# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2025-04-15T02:17:10+02:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Inorganica Chimica Acta') AND volume = 396 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
"1512962","10.2477","0.0003","10.492","0.0002","10.9152","0.0003","90","","111.179","0.003","90","","1094.32","0.05","120","0.1","120","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H32 Cl2 Cu N4 O8 -","- C16 H32 Cl2 Cu N4 O8 -","- C32 H64 Cl4 Cu2 N8 O16 -","2","0.5","","Neil F. Curtis; Jan Wikaira","meso-(5,7,7,12,14,14-Hexamethyl-1,4,8,11-tetraazacyclotetradec-4,11-diene) copper(II) perchlorate; an unexpected preparation and structure determination","Inorganica Chimica Acta","2013","396","","14","16","10.1016/j.ica.2012.11.027","","","1.54184","CuKα","","0.0288","0.0267","","","0.0721","0.0737","","","","","","1.051","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512963","10.9446","0.0018","13.11","0.002","10.945","","90","","90","","90","","1570.4","0.4","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C8 H16 Ba N6 O2 S2 -","- C8 H16 Ba N6 O2 S2 -","- C32 H64 Ba4 N24 O8 S8 -","4","0.5","","Wenjun Zheng; Dongming Yang","1,2,4-Triazolato barium complex: The layered polymeric planar structure with an nu2-nu2,nu1 bridging coordination","Inorganica Chimica Acta","2013","396","","21","24","10.1016/j.ica.2012.12.027","","","0.71073","MoKα","","0.0216","0.0169","","","0.0486","0.0528","","","","","","0.81","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512964","19.628","0.001","30.001","0.002","37.205","0.001","90","","90","","90","","21908.5","1.9","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C245.2 H208 N8 O23.05 U3 -","- C245.2 H208 N8 O23.05 U3 -","- C980.8 H832 N32 O92.2 U12 -","4","1","","Giovanna Brancatelli; Andrea Pappalardo; Giuseppe Trusso Sfrazzetto; Anna Notti; Silvano Geremia","Mono- and dinuclear uranyl(VI) complexes with chiral Schiff base ligand","Inorganica Chimica Acta","2013","396","","25","29","10.1016/j.ica.2012.12.034","","","0.7","synchrotron","","0.0732","0.0611","","","0.16","0.171","","","","","","1.015","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1512965","7.4582","0.0002","7.4654","0.0002","41.4496","0.0012","90","","90","","90","","2307.85","0.11","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H22 N8 O10 Zn -","- C18 H22 N8 O10 Zn -","- C72 H88 N32 O40 Zn4 -","4","1","","Konstantis F. Konidaris; Maria Giouli; Catherine P. Raptopoulou; Vassilis Psycharis; Ioannis I. Verginadis; Anastasios Vasiliadis; Amalia S. Afendra; Spyridon Karkabounas; Evy Manessi-Zoupa; Theocharis C. Stamatatos","Employment of pyridyl oximes and dioximes in zinc(II) chemistry: Synthesis, structural and spectroscopic characterization, and biological evaluation","Inorganica Chimica Acta","2013","396","","49","59","10.1016/j.ica.2012.09.039","","","1.54187","CuKα","","0.097","0.0833","","","0.2051","0.2261","","","","","","1.158","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512966","7.0635","0.0001","7.0866","0.0001","50.7469","0.0012","90","","90","","90","","2540.2","0.08","180","2","180","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H26 N12 O14 Zn -","- C14 H24 N12 O14 Zn -","- C56 H96 N48 O56 Zn4 -","4","1","","Konstantis F. Konidaris; Maria Giouli; Catherine P. Raptopoulou; Vassilis Psycharis; Ioannis I. Verginadis; Anastasios Vasiliadis; Amalia S. Afendra; Spyridon Karkabounas; Evy Manessi-Zoupa; Theocharis C. Stamatatos","Employment of pyridyl oximes and dioximes in zinc(II) chemistry: Synthesis, structural and spectroscopic characterization, and biological evaluation","Inorganica Chimica Acta","2013","396","","49","59","10.1016/j.ica.2012.09.039","","","1.54178","CuKα","","0.0525","0.0475","","","0.1108","0.12","","","","","","1.051","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512967","13.0176","0.001","13.0176","0.001","19.955","0.0014","90","","90","","120","","2928.5","0.4","293","2","293","2","","","","","","","","6","P 31","P 31","144","","","","- C39 H29 O3 P S6 Zn -","- C39 H29 O3 P S6 Zn -","- C117 H87 O9 P3 S18 Zn3 -","3","1","","Suryabhan Singh; Jyotsna Chaturvedi; A.S. Aditya; N. Rajasekhar Reddy; Subrato Bhattacharya","Syntheses and structural studies of heterobimetallic thiocarboxylate complexes containing zinc and copper","Inorganica Chimica Acta","2013","396","","6","9","10.1016/j.ica.2012.11.022","","","0.71073","MoKα","","0.1834","0.086","","","0.2121","0.294","","","","","","1.003","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1512968","12.2553","0.0006","14.0872","0.0004","29.2874","0.0009","90","","90","","90","","5056.3","0.3","150","2","150","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C57 H45 Cu O3 P2 S3 Zn -","- C57 H45 Cu O3 P2 S3 Zn -","- C228 H180 Cu4 O12 P8 S12 Zn4 -","4","1","","Suryabhan Singh; Jyotsna Chaturvedi; A.S. Aditya; N. Rajasekhar Reddy; Subrato Bhattacharya","Syntheