -","- C120 H116 Cd4 N20 O28 -","4","1","","Ding, Run-Dong; Li, Dan-Dan; Leng, Feng; Yu, Jie-Hui; Jia, Ming-Jun; Xu, Ji-Qing","A metal–organic framework with rich accessible nitrogen sites for rapid dye adsorption and highly efficient dehydrogenation of formic acid","Dalton Transactions","2022","","","","","10.1039/D2DT00389A","","","0.71073","MoKα","","0.0522","0.0402","","","0.1058","0.114","","","","","","1.079","","","","has coordinates","275645","2022-05-25","22:52:57",""
"7710414","12.662","0.003","13.378","0.003","12.892","0.003","90","","119.05","0.03","90","","1909.1","0.9","300","","300","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C42 H30 Cl2 Fe O6 P2 -","- C42 H30 Cl2 Fe O6 P2 -","- C84 H60 Cl4 Fe2 O12 P4 -","2","0.5","","Clutterbuck, Katelyn M.; Abrahams, Brendan F.; Hudson, Timothy A.; van Koeverden, Martin P.","Mixed valency in a neutral 1D Fe-chloranilate coordination polymer.","Dalton transactions (Cambridge, England : 2003)","2022","51","24","9199","9205","10.1039/d1dt04368d","","","0.71073","MoKα","","0.0649","0.0594","","","0.182","0.1903","","","","","","1.049","","","","has coordinates","276616","2022-07-06","08:08:59",""
"7710415","12.463","0.003","13.273","0.003","12.782","0.003","90","","118.94","0.03","90","","1850.4","0.9","100","","100","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C42 H30 Cl2 Fe O6 P2 -","- C42 H30 Cl2 Fe O6 P2 -","- C84 H60 Cl4 Fe2 O12 P4 -","2","0.5","","Clutterbuck, Katelyn M.; Abrahams, Brendan F.; Hudson, Timothy A.; van Koeverden, Martin P.","Mixed valency in a neutral 1D Fe-chloranilate coordination polymer.","Dalton transactions (Cambridge, England : 2003)","2022","51","24","9199","9205","10.1039/d1dt04368d","","","0.71073","MoKα","","0.0689","0.063","","","0.188","0.196","","","","","","1.07","","","","has coordinates","276616","2022-07-06","08:09:05",""
"7711270","15.475","0.002","9.1044","0.0012","15.932","0.002","90","","101.773","0.002","90","","2197.4","0.5","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C17 H28 Cl F2 N O9 -","- C17 H28 Cl F2 N O9 -","- C68 H112 Cl4 F8 N4 O36 -","4","1","","Ye, Xing; He, Wenhui; Wei, Jing; Wei, Zhenhong; You, Xiuli; Cai, Hu","Two host–guest grown ether supramolecules show switchable phase transition, dielectric and second-harmonic generation effect","Dalton Transactions","2022","","","","","10.1039/D2DT01826H","","","0.71073","MoKα","","0.1142","0.0732","","","0.2488","0.3006","","","","","","1.068","","","","has coordinates","277968","2022-09-18","22:59:30",""
"7711437","13.4425","0.0002","21.4389","0.0004","29.9936","0.0004","90","","91.448","0.001","90","","8641.2","0.2","100","0.1","100","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C60 H160 Cl11 N14 O92 Tb15 -","- C60 H160 Cl11 N14 O92 Tb15 -","- C120 H320 Cl22 N28 O184 Tb30 -","2","0.5","","Zou, Ying; Lv, Wei; Xue, Zhe; Pan, Jie; Li, Xiao-Yu; Wang, Guo-Ming","The pentagram-typed Ln15 (Ln=Dy, Tb, Eu, Sm, Ho) clusters with different anion templates: magnetic and luminescent properties","Dalton Transactions","2022","","","","","10.1039/D2DT02712G","","x-ray","0.71073","MoKα","","0.0764","0.0546","","","0.1438","0.1609","","","","","","1.023","","","","has coordinates","278371","2022-10-05","22:39:05",""
"7711456","10.867","0.0005","8.6697","0.0003","23.7339","0.0009","90","","96.663","0.004","90","","2220.95","0.15","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C38 H30 Cr Cu2 N7 O21 -","- C38 H30 Cr Cu2 N7 O21 -","- C76 H60 Cr2 Cu4 N14 O42 -","2","0.5","","Molčanov, Lidija; Šenjug, Pavla; Barišić, Dario; Pajić, Damir; Molčanov, Krešimir; Jurić, Marijana","Oxalate-based [CuIICrIII] coordination compounds affected by the tridentate ligand, simple anion, and reactant ratio: structural and magnetic features","Dalton Transactions","2022","","","","","10.1039/D2DT01949C","","","1.54184","CuKα","","0.0916","0.0844","","","","0.2689","","","","","","1.14","","","","has coordinates,has disorder","278535","2022-10-11","23:03:02",""
"7712107","14.0415","0.0006","18.4352","0.0007","27.089","0.0009","90","","104.177","0.004","90","","6798.6","0.5","110.05","0.1","110.05","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C33 H43 Cl2 Hg2 N O4 -","- C33 H43 Cl2 Hg2 N O4 -","- C264 H344 Cl16 Hg16 N8 O32 -","8","2","","McEllin, Alice Jane; Goult, Christopher A.; Whitwood, Adrian C.; Lynam, Jason M.; Bruce, Duncan W.","On the mercuration, palladation, transmetalation and direct auration of a C^N^C pincer ligand.","Dalton transactions (Cambridge, England : 2003)","2023","52","4","872","876","10.1039/d2dt04114f","","x-ray","1.54184","CuKα","","0.0786","0.0647","","","0.1431","0.1525","","","","","","1.059","","","","has coordinates,has disorder","283263","2023-05-05","01:52:48",""
"7712111","7.52262","0.0001","5.26905","0.00008","11.22463","0.00016","90","","104.641","0.0007","90","","430.464","0.011","300","","300","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Lu2 O6 W -","- Lu2 O6 W -","- Lu8 O24 W4 -","4","1","","Wang, Xuejiao; Feng, Xiaowen; Molokeev, Maxim S.; Zheng, Huiling; Wang, Qiushi; Xu, Chunyan; Li, Ji-Guang","Modulation of Bi<sup>3+</sup> luminescence from broadband green to broadband deep red in Lu<sub>2</sub>WO<sub>6</sub> by Gd<sup>3+</sup> doping and its applications in high color rendering index white LED and near-infrared LED.","Dalton transactions (Cambridge, England : 2003)","2023","52","9","2619","2630","10.1039/d2dt03751c","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.1","4.05","","","","","","","has coordinates","283222","2023-05-05","01:35:27",""
"7712114","7.56643","0.00011","5.30847","0.00009","11.30437","0.00017","90","","104.527","0.0009","90","","439.536","0.012","300","","300","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Gd1.96 Lu6.04 O24 W4 -","- Gd1.96 Lu6.04 O24 W4 -","- Gd1.96 Lu6.04 O24 W4 -","1","0.25","","Wang, Xuejiao; Feng, Xiaowen; Molokeev, Maxim S.; Zheng, Huiling; Wang, Qiushi; Xu, Chunyan; Li, Ji-Guang","Modulation of Bi<sup>3+</sup> luminescence from broadband green to broadband deep red in Lu<sub>2</sub>WO<sub>6</sub> by Gd<sup>3+</sup> doping and its applications in high color rendering index white LED and near-infrared LED.","Dalton transactions (Cambridge, England : 2003)","2023","52","9","2619","2630","10.1039/d2dt03751c","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","0","1.64","","","","","","","has coordinates","283222","2023-05-05","01:35:42",""
"7712115","7.52747","0.00014","5.27346","0.00011","11.2307","0.0002","90","","104.638","0.0011","90","","431.341","0.014","300","","300","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Gd0.6 Lu7.4 O24 W4 -","- Gd0.6 Lu7.4 O24 W4 -","- Gd0.6 Lu7.4 O24 W4 -","1","0.25","","Wang, Xuejiao; Feng, Xiaowen; Molokeev, Maxim S.; Zheng, Huiling; Wang, Qiushi; Xu, Chunyan; Li, Ji-Guang","Modulation of Bi<sup>3+</sup> luminescence from broadband green to broadband deep red in Lu<sub>2</sub>WO<sub>6</sub> by Gd<sup>3+</sup> doping and its applications in high color rendering index white LED and near-infrared LED.","Dalton transactions (Cambridge, England : 2003)","2023","52","9","2619","2630","10.1039/d2dt03751c","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","2.28","2.4","","","","","","","has coordinates","283222","2023-05-05","01:35:49",""
"7712116","7.54138","0.00016","5.28624","0.00012","11.2588","0.0003","90","","104.593","0.0013","90","","434.359","0.018","300","","300","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Gd0.8 Lu7.2 O24 W4 -","- Gd0.8 Lu7.2 O24 W4 -","- Gd0.8 Lu7.2 O24 W4 -","1","0.25","","Wang, Xuejiao; Feng, Xiaowen; Molokeev, Maxim S.; Zheng, Huiling; Wang, Qiushi; Xu, Chunyan; Li, Ji-Guang","Modulation of Bi<sup>3+</sup> luminescence from broadband green to broadband deep red in Lu<sub>2</sub>WO<sub>6</sub> by Gd<sup>3+</sup> doping and its applications in high color rendering index white LED and near-infrared LED.","Dalton transactions (Cambridge, England : 2003)","2023","52","9","2619","2630","10.1039/d2dt03751c","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","0","2.18","","","","","","","has coordinates","283222","2023-05-05","01:35:49",""
"7712117","7.53287","0.0001","5.27787","0.00008","11.24076","0.00015","90","","104.624","0.0008","90","","432.426","0.011","300","","300","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Gd0.36 Lu7.64 O24 W4 -","- Gd0.36 Lu7.64 O24 W4 -","- Gd0.36 Lu7.64 O24 W4 -","1","0.25","","Wang, Xuejiao; Feng, Xiaowen; Molokeev, Maxim S.; Zheng, Huiling; Wang, Qiushi; Xu, Chunyan; Li, Ji-Guang","Modulation of Bi<sup>3+</sup> luminescence from broadband green to broadband deep red in Lu<sub>2</sub>WO<sub>6</sub> by Gd<sup>3+</sup> doping and its applications in high color rendering index white LED and near-infrared LED.","Dalton transactions (Cambridge, England : 2003)","2023","52","9","2619","2630","10.1039/d2dt03751c","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.09","4.17","","","","","","","has coordinates","283222","2023-05-05","01:35:52",""
"7712559","15.686","0.0011","9.7121","0.0009","18.3253","0.0018","90","","104.091","0.009","90","","2707.7","0.4","292","2","292","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C48 H50 Cu2 F2 N18 O15 -","- C48 H50 Cu2 F2 N18 O15 -","- C96 H100 Cu4 F4 N36 O30 -","2","0.5","","Icsel, Ceyda; Yilmaz, Veysel T.; Aygün, Muhittin; Erkisa, Merve; Ulukaya, Engin","Water-soluble copper(II) 5-fluorouracil complexes bearing polypyridyl co-ligands: Synthesis, structures and anticancer activity","Dalton Transactions","2023","","","","","10.1039/D3DT00363A","","","0.71073","MoKα","","0.1481","0.0466","","","0.0566","0.0659","","","","","","0.706","","","","has coordinates,has disorder","281784","2023-03-09","23:52:46",""
"7712655","12.0707","0.0005","7.3415","0.0003","18.2512","0.0007","90","","106.26","0.002","90","","1552.67","0.11","150","","150","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C8 H14 K6 N22 O15 -","- C8 H14 K6 N22 O15 -","- C16 H28 K12 N44 O30 -","2","0.5","","Jiang, Xiue; Yang, Yalin; Du, Huiying; Yang, Bo; Tang, Pengfei; Wu, Bo; Ma, Congming","Triazene Bridged Energetic Materials Based on Nitrotriazole: Synthesis, Characterization and Laser Ignited Combustion Performance","Dalton Transactions","2023","","","","","10.1039/D2DT04007G","","x-ray","1.34139","GaKα","","0.0681","0.0508","","","0.1312","0.1401","","","","","","1.045","","","","has coordinates,has disorder","281942","2023-03-18","23:49:01",""
"7712916","21.516","0.003","6.3257","0.0008","20.465","0.003","90","","117.404","0.002","90","","2472.8","0.6","296.15","","296.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C23 H26 Cd N4 O6.5 -","- C23 H26 Cd N4 O6.5 -","- C92 H104 Cd4 N16 O26 -","4","1","","li, Chaoxiong; Sun, Xuancheng; Meng, Xiang Gao; Wang, Dunjia; Zheng, Chunyang","A Water Stable and Highly Fluorescent Zn(II) Based Metal−Organic Frameworks for Fast Detection of Hg2+, CrVI and Antibiotics","Dalton Transactions","2023","","","","","10.1039/D3DT00756A","","","0.71073","MoKα","","0.0385","0.0272","","","0.0677","0.0748","","","","","","1.036","","","","has coordinates,has disorder","282954","2023-05-02","22:52:49",""
"7713842","11.6879","0.0003","8.1606","0.0003","17.0513","0.0006","90","","106.191","0.002","90","","1561.85","0.09","200","2","200","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C37 H30 Co N O2 P2 -","- C37 H30 Co N O2 P2 -","- C74 H60 Co2 N2 O4 P4 -","2","0.5","","Chang, Wen-Chieh; Du, Wan-Ting; Lin, Yi-Xuan; Jhang, Ruei-Lin; Hsieh, Chung-Hung","Phosphine/Thiolate Containing Dinitrosyl Cobalt Complexes (DNCCs): Synthesis, Characterization, Interconversion, X-ray Diffraction Identification, and Its NO Releasing","Dalton Transactions","2023","","","","","10.1039/D3DT01681A","","","0.71073","MoKα","","0.0553","0.0391","","","0.0896","0.0978","","","","","","1.087","","","","has coordinates,has disorder","285919","2023-08-30","23:05:54",""
"7714131","20.9097","0.0008","11.5922","0.0003","31.8136","0.0009","90","","107.886","0.004","90","","7338.6","0.4","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C18 H12 Cl I N2 O Pt -","- C18 H12 Cl I N2 O Pt -","- C288 H192 Cl16 I16 N32 O16 Pt16 -","16","4","","Gitlina, Anastasiia Yu.; Petrovskii, Stanislav; Luginin, Maksim; Melnikov, Alexei S.; Rychagova, Elena A.; Ketkov, Sergey Yu.; Grachova, Elena V.","X/Y Platinum(II) complexes: some features of supramolecular assembly via halogen bonding","Dalton Transactions","2023","","","","","10.1039/D3DT02970K","","","0.71073","MoKα","","0.0906","0.0797","","","0.1893","0.1968","","","","","","1.098","","","","has coordinates","286833","2023-10-06","22:58:50",""
"7714268","24.46","0.002","8.6052","0.0008","24.688","0.003","90","","103.579","0.011","90","","5051.2","0.9","298","","298","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C50 H54 B2 F4 N4 -","- C50 H54 B2 F4 N4 -","- C200 H216 B8 F16 N16 -","4","1","","Kannan, Ramkumar; Nayak, Prakash; Arumugam, Ramar; Krishna Rao, D.; Mote, Kaustubh R.; Murali, Anna Chandrasekar; Venkatasubbaiah, Krishnan; Chandrasekhar, Vadapalli","Blue Emissive Amidinate Based Tetra coordinate Boron Compounds","Dalton Transactions","2023","","","","","10.1039/D3DT03378C","","x-ray","0.71073","MoKα","","0.1369","0.0756","","","0.1941","0.2265","","","","","","1.019","","","","has coordinates","287067","2023-10-20","23:05:40",""
"7715720","22.461","0.0007","11.6306","0.0004","26.5609","0.0009","90","","97.488","0.001","90","","6879.5","0.4","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","Compound1","","- C110 H150 Cl12 Dy4 N14 O48 Zn4 -","- C104 H128 Dy4 N14 O46 Zn4 -","- C208 H256 Dy8 N28 O92 Zn8 -","2","0.5","","Zabala-Lekuona, Andoni; Lopez de Pariza, Xabier; Díaz-Ortega, Ismael Francisco; Cepeda, Javier; Nojiri, Hiroyuki; Gritsan, Nina P.; Dmitriev, A. A.; López-Ortega, Alberto; Rodríguez Diéguez, Antonio; Seco, José Manuel; Colacio, Enrique","From field-induced to zero-field SMMs associated with open/closed structures of bis(ZnDy) tetranuclear complexes: a combined magnetic, theoretical and optical study","Dalton Transactions","2024","","","","","10.1039/D4DT00148F","","","0.71073","MoKα","","0.0424","0.0359","","","0.0754","0.0774","","","","","","1.143","","","","has coordinates,has disorder","291208","2024-04-15","23:11:24",""
"7715757","8.864","0.002","8.089","0.002","20.473","0.005","90","","98.664","0.009","90","","1451.2","0.6","296","2","296","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H26 N6 Ni S4 -","- C26 H26 N6 Ni S4 -","- C52 H52 N12 Ni2 S8 -","2","0.5","","Gao, Yan; Xu, Lei; Feng, Zi-Heng; Qian, yin; Tian, Zhengfang; Ren, Xiaoming","Polymorph transformation in a mixed-stacking nickel-dithiolene complex with the derivative of 4,4'-bipyridinium","Dalton Transactions","2024","","","","","10.1039/D4DT00324A","","","0.71073","MoKα","","0.1246","0.0538","","","0.0932","0.119","","","","","","1.027","","","","has coordinates","291264","2024-04-17","22:51:26",""
"8000075","16.9741","0.0004","6.496","0.0002","7.1152","0.0002","90","","91.0088","0.0013","90","","784.43","0.04","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C21 H12 O S2 -","- C21 H12 O S2 -","- C42 H24 O2 S4 -","2","0.5","","Reddy, J. Sreedhar; Kale, Tejaswini; Balaji, Ganapathy; Chandrasekaran, A.; Thayumanavan, S.","Cyclopentadithiophene-Based Organic Semiconductors: Effect of Fluorinated Substituents on Electrochemical and Charge Transport Properties","The Journal of Physical Chemistry Letters","2011","2","6","648","","10.1021/jz200126s","","","0.71073","MoKα","","0.0315","0.0292","","","0.0769","0.0786","","","","","","1.067","","","","has coordinates","211175","2020-10-21","18:00:00",""
"8000470","30.891","0.006","17.628","0.004","39.727","0.008","90","","99.02","0.03","90","","21366","8","100","","100","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C180 H270 Ag26 Au S19 -","- C180 H270 Ag26 Au S19 -","- C720 H1080 Ag104 Au4 S76 -","4","1","","Lin, Xinzhang; Ma, Weiguang; Sun, Keju; Sun, Bo; Fu, Xuemei; Ren, Xiuqing; Liu, Chao; Huang, Jiahui","[AuAg26(SR)18S]− Nanocluster: Open Shell Structure and High Faradaic Efficiency in Electrochemical Reduction of CO2 to CO","The Journal of Physical Chemistry Letters","2020","","","552","557","10.1021/acs.jpclett.0c03416","","","0.9793","MoKα","","0.1058","0.099","","","0.2628","0.2709","","","","","","1.037","","","","has coordinates","260332","2021-01-01","01:32:19",""
"8100400","18.757","0.004","3.9876","0.0008","14.668","0.003","90","","112.15","0.03","90","","1016.1","0.4","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C9 H8 N4 S2 -","- C9 H8 N4 S2 -","- C36 H32 N16 S8 -","4","1","","Liu, Lihua; Fu, Yongshan; Zhang, Qian-Feng","Crystal structure of bis(2-pyrimidylthio)methane, C~9~H~8~N~4~S~2~","Zeitschrift für Kristallographie - New Crystal Structures","2003","218","3","339","340","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8100942","21.242","0.002","4.755","0.001","9.366","0.001","90","","93.132","0.001","90","","944.6","0.2","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","Zn(C8 H12 O4)","","","- C8 H12 O4 Zn -","- C8 H12 O4 Zn -","- C32 H48 O16 Zn4 -","4","1","","Zheng, Yue-Qing; Pan, Ai-Ya; Lin, Jian-Li","Crystal structure of zinc suberate, C~8~H~12~O~4~Zn","Zeitschrift für Kristallographie - New Crystal Structures","2001","216","2","267","268","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101338","13.933","0.002","4.782","0.001","9.281","0.002","90","","90.62","0.01","90","","618.3","0.2","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C5 H6 O4 Zn -","- C5 H6 O4 Zn -","- C20 H24 O16 Zn4 -","4","1","","Zheng, Yue-Qing; Lin, Jian-Li; Zhang, Hong-Liang","Crystal structure of zinc glutarate, Zn(C~5~H~6~O~4~)","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","4","535","536","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101870","24.392","0.005","12.632","0.002","23.709","0.005","90","","100.97","0.03","90","","7172","3","200","2","200","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","tris[{((diphenylphosphino)methylene)diphenylphosphoranyl}methyl]yttrium ethyl ether monosolvate","","- C82 H79 O P6 Y -","- C82 H79 O P6 Y -","- C328 H316 O4 P24 Y4 -","4","1","","Spannenberg, A.; Müller, B.; Rosenthal, U.","Crystal structure of tris[(diphenylphosphino)methylene) diphenylphosphoranylmethyl]yttrium diethyl ether monosolvate, [Y{P(C~6~H~5~)~2~CHP(C~6~H~5~)~2~CH~2~}~3~] · (C~2~H~5~)~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","4","581","584","","","","0.71073","MoKα","","0.1679","0.0543","","","0.0918","0.1121","","","","","","0.762","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102172","13.5422","0.0008","3.6958","0.0002","24.8378","0.0012","90","","118.965","0.003","90","","1087.62","0.11","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","bis(imidazolium) bis(μ~2~-2-oxybenzene-1,3-dicarboxylato)-dicuprate(II) monohydrate","","- C22 H18 Cu2 N4 O11 -","- C22 H18 Cu2 N4 O11 -","- C44 H36 Cu4 N8 O22 -","2","0.5","","He, Yin-Hua; Feng, Xia; Wen, Yi-Hang","Crystal structure of bis(imidazolium) bis(μ~2~-2-oxy-benzene- 1,3-dicarboxylato)-dicuprate(II) monohydrate, (C~3~H~5~N~2~)~2~[Cu~2~ (C~8~H~3~O~5~)~2~] · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","361","362","","","","0.71073","MoKα","","","0.0722","","","0.164","0.1913","","","","","","1.06","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102420","14.1203","0.0015","8.4612","0.0009","20.5495","0.0016","90","","129.47","0.005","90","","1895.3","0.3","291","2","291","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C72 H52 Co4 N12 O28 S4 -","- C72 H52 Co4 N12 O28 S4 -","- C72 H52 Co4 N12 O28 S4 -","1","0.25","","Shuai Yuan; Wen-Ying Zhang; Kun-Xian Shu; Yi-Long Liang; Guang-Fan Yan","Crystal structure of diaqua-bis[(5-nitroisophthalato)-(4,4'-dipyridylsulfide)cobalt(II)], Co2(H2O)2(C8H3NO6)2(C10H8N2S)2","Zeitschrift für Kristallographie - New Crystal Structures","2009","224","2","203","","","","","0.71073","MoKα","","0.0397","0.0282","","","0.0711","0.0773","","","","","","1.016","","","","has coordinates","211175","2020-10-21","18:00:00",""
"8102445","12.84","0.003","7.5329","0.0017","16.373","0.004","90","","96.907","0.004","90","","1572.1","0.6","298","2","298","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","2-amino-4-(4-bromophenyl)-5,6,7,8-tetrahydronaphthalene- 1,3-dicarbonitrile, C~18~H~14~Br~1~N~3~","","- C18 H14 Br N3 -","- C18 H14 Br N3 -","- C72 H56 Br4 N12 -","4","1","","Zhen Jia","Crystal structure of 2-amino-4-(4-bromophenyl)-5,6,7,8-tetrahydronaphthalene-1,3-dicarbonitrile, C18H14BrN3","Zeitschrift für Kristallographie - New Crystal Structures","2009","224","3","435","","","","","0.71073","MoKα","","0.0754","0.0451","","","0.1042","0.1193","","","","","","1.028","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102705","14.6271","0.0003","6.8558","0.0001","15.0743","0.0003","90","","111.185","0.002","90","","1409.5","0.05","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","trans-tetraaqua-bis(nicotinamide) zinc(ii) 4,4'-biphenyldisulfonate","","- C24 H28 N4 O12 S2 Zn -","- C24 H28 N4 O12 S2 Zn -","- C48 H56 N8 O24 S4 Zn2 -","2","0.5","","Zhaoxun Lian; Ning Zhao; Ping Liu","Crystal structure of trans-tetraaquabis(nicotinamide)zinc(II) 4,4'-biphenyldisulfonate, [Zn(H2O)4(C6H6N2O)2][C12H8S2O6]","Zeitschrift für Kristallographie - New Crystal Structures","2010","225","2","379","","","","","1.54178","CuKα","","0.0475","0.0437","","","0.1194","0.1225","","","","","","1.009","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102967","6.479","0.001","6.11","0.001","10.741","0.002","90","","103.61","0.03","90","","413.26","0.13","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","rubidium zinc bis(hydrogenselenate(IV)) chloride","","- Cl H2 O6 Rb Se2 Zn -","- Cl H2 O6 Rb Se2 Zn -","- Cl2 H4 O12 Rb2 Se4 Zn2 -","2","0.5","","Spirovski, F.; Wagener, M.; Stefov, V.; Engelen, B.","Crystal structures of rubidium zinc bis(hydrogenselenate(IV)) chloride, RbZn(HSeO~3~)~2~Cl, and rubidium zinc bis(hydrogenselenate(IV)) bromide, RbZn(HSeO~3~)~2~Br","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","91","92","","","","0.71069","MoKα","","0.0305","0.0245","","","0.0513","0.0528","","","","","","1.087","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103104","8.957","0.0014","13.055","0.002","23.67","0.003","90","","110.267","0.005","90","","2596.5","0.7","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","N6O18Sr.2(C10H10N2).2(C3H5N2).2(C3H4N2).2(C3H3N2).(H2O)","","- C38 H46 N22 O19 Sr -","- C38 H46 N22 O19 Sr -","- C76 H92 N44 O38 Sr2 -","2","0.5","","Wenyan Bi; Li Guanghua; Qing Xue; Yu Huo; Gaopeng Wang","Crystal structure of bis(4,4'-bipyridinium) bis(imidazolium) hexanitratostrontium(II) bis(imidazolate) — imidazole — water (1:2:1), [C10H10N2]2[C3H5N2]2[Sr(NO3)6][C3H3N2]2 · 2C3H4N2 · H2O","Zeitschrift für Kristallographie - New Crystal Structures","2011","226","1","121","","","","","0.71073","MoKα","","0.0705","0.0437","","","0.1013","0.1133","","","","","","1.005","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8103111","14.603","0.003","4.323","0.002","20.445","0.003","90","","102.234","0.002","90","","1261.4","0.7","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","2,4-dichloro-6-[(6-methylpyridin-2-ylimino)methyl]phenol, C~13~H~10~Cl~2~N~2~O","","- C13 H10 Cl2 N2 O -","- C13 H10 Cl2 N2 O -","- C52 H40 Cl8 N8 O4 -","4","1","","Ping Wang; Qi-Lin Li; Qiong Ruan; Yong-Qing Su","Crystal structure of 2,4-dichloro-6-[(6-methylpyridin-2-ylimino)methyl]phenol, C13H10Cl2N2O","Zeitschrift für Kristallographie - New Crystal Structures","2011","226","1","35","","","","","0.71073","MoKα","","0.0765","0.0415","","","0.0886","0.1013","","","","","","1.026","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8103142","18.2901","0.001","10.6611","0.0006","20.8722","0.0011","90","","100.122","0.001","90","","4006.6","0.4","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","[(2-(4-fluorophenyl)-1H-imidazo[4,5-f][1,10]phenanthroline-lead(II)]- 5-nitro-1,3-benzenedicarboxylato], [Pb(C~19~H~11~N~4~F)~2~(C~8~H~3~NO~6~)]^.^1.5H~2~O","","- C92 H56 F4 N18 O15 Pb2 -","- C92 H50 F4 N18 O15 Pb2 -","- C184 H100 F8 N36 O30 Pb4 -","2","0.5","","Xiu-Yan Wang; Shuai Ma; Yu He","Crystal structure of (2-(4-fluorophenyl)-1H-imidazo[4,5-f][1,10]-phenanthroline)-(5-nitro-1,3-benzenedicarboxylato)lead(II) sesquihydrate, Pb(C19H11N4F)2(C8H3NO6) · 1.5H2O","Zeitschrift für Kristallographie - New Crystal Structures","2011","226","3","350","","","","","0.71073","MoKα","","0.0543","0.039","","","0.0904","0.096","","","","","","1.037","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8103676","4.8238","","5.7504","","4.9901","","90","","91.18","","90","","138.39","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Mn W O4","","- Mn O4 W -","- Mn O4 W -","- Mn2 O8 W2 -","2","0.5","","Weitzel, H.","Kristallstrukturverfeinerung von Wolframiten und Columbiten","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1976","144","","238","258","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103677","4.6698","","5.6873","","4.9515","","90","","90","","90","","131.505","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Co (W O4)","","- Co O4 W -","- Co O4 W -","- Co2 O8 W2 -","2","0.5","","Weitzel, H.","Kristallstrukturverfeinerung von Wolframiten und Columbiten","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1976","144","","238","258","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103678","4.5992","","5.6606","","4.9068","","90","","90.03","","90","","127.745","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Ni W O4","","- Ni O4 W -","- Ni O4 W -","- Ni2 O8 W2 -","2","0.5","","Weitzel, H.","Kristallstrukturverfeinerung von Wolframiten und Columbiten","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1976","144","","238","258","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103833","4.82","","5.76","","4.97","","90","","89.12","","90","","137.967","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Mn W O4","","- Mn O4 W -","- Mn O4 W -","- Mn2 O8 W2 -","2","0.5","","Dachs, H.; Stoll, E.; Weitzel, H.","Kristallstruktur und magnetische Ordnung des Huebnerits, Mn W O4","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1967","125","","120","129","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103937","7.108","","6.682","","12.276","","90","","95.712","","90","","580.162","","","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","K3 ((B O2 (O H))2 B3 P O6 (O H))","","- B5 H3 K3 O13 P -","- B5 H2 K3 O13 P -","- B10 H4 K6 O26 P2 -","2","0.5","","Hauf, C.; Kniep, R.","Crystal structure of catena-(triboro-monohydrogen-phosphate bis(monohydrogenborate)), K3 (B5 P O10 (O H)3)","Zeitschrift fuer Kristallographie (149,1979-)","1996","211","","707","708","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104039","6.327","","7.377","","6.2","","90","","109.05","","90","","273.532","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","Hf Cl4","","- Cl4 Hf -","- Cl4 Hf -","- Cl8 Hf2 -","2","0.5","","Niewa, R.; Jacobs, H.","Crysta structure of hafnium(IV) chloride, Hf Cl4","Zeitschrift fuer Kristallographie (149,1979-)","1995","210","","687","687","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104805","14.258","0.003","7.1056","0.0013","17.589","0.003","90","","113.672","0.003","90","","1632","0.5","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C32 H32 Mn N8 O10 -","- C32 H32 Mn N8 O10 -","- C64 H64 Mn2 N16 O20 -","2","0.5","","Zhou, Jingjing; Xu, Wei; He, Luxiang; Xiao, Hongping","Crystal structure of tetraaqua-bis(1,4-di(1H-imidazol-1-yl)benzene-κ1 N)manganese(II) 2,3-dihydroxyterephthalate, C32H32MnN8O10","Zeitschrift für Kristallographie - New Crystal Structures","2021","236","3","701","703","10.1515/ncrs-2021-0042","","","0.71073","MoKα","","0.0374","0.0314","","","0.0976","0.1019","","","","","","1.088","","","","has coordinates","273805","2022-03-18","10:17:10",""
"8105396","16.7294","0.0005","6.4985","0.0002","7.1414","0.0002","90","","100.449","0.003","90","","763.51","0.04","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C19 H13 N O5 Zn -","- C19 H13 N O5 Zn -","- C38 H26 N2 O10 Zn2 -","2","0.5","","Fang, Hui-Long; Zhu, Li-Zhi; Li, Biao; Wang, Jun-Jie","Crystal structure of catena-poly[aqua-(μ4-4,4′-(pyridine-3,5-diyl)dibenzoato-κ4 O,O′:O′′:O′′′)zinc(II)], C19H13NO5Zn","Zeitschrift für Kristallographie - New Crystal Structures","2020","235","5","1123","1124","10.1515/ncrs-2020-0197","","","0.71073","MoKα","","0.0387","0.0297","","","0.0688","0.0732","","","","","","1.056","","","","has coordinates","275991","2022-06-13","08:09:16",""
"8105568","11.073","0.0002","5.526","0.0001","10.841","0.0002","90","","100.35","0.001","90","","652.56","0.02","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C10 H18 O6 Zn -","- C10 H18 O6 Zn -","- C20 H36 O12 Zn2 -","2","0.5","","Kang, Jaeun; Ok, Kang Min; Do, Junghwan","Crystal structure of diaqua-bis(3,3-dimethylacrylato-κ2 O,O′)zinc(II), C10H18ZnO6","Zeitschrift für Kristallographie - New Crystal Structures","2018","234","1","139","140","10.1515/ncrs-2018-0235","","","0.71073","MoKα","","0.0366","0.0318","","","0.0816","0.0842","","","","","","1.043","","","","has coordinates","276400","2022-06-29","09:46:32",""
"8105877","10.063","0.0011","9.625","0.001","18.196","0.002","90","","116.1","0.03","90","","1582.7","0.5","293","2","297","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","diaqua-bis(1,10-phenanthroline)-nickel(II) trifluoroacetate trifluoroacetic acid","","- C30 H21 F9 N4 Ni O8 -","- C30 H21 F9 N4 Ni O8 -","- C60 H42 F18 N8 Ni2 O16 -","2","0.5","","Zhang, Lan; Wang, Qiang; Ding, Wu-Xiu; Hao, Hui-Min","Crystal structure of diaqua-bis(1,10-phenanthroline κ2 N,N′)nickel(II) trifluoroacetate- trifluoroacetic acid (1/1), C30H21F9N4NiO8","Zeitschrift für Kristallographie - New Crystal Structures","2019","234","5","869","871","10.1515/ncrs-2019-0052","","","0.71073","MoKα","","0.0903","0.0511","","","0.1129","0.1261","","","","","","1.028","","","","has coordinates,has disorder","278208","2022-09-27","09:01:22",""
"8106660","13.7579","0.0008","8.5684","0.0006","19.7973","0.001","90","","96.5","0.006","90","","2318.8","0.2","288.04","0.15","288.04","0.15","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H17 N6 O4 Zn -","- C24 H18 N6 O4 Zn -","- C96 H72 N24 O16 Zn4 -","4","1","","Yu-Fang, Wang; Tai, Jun-Hui","Crystal structure of catena-poly[(μ2-3-(1H-pyrazol-4-yl)-5-(pyridin-4-yl)-1,2,4-triazole-κ N:N′)-bis(benzoato-κO)zinc(II)], C24H18N6O4Zn","Zeitschrift für Kristallographie - New Crystal Structures","2017","232","5","733","735","10.1515/ncrs-2016-0409","","x-ray","0.71073","MoKα","","0.0789","0.0521","","","0.1191","0.1297","","","","","","1.056","","","","has coordinates","280750","2023-02-02","08:35:26",""
"8107015","13.76","0.004","14.079","0.004","16.317","0.005","90","","98.604","0.006","90","","3125.5","1.6","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C26 H20 Br4 N8 Ni O3 -","- C26 H20 Br4 N8 Ni O3 -","- C104 H80 Br16 N32 Ni4 O12 -","4","1","","Meng, Jiang Ping; Liu, Xuan Lin; Xu, Qiang","Crystal structure of diaquabis(3-(3,5-dibromophenyl)-5-(pyridin-2-yl)-1,2,4-triazol-4-ido-κ2 N,N′)nickel(II) mono hydrate, C26H20Br4N8NiO3","Zeitschrift für Kristallographie - New Crystal Structures","2016","231","3","811","813","10.1515/ncrs-2015-0277","","","0.71073","MoKα","","0.2223","0.0719","","","0.1144","0.1376","","","","","","1.19","","","","has coordinates,has disorder","282258","2023-04-04","09:38:11",""
"8107034","11.8533","0.0004","7.1975","0.0003","23.549","0.0007","90","","115.181","0.002","90","","1818.14","0.12","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C42 H28 Cd N2 O17 -","- C42 H28 Cd N2 O17 -","- C84 H56 Cd2 N4 O34 -","2","0.5","","Xia, Wei; Liu, Peng-Jun; Li, Gui-Juan","Crystal structure of catena-poly-[aqua(μ2-4,4′-bipyridine-κ2 N:N′)bis(3′,5,5′-tricarboxybiphenyl-2-carboxylato-κ2 O,O′)cadmium(II)], C42H28N2O17Cd","Zeitschrift für Kristallographie - New Crystal Structures","2016","231","3","875","877","10.1515/ncrs-2015-0301","","","0.71073","MoKα","","0.024","0.022","","","0.0601","0.0615","","","","","","1.076","","","","has coordinates","282388","2023-04-05","08:26:28",""
"8107078","10.4372","0.0005","11.4647","0.0005","17.0628","0.001","90","","122.508","0.004","90","","1721.82","0.17","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C32 H44 F2 N6 Ni O11 -","- C32 H44 F2 N6 Ni O11 -","- C64 H88 F4 N12 Ni2 O22 -","2","0.5","","An, Zhe; Zhu, Ling; Zhao, Xin-Hua","Crystal structure of the catena-poly-[bis(μ2-1-ethyl-6-fluoro-4-oxo-7-(piperazin-1-yl-κN)-1,4-dihydroquinoline-3-carboxylato-κ2 O,O′)nickel(II)] 5.5 hydrate, C32H44N6NiO11F2","Zeitschrift für Kristallographie - New Crystal Structures","2016","231","4","1007","1008","10.1515/ncrs-2015-0132","","","0.71073","MoKα","","0.0834","0.0509","","","0.1227","0.138","","","","","","0.991","","","","has coordinates","282720","2023-04-19","07:33:25",""
"8107288","23.938","0.002","9.1931","0.0008","12.6327","0.001","90","","91.828","0.007","90","","2778.6","0.4","296","2","296","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C31 H32 N4 O4 -","- C31 H32 N4 O4 -","- C124 H128 N16 O16 -","4","1","","Zhang, Zhijian; Jiang, Wujiu; Zhang, Fuxing; Li, Aodian","Crystal structure of N′,N‴-((1E,2E)-1,2-diphenylethane-1,2-diylidene)bis(4-methylbenzohydrazide) – water – methanol (1/1/1), C31H32N4O4","Zeitschrift für Kristallographie - New Crystal Structures","2022","237","6","1043","1045","10.1515/ncrs-2022-0375","","","0.71073","MoKα","","0.0869","0.0544","","","0.1228","0.1388","","","","","","1.027","","","","has coordinates","284127","2023-06-01","07:19:21",""
"8107317","8.6308","0.0006","10.518","0.0006","18.6325","0.0011","90","","102.21","0.006","90","","1653.17","0.18","249.99","0.1","249.99","0.1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C20 H12 Cd N2 O5 -","- C20 H12 Cd N2 O5 -","- C80 H48 Cd4 N8 O20 -","4","1","","Zhao, Qiang; Chen, Xinyu; Huang, Guang","The crystal structure of catena-poly[(1,10-phenanthroline-κ2 N,N′)-(μ3-2-hydroxybenzene-1,3-dicarboxylato-κ5 O,O′:O″,O‴:O‴)cadmium(II)], C20H12CdN2O5","Zeitschrift für Kristallographie - New Crystal Structures","2022","237","6","1139","1141","10.1515/ncrs-2022-0389","","x-ray","0.71073","MoKα","","0.0509","0.0374","","","0.0778","0.0856","","","","","","1.048","","","","has coordinates","284409","2023-06-08","08:35:50",""
"8107468","10.894","0.002","7.9674","0.0016","16.787","0.003","90","","106.226","0.004","90","","1399","0.5","296","2","296.15","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18 H22 N6 O18 U2 -","- C18 H22 N6 O18 U2 -","- C36 H44 N12 O36 U4 -","2","0.5","","Meng, Yuning; Cai, Bin","Crystal structure of cyclo-(bis(µ2-3,3′-(1H-imidazole-3-ium-1,3-diyl)dipropionato-κ4 O,O′:O″,O″′)-dinitrato-κ2 O,O′-tetraoxido-diuranium(VI) C18H22N6O18U2","Zeitschrift für Kristallographie - New Crystal Structures","2023","238","3","463","464","10.1515/ncrs-2023-0035","","","0.71073","MoKα","","0.0392","0.0307","","","0.0698","0.0728","","","","","","1.032","","","","has coordinates","285151","2023-07-11","09:31:27",""
"8107612","14.6016","0.0014","6.2077","0.0006","12.9876","0.0011","90","","100.742","0.003","90","","1156.6","0.19","170","","170","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C4 H6 N4 O2 -","- C4 H6 N4 O2 -","- C32 H48 N32 O16 -","8","2","","Cai, Cao; Yumin, Yan; Zhiwei, Wen; Pengbao, Lian; Jianlong, Wang","The crystal structure of 5-amino-1-methyl-4-nitroimidazole, C4H6O2N4","Zeitschrift für Kristallographie - New Crystal Structures","2023","238","5","963","964","10.1515/ncrs-2023-0299","","","0.71073","MoKα","","0.11","0.0656","","","0.1278","0.1524","","","","","","1.125","","","","has coordinates","286915","2023-10-12","08:08:13",""
"9000026","8.94","","4.48","","14.59","","90","","145.43","","90","","331.566","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","Sylvanite","- Ag Au Te4 -","- Ag Au Te4 -","- Ag2 Au2 Te8 -","2","0.5","","Tunell, G.","The atomic arrangement of sylvanite","American Mineralogist","1941","26","","457","477","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:13:59",""
"9000223","4.753","","5.72","","4.968","","90","","90.08","","90","","135.066","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","Ferberite","- Fe O4 W -","- Fe O4 W -","- Fe2 O8 W2 -","2","0.5","","Escobar, C.; Cid-Dresdner H; Kittl, P.; Dumler, I.","The relation between ""light wolframite"" and common wolframite sample: light wolframite","American Mineralogist","1971","56","","489","498","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:13:59",""
"9000224","4.75","","5.72","","4.97","","90","","90.17","","90","","135.034","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","Ferberite","- Fe O4 W -","- Fe O4 W -","- Fe2 O8 W2 -","2","0.5","","Escobar, C.; Cid-Dresdner H; Kittl, P.; Dumler, I.","The relation between ""light wolframite"" and common wolframite sample: common wolframite","American Mineralogist","1971","56","","489","498","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:13:59",""
"9003096","9.942","","9.601","","9.178","","90","","101.94","","90","","857.115","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","","Alacranite","- As8 S9 -","- As8 S9 -","- As16 S18 -","2","0.5","","Bonazzi, P.; Bindi, L.; Popova, V.; Pratesi, G.; Menchetti, S.","Alacranite, As8S9: structural study of the holotype and re-assignment of the original chemical formula","American Mineralogist","2003","88","","1796","1800","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:31",""
"9004126","11.769","","6.684","","8.235","","90","","102.59","","90","","632.222","","","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","Hydroboracite","- B6 Ca H12 Mg O17 -","- B6 Ca H12 Mg O17 -","- B12 Ca2 H24 Mg2 O34 -","2","0.5","","Sabelli, C.; Stoppioni, A.","Refinement of the crystal structure of hydroboracite","The Canadian Mineralogist","1978","16","","75","80","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:36",""
"9004763","19.7942","","7.1913","","22.8835","","90","","97.828","","90","","3227.02","","","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- H14 Mo12 Na12.9 O62.8 Tl3.1 U4 -","- H13.6 Mo12 Na12.9 O62.8 Tl3.1 U4 -","- H27.2 Mo24 Na25.8 O125.6 Tl6.2 U8 -","2","0.5","","Krivovichev, S. V.; Burns, P. C.","Crystal chemistry of uranyl molybdates. VIII. Crystal structures of Na3Tl3[(UO2)(MoO4)4], Na13-xTl3+x[(UO2)(MoO4)3]4(H2O)6+x (x=0.1), Na3Tl5[(UO2)(MoO4)2]2(H2O)3 and Na2[(UO2)(MoO4)2](H2O)4 Sample 2","The Canadian Mineralogist","2003","41","","707","719","10.2113/gscanmin.41.3.707","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:50",""
"9004795","5.5558","","7.0752","","18.406","","90","","102.713","","90","","705.773","","","","","","","","","","","","Lovozero Complex, Kola Peninsula, Russia","11","P 1 2/c 1","-P 2yc","13","","","Seidozerite","- Ca0.26 F3 Fe0.32 Mg0.305 Mn0.425 Na3.91 Nb0.04 O15 Si4 Ti1.36 Zr1.38 -","- Ca0.26 F3 Fe0.32 Mg0.305 Mn0.425 Na3.91 Nb0.04 O15 Si4 Ti1.36 Zr1.38 -","- Ca0.52 F6 Fe0.64 Mg0.61 Mn0.85 Na7.82 Nb0.08 O30 Si8 Ti2.72 Zr2.76 -","2","0.5","","Christiansen, C. C.; Johnsen, O.; Makovicky, E.","Crystal chemistry of the rosenbuschite group Sample: 1993.158","The Canadian Mineralogist","2003","41","","1203","1224","10.2113/gscanmin.41.5.1203","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004911","7.154","","7.101","","18.901","","90","","92.67","","90","","959.139","","","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- As2 H16 O20 Sr U2 -","- As2 H16 O20 Sr U2 -","- As4 H32 O40 Sr2 U4 -","2","0.5","","Locock, A. J.; Burns, P. C.; Flynn, T. M.","Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet Sample: SrUAs8","The Canadian Mineralogist","2005","43","","721","733","10.2113/gscanmin.43.2.721","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37",""
"9004913","7.1548","","7.134","","21.29","","90","","104.171","","90","","1053.62","","","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","Heinrichite","- As2 Ba H20 O22 U2 -","- As2 Ba H20 O22 U2 -","- As4 Ba2 H40 O44 U4 -","2","0.5","","Locock, A. J.; Burns, P. C.; Flynn, T. M.","Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet","The Canadian Mineralogist","2005","43","","721","733","10.2113/gscanmin.43.2.721","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37",""
"9005254","4.687","","5.726","","4.92","","90","","90.85","","90","","132.027","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","Sanmartinite","- Cu0.15 O4 W Zn0.85 -","- Cu0.15 O4 W Zn0.85 -","- Cu0.3 O8 W2 Zn1.7 -","2","0.5","","Redfern, S. A. T.; Bell, A. M. T.; Henderson, M. B.; Schofield, P. F.","Rietveld study of the structural phase transition in the sanmartinite (ZnWO4)- cuproscheelite (CuWO4) solid solution Sample: x=0.85","European Journal of Mineralogy","1995","7","","1019","1028","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005694","5.608","","7.139","","18.575","","90","","102.6","","90","","725.75","","","","","","","","","","","","Langesundsfjord district, Norway","8","P 1 2/c 1","-P 2yc","13","","","Grenmarite","- Ca0.38 F2 Mn1.3 Na3.56 O16 Si4 Ti0.46 Zr2.3 -","- Ca0.38 F2 Mn1.3 Na3.56 O16 Si4 Ti0.46 Zr2.3 -","- Ca0.76 F4 Mn2.6 Na7.12 O32 Si8 Ti0.92 Zr4.6 -","2","0.5","","Bellezza, M.; Franzini, M.; Larsen, A. O.; Merlino, S.; Perchiazzi, N.","Grenmarite, a new member of the gotzenite-seidozerite-rosenbuschite group from the Langesundsfjord district, Norway: definition and crystal structure","European Journal of Mineralogy","2004","16","","971","978","10.1127/0935-1221/2004/0016-0971","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9007593","8.442","","13.025","","9.356","","90","","124.98","","90","","842.915","","","","","","","","","","","","Synthetic","1","P 1 2/c 1","-P 2yc","13","","","Rosickyite","- S8 -","- S8 -","- S32 -","4","1","","Watanabe, Y.","The crystal structure of monoclinic gamma-sulfur","Acta Crystallographica, Section B","1974","30","","1396","1401","10.1107/S0567740874004961","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007886","8.455","","13.052","","9.267","","90","","124.89","","90","","838.836","","","","","","","","","","","","Synthetic","1","P 1 2/c 1","-P 2yc","13","","","Rosickyite","- S8 -","- S8 -","- S32 -","4","1","","Gallacher, A. C.; Pinkerton, A. A.","A redetermination of monoclinic gamma-sulfur Note: known as gamma sulfur","Acta Crystallographica, Section C","1993","49","","125","126","10.1107/S0108270192009661","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9008124","4.73","","5.703","","4.952","","90","","90","","90","","133.581","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","Ferberite","- Fe O4 W -","- Fe O4 W -","- Fe2 O8 W2 -","2","0.5","","Ulku, D.","Untersuchungen zur kristallstruktur und magnetischen struktur des ferberits FeWO4","Zeitschrift fur Kristallographie","1967","124","","192","219","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008131","4.82","","5.76","","4.97","","90","","89.12","","90","","137.967","","","","4.2","","","","","","","","Henderson, North Carolina, USA","4","P 1 2/c 1","-P 2yc","13","","","Hubnerite","- Fe0.03 Mn0.97 O4 W -","- Fe0.03 Mn0.97 O4 W -","- Fe0.06 Mn1.94 O8 W2 -","2","0.5","","Dachs, H.; Stoll, E.; Weitzel, H.","Kristallstruktur und magnetische ordnung des hubnerits, MnWO4 Note: T = 4.2 K","Zeitschrift fur Kristallographie","1967","125","","120","129","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9009353","10.02","","11.501","","16.286","","90","","104.22","","90","","1819.29","","","","","","","","","","","","Montalto di Castro, Viterbo, Latium, Italy","6","P 1 2/c 1","-P 2yc","13","","","Hydrocalumite","- C H44 Al4 Ca8 Cl2 O36.6 -","- C H43.2 Al4 Ca8 Cl2 O36.6 -","- C2 H86.4 Al8 Ca16 Cl4 O73.2 -","2","0.5","","Sacerdoti, M.; Passaglia, E.","Hydrocalumite from Latium, Italy: its crystal structure and relationship with related synthetic phases","Neues Jahrbuch fur Mineralogie, Monatshefte","1988","1988","","462","475","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9009446","10.448","","5.282","","11.208","","90","","116.73","","90","","552.43","","","","","","","","","","","","Salmo, British Columbia, Canada","4","P 1 2/c 1","-P 2yc","13","","","Spencerite","- H8 O13 P2 Zn4 -","- H8 O13 P2 Zn4 -","- H16 O26 P4 Zn8 -","2","0.5","","Fanfani, L.; Nunzi, A.; Zanazzi, P. F.","Structure and twinning in spencerite","Mineralogical Magazine","1972","38","","687","692","10.1180/minmag.1972.038.298.05","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:47",""
"9009977","4.93","","6.772","","5.859","","90","","96.07","","90","","194.512","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","Schultenite","- As H O4 Pb -","- As H O4 Pb -","- As2 H2 O8 Pb2 -","2","0.5","","Wilson, C. C.; Cox, P. J.; Stewart, N. S.","Structure and disorder in schultenite, lead hydrogen arsenate","Journal of Crystallographic and Spectroscopic Research","1991","21","","589","593","10.1007/BF01161081","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:33",""
"9010102","27.562","","5.5682","","10.4662","","90","","98.074","","90","","1590.33","","","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","Tyrolite","- C0.76 H24.4 As4 Ca2 Cu9 O38 -","- C0.76 H30 As4 Ca2 Cu9 O38 -","- C1.52 H60 As8 Ca4 Cu18 O76 -","2","0.5","","Krivovichev, S. V.; Chernyshov, D. Y.; Dobelin, N.; Armbruster, T.; Kahlenberg, V.; Kaindl, R.; Tessadri, R.; Kaltenhauser, G.","Crystal chemistry and polytypism of tyrolite Sample: Brixlegg, Schwaz, Tyrol, Austria Note: Tyrolite-1M polytype","American Mineralogist","2006","91","","1378","1384","10.2138/am.2006.2040","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9011112","8.04","","6.69","","7.95","","90","","104.9","","90","","413.233","","","","","","","","","","","","Synthetic","4","P 1 2/c 1","-P 2yc","13","","","Hexahydroborite","- B2 Ca H12 O10 -","- B2 Ca H12 O10 -","- B4 Ca2 H24 O20 -","2","0.5","","Sedlacek, P.; Dornberger-Schiff K","An OD-Disordered modification of the calcium monoborate dihydrate Ca[B(OH)4]2*2H2O Sample: MDO (2)","Acta Crystallographica, Section B","1971","27","","1532","1541","10.1107/S0567740871004357","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9011825","20.117","","5.185","","13.978","","90","","107.07","","90","","1393.77","","","","","","","","","","","","Clara mine, Black Forest, Germany","7","P 1 2/c 1","-P 2yc","13","","","Kidwellite","- As0.476 Cu0.356 Fe9 H19 Na O38 P5.524 -","- As0.476 Cu0.356 Fe9 H17 Na O38 P5.524 -","- As0.952 Cu0.712 Fe18 H34 Na2 O76 P11.048 -","2","0.5","","Kolitsch, U.","The crystal structures of kidwellite and 'laubmannite', two complex fibrous iron phosphates","Mineralogical Magazine","2004","68","","147","165","10.1180/0026461046810177","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:11",""
"9011835","5.53","","7.1","","18.3","","90","","102.43","","90","","701.671","","","","","","","","","","","","","12","P 1 2/c 1","-P 2yc","13","","","Seidozerite","- Al0.1 Ca0.4 F2 Fe0.19 Mg0.34 Mn0.46 Na3.6 Nb0.04 O16 Si4 Ti1.26 Zr1.44 -","- Al0.1 Ca0.4 F2 Fe0.19 Mg0.34 Mn0.46 Na3.6 Nb0.04 O16 Si4 Ti1.26 Zr1.44 -","- Al0.2 Ca0.8 F4 Fe0.38 Mg0.68 Mn0.92 Na7.2 Nb0.08 O32 Si8 Ti2.52 Zr2.88 -","2","0.5","","Simonov, V. I.; Belov, N. V.","The determination of the structure of seidozerite","Soviet Physics Crystallography","1960","4","","146","157","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9011849","5.54","","7.1","","18.36","","90","","102.4","","90","","705.326","","","","","","","","","","","","Baikal area, Russia","9","P 1 2/c 1","-P 2yc","13","","","Seidozerite","- Ca1.28 F2 Fe0.42 Mn0.56 Na3.56 O16 Si4 Ti0.78 Zr1.4 -","- Ca1.28 F2 Fe0.42 Mn0.56 Na3.56 O16 Si4 Ti0.78 Zr1.4 -","- Ca2.56 F4 Fe0.84 Mn1.12 Na7.12 O32 Si8 Ti1.56 Zr2.8 -","2","0.5","","Skszat, S. M.; Simonov, V. I.","The structure of calcium seidozerite","Soviet Physics Crystallography","1966","10","","505","508","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9011877","7.303","","12.201","","14.715","","90","","91.93","","90","","1310.42","","","","","","","","","","","","Khibiny pegmatites, Kola Peninsula, Russia","5","P 1 2/c 1","-P 2yc","13","","","Clinophosinaite","- Ca2 Na6 O14 P2 Si2 -","- Ca2 Na6 O14 P2 Si2 -","- Ca8 Na24 O56 P8 Si8 -","4","1","","Krutik, V. M.; Pushcharovsky, D. Y.; Khomyakov, A. P.; Pobedimskaya, E. A.; Belov, N. V.","Anion radical of mixed type (four [S4O12] rings and P orthotetrahedra) in the structure of monoclinic fosinaite","Soviet Physics Crystallography","1980","25","","138","142","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9012650","5.627","","7.134","","18.59","","90","","102.68","","90","","728.058","","","","","","","","","","","","Burpala alkaline massif, Russia","8","P 1 2/c 1","-P 2yc","13","","","Seidozerite","- Ca0.55 F2 Mn0.85 Na3.2 O16 Si4 Ti1.15 Zr1.85 -","- Ca0.55 F2 Mn0.85 Na3.2 O16 Si4 Ti1.15 Zr1.85 -","- Ca1.1 F4 Mn1.7 Na6.4 O32 Si8 Ti2.3 Zr3.7 -","2","0.5","","Pushcharovskii D Yu; Pasero, M.; Merlino, S.; Vladykin, N. V.; Zubkova, N. V.; Gobechiya, E. R.","Crystal structure of zirconium-rich seidozerite","Crystallography Reports","2002","47","","196","200","10.1134/1.1466492","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9012837","7.9997","","6.726","","7.9693","","90","","103.8","","90","","416.419","","","","","","","","","","","","Synthetic","4","P 1 2/c 1","-P 2yc","13","","","Hexahydroborite","- B2 Ca H12 O10 -","- B2 Ca H12 O10 -","- B4 Ca2 H24 O20 -","2","0.5","","Ozol, Y.; Vimba, S.; Ievins, A.","The crystal structure of calcium monoborate Ca[B(OH)4]2*2H2O","Soviet Physics","1964","9","","22","25","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:50",""
"9013902","4.696","","5.683","","4.945","","90","","90.83","","90","","131.955","","","","","","","","100","","","","Synthetic","3","P 1 2/c 1","-P 2yc","13","","","Huanzalait","- Mg O4 W -","- Mg2 O8 W2 -","- Mg2 O8 W2 -","","","","Macavei, J.; Schulz, H.","The crystal structure of wolframite type tungstates at high pressure Note: P = 0.0001 GPa, in air","Zeitschrift fur Kristallographie","1993","207","","193","208","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013903","4.695","","5.6834","","4.9371","","90","","90.93","","90","","131.722","","","","","","","","100","","","","Synthetic","3","P 1 2/c 1","-P 2yc","13","","","Huanzalait","- Mg O4 W -","- Mg2 O8 W2 -","- Mg2 O8 W2 -","","","","Macavei, J.; Schulz, H.","The crystal structure of wolframite type tungstates at high pressure Note: P = .0001 GPa, in diamond anvil cell","Zeitschrift fur Kristallographie","1993","207","","193","208","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013904","4.66","","5.6406","","4.91","","90","","90.64","","90","","129.052","","","","","","","","3020000","","","","Synthetic","3","P 1 2/c 1","-P 2yc","13","","","Huanzalait","- Mg O4 W -","- Mg2 O8 W2 -","- Mg2 O8 W2 -","","","","Macavei, J.; Schulz, H.","The crystal structure of wolframite type tungstates at high pressure Note: P = 3.02 GPa","Zeitschrift fur Kristallographie","1993","207","","193","208","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013905","4.636","","5.6123","","4.889","","90","","90.57","","90","","127.199","","","","","","","","4860000","","","","Synthetic","3","P 1 2/c 1","-P 2yc","13","","","Huanzalait","- Mg O4 W -","- Mg2 O8 W2 -","- Mg2 O8 W2 -","","","","Macavei, J.; Schulz, H.","The crystal structure of wolframite type tungstates at high pressure Note: P = 4.86 GPa","Zeitschrift fur Kristallographie","1993","207","","193","208","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013906","4.624","","5.594","","4.88","","90","","90.56","","90","","126.223","","","","","","","","5900000","","","","Synthetic","3","P 1 2/c 1","-P 2yc","13","","","Huanzalait","- Mg O4 W -","- Mg2 O8 W2 -","- Mg2 O8 W2 -","","","","Macavei, J.; Schulz, H.","The crystal structure of wolframite type tungstates at high pressure Note: P = 5.90 GPa","Zeitschrift fur Kristallographie","1993","207","","193","208","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013907","4.83","","5.7603","","4.994","","90","","91.14","","90","","138.917","","","","","","","","100","","","","Synthetic","3","P 1 2/c 1","-P 2yc","13","","","Huebnerite","- Mn O4 W -","- Mn2 O8 W2 -","- Mn2 O8 W2 -","","","","Macavei, J.; Schulz, H.","The crystal structure of wolframite type tungstates at high pressure Note: P = 0.0001 GPa, in air","Zeitschrift fur Kristallographie","1993","207","","193","208","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013908","4.8277","","5.761","","4.997","","90","","91.14","","90","","138.951","","","","","","","","100","","","","Synthetic","3","P 1 2/c 1","-P 2yc","13","","","Huebnerite","- Mn O4 W -","- Mn2 O8 W2 -","- Mn2 O8 W2 -","","","","Macavei, J.; Schulz, H.","The crystal structure of wolframite type tungstates at high pressure Note: P = .0001 GPa, in diamond anvil cell","Zeitschrift fur Kristallographie","1993","207","","193","208","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013909","4.789","","5.7106","","4.9738","","90","","91.22","","90","","135.993","","","","","","","","2810000","","","","Synthetic","3","P 1 2/c 1","-P 2yc","13","","","Huebnerite","- Mn O4 W -","- Mn2 O8 W2 -","- Mn2 O8 W2 -","","","","Macavei, J.; Schulz, H.","The crystal structure of wolframite type tungstates at high pressure Note: P = 2.81 GPa","Zeitschrift fur Kristallographie","1993","207","","193","208","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013910","4.7766","","5.681","","4.9605","","90","","91.19","","90","","134.578","","","","","","","","5000000","","","","Synthetic","3","P 1 2/c 1","-P 2yc","13","","","Huebnerite","- Mn O4 W -","- Mn2 O8 W2 -","- Mn2 O8 W2 -","","","","Macavei, J.; Schulz, H.","The crystal structure of wolframite type tungstates at high pressure Note: P = 5.00 GPa","Zeitschrift fur Kristallographie","1993","207","","193","208","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013911","4.762","","5.66","","4.9507","","90","","91.23","","90","","133.405","","","","","","","","5930000","","","","Synthetic","3","P 1 2/c 1","-P 2yc","13","","","Huebnerite","- Mn O4 W -","- Mn2 O8 W2 -","- Mn2 O8 W2 -","","","","Macavei, J.; Schulz, H.","The crystal structure of wolframite type tungstates at high pressure Note: P = 5.93 GPa","Zeitschrift fur Kristallographie","1993","207","","193","208","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013912","5.028","","5.862","","5.067","","90","","91.5","","90","","149.294","","","","","","","","100","","","","Synthetic","3","P 1 2/c 1","-P 2yc","13","","","","- Cd O4 W -","- Cd2 O8 W2 -","- Cd2 O8 W2 -","","","","Macavei, J.; Schulz, H.","The crystal structure of wolframite type tungstates at high pressure Note: P = 0.0001 GPa, in air","Zeitschrift fur Kristallographie","1993","207","","193","208","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013913","5.031","","5.8573","","5.0709","","90","","91.5","","90","","149.378","","","","","","","","100","","","","Synthetic","3","P 1 2/c 1","-P 2yc","13","","","","- Cd O4 W -","- Cd2 O8 W2 -","- Cd2 O8 W2 -","","","","Macavei, J.; Schulz, H.","The crystal structure of wolframite type tungstates at high pressure Note: P = 0.0001 GPa, in diamond anvil cell","Zeitschrift fur Kristallographie","1993","207","","193","208","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013914","5.011","","5.804","","5.05","","90","","91.62","","90","","146.815","","","","","","","","2810000","","","","Synthetic","3","P 1 2/c 1","-P 2yc","13","","","","- Cd O4 W -","- Cd2 O8 W2 -","- Cd2 O8 W2 -","","","","Macavei, J.; Schulz, H.","The crystal structure of wolframite type tungstates at high pressure Note: P = 2.81 GPa","Zeitschrift fur Kristallographie","1993","207","","193","208","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013915","4.975","","5.765","","5.037","","90","","91.84","","90","","144.391","","","","","","","","4320000","","","","Synthetic","3","P 1 2/c 1","-P 2yc","13","","","","- Cd O4 W -","- Cd2 O8 W2 -","- Cd2 O8 W2 -","","","","Macavei, J.; Schulz, H.","The crystal structure of wolframite type tungstates at high pressure Note: P = 4.32 GPa","Zeitschrift fur Kristallographie","1993","207","","193","208","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013916","4.966","","5.72","","5.025","","90","","92.04","","90","","142.647","","","","","","","","6370000","","","","Synthetic","3","P 1 2/c 1","-P 2yc","13","","","","- Cd O4 W -","- Cd2 O8 W2 -","- Cd2 O8 W2 -","","","","Macavei, J.; Schulz, H.","The crystal structure of wolframite type tungstates at high pressure Note: P = 6.37 GPa","Zeitschrift fur Kristallographie","1993","207","","193","208","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013918","13.704","","6.576","","13.751","","90","","105.752","","90","","1192.67","","","","","","","","","","","","Yubileinaya pegmatite, Lovozero alkaline complex, Kola Peninsula, Russia","6","P 1 2/c 1","-P 2yc","13","","","Mountainite","- Ca2 H2.44 K Na2 O26 Si8 -","- Ca2 H13 K Na2 O26 Si8 -","- Ca4 H26 K2 Na4 O52 Si16 -","2","0.5","","Zubkova, N. V.; Pekov, I. V.; Pushcharovsky, D. Y.; Chukanov, N. V.","The crystal structure and refined formula of mountainite, KNa2Ca2[Si8O19(OH)]*6H2O Locality: Yubileinaya pegmatite, Lovozero alkaline complex, Kola Peninsula, Russia","Zeitschrift fur Kristallographie","2009","224","","389","396","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:55:07",""
"9015077","5.4206","","7.125","","29.314","","90","","94.698","","90","","1128.35","","","","","","","","","","","","Inagli massif, Yakutia, Russia","14","P 1 2/c 1","-P 2yc","13","","","Innelite","- Al0.02 Ba3.92 Ca0.1 Fe0.17 Mg0.15 Mn0.38 Na2.16 Nb0.02 O26 P0.8 S1.02 Si4 Sr0.08 Ti2.96 -","- Al0.02 Ba3.92 Ca0.1 Fe0.17 Mg0.15 Mn0.38 Na2.16 Nb0.02 O26 P0.8 S1.02 Si4 Sr0.08 Ti2.96 -","- Al0.04 Ba7.84 Ca0.2 Fe0.34 Mg0.3 Mn0.76 Na4.32 Nb0.04 O52 P1.6 S2.04 Si8 Sr0.16 Ti5.92 -","2","0.5","","Sokolova, E.; Camara, F.; Hawthorne, F. C.","From structure topology to chemical composition. XI. Titanium silicates: crystal structures of innelite-1T and innelite-2M from the Inagli massif, Yakutia, Russia, and the crystal chemistry of innelite Note: this is the polytype innelite-2M","Mineralogical Magazine","2011","75","","2495","2518","10.1180/minmag.2011.075.4.2495","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:10",""
"9015083","4.68","","5.66","","4.92","","90","","89.67","","90","","130.323","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","","","- Mg W -","- Mg2 W2 -","- Mg2 W2 -","","","","Broch, E.","Untersuchungen ueber Kristallstrukturen des Wolframittypus und des Scheelittypus _cod_database_code 1010642","Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo","1929","1","","1","618","","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9016292","4.784","","5.693","","5.12","","90","","91.15","","90","","139.417","","","","","","","","","","","","the Heftetjern pegmatite, Tordal, Norway","8","P 1 2/c 1","-P 2yc","13","","","Heftetjernite","- Fe0.07 Mn0.18 Nb0.42 O4 Sc0.5 Sn0.2 Ta0.58 Ti0.05 -","- Fe0.14 Mn0.36 Nb0.84 O8 Sc Sn0.4 Ta1.16 Ti0.1 -","- Fe0.14 Mn0.36 Nb0.84 O8 Sc Sn0.4 Ta1.16 Ti0.1 -","","","","Kolitsch, U.; Kristiansen, R.; Raade, G.; Tillmanns, E.","Heftetjernite, a new scandium mineral from the Heftetjern pegmatite, Tordal, Norway","European Journal of Mineralogy","2010","22","","309","316","10.1127/0935-1221/2010/0022-1987","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9016439","9.9342","","9.5566","","9.1104","","90","","102.397","","90","","844.749","","","","","","","","","","","","Synthetic","2","P 1 2/c 1","-P 2yc","13","","","Alacranite","- As8 S9 -","- As16 S18 -","- As16 S18 -","","","","Zoppi, M.; Pratesi, G.","The dual behavior of the beta-As4S4 altered by light","American Mineralogist","2012","97","","890","896","10.2138/am.2012.3968","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9017093","11.22955","","5.1396","","11.7514","","90","","141.312","","90","","423.952","","","","","","","","100","","","","Aracuai pegmatite district, Minas Gerais, Brazil","4","P 1 2/c 1","-P 2yc","13","","","Petalite","- Al Li O10 Si4 -","- Al2 Li2 O20 Si8 -","- Al2 Li2 O20 Si8 -","","","","Ross, N. L.; Zhao, J.; Slebodnick, C.; Spencer, E. C.; Chakoumakos, B. C.","Petalite under pressure: Elastic behavior and phase stability Note: P = 0.0001 GPa","American Mineralogist","2015","100","","714","721","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:21",""
"9017094","11.2067","","5.1228","","11.716","","90","","141.243","","90","","421.069","","","","","","","","320000","","","","Aracuai pegmatite district, Minas Gerais, Brazil","4","P 1 2/c 1","-P 2yc","13","","","Petalite","- Al Li O10 Si4 -","- Al2 Li2 O20 Si8 -","- Al2 Li2 O20 Si8 -","","","","Ross, N. L.; Zhao, J.; Slebodnick, C.; Spencer, E. C.; Chakoumakos, B. C.","Petalite under pressure: Elastic behavior and phase stability Note: P = 0.32 GPa","American Mineralogist","2015","100","","714","721","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:21",""
"9017095","11.1895","","5.11","","11.6872","","90","","141.19","","90","","418.826","","","","","","","","560000","","","","Aracuai pegmatite district, Minas Gerais, Brazil","4","P 1 2/c 1","-P 2yc","13","","","Petalite","- Al Li O10 Si4 -","- Al2 Li2 O20 Si8 -","- Al2 Li2 O20 Si8 -","","","","Ross, N. L.; Zhao, J.; Slebodnick, C.; Spencer, E. C.; Chakoumakos, B. C.","Petalite under pressure: Elastic behavior and phase stability Note: P = 0.56 GPa","American Mineralogist","2015","100","","714","721","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:21",""
"9017096","11.1705","","5.0963","","11.6569","","90","","141.134","","90","","416.413","","","","","","","","890000","","","","Aracuai pegmatite district, Minas Gerais, Brazil","4","P 1 2/c 1","-P 2yc","13","","","Petalite","- Al Li O10 Si4 -","- Al2 Li2 O20 Si8 -","- Al2 Li2 O20 Si8 -","","","","Ross, N. L.; Zhao, J.; Slebodnick, C.; Spencer, E. C.; Chakoumakos, B. C.","Petalite under pressure: Elastic behavior and phase stability Note: P = 0.89 GPa","American Mineralogist","2015","100","","714","721","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:21",""
"9017097","11.1425","","5.0723","","11.6092","","90","","141.074","","90","","412.257","","","","","","","","1250000","","","","Aracuai pegmatite district, Minas Gerais, Brazil","4","P 1 2/c 1","-P 2yc","13","","","Petalite","- Al Li O10 Si4 -","- Al2 Li2 O20 Si8 -","- Al2 Li2 O20 Si8 -","","","","Ross, N. L.; Zhao, J.; Slebodnick, C.; Spencer, E. C.; Chakoumakos, B. C.","Petalite under pressure: Elastic behavior and phase stability Note: P = 1.25 GPa","American Mineralogist","2015","100","","714","721","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:21",""
"9017098","10.8301","","5.053","","33.59","","90","","140.665","","90","","1165.15","","","","","","","","2710000","","","","Aracuai pegmatite district, Minas Gerais, Brazil","4","P 1 2/c 1","-P 2yc","13","","","Petalite-beta","- Al3 Li3 O30 Si12 -","- Al6 Li6 O60 Si24 -","- Al6 Li6 O60 Si24 -","","","","Ross, N. L.; Zhao, J.; Slebodnick, C.; Spencer, E. C.; Chakoumakos, B. C.","Petalite under pressure: Elastic behavior and phase stability Note: P = 2.71 GPa","American Mineralogist","2015","100","","714","721","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:21",""
"9017197","13.9043","","4.9765","","23.5855","","90","","90.209","","90","","1631.98","","","","","","","","","","","","Tolbachik volcano, Kamchatka, Russia","8","P 1 2/c 1","-P 2yc","13","","","Parawulffite","- Cs0.14 Cu7.95 K4.75 Na2.95 O36 Rb0.25 S8 Zn0.04 -","- Cs0.28 Cu15.9 K9.5 Na5.89998 O72 Rb0.5 S16 Zn0.08 -","- Cs0.28 Cu15.9 K9.5 Na5.89998 O72 Rb0.5 S16 Zn0.08 -","","","","Pekov, I. V.; Zubkova, N. V.; Yapaskurt, V. O.; Belakovskiy, D. I.; Chukanov, N. V.; Lykova, I. S.; Savelyev, D. P.; Sidorov, E. G.; Pushcharovsky, D. Y.","Wulffite, K3NaCu4O2(SO4)4, and parawulffite, K5Na3Cu8O4(SO4)8, two new minerals from fumarole sublimates of the Tolbachik volcano, Kamchatka, Russia","The Canadian Mineralogist","2014","52","","699","716","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:32",""
"9017387","9.118","","5.676","","5.604","","90","","87","","90","","289.631","","","","","","","","","","","","Langban, Sweden","4","P 1 2/c 1","-P 2yc","13","","","Quenselite","- H Mn O3 Pb -","- H Mn O3 Pb -","- H4 Mn4 O12 Pb4 -","4","1","","Bystrom, A.","The structure of quenselite, PbMnO2OH","Arkiv for Kemi, Mineralogi och Geologi","1944","19","","1","9","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:53",""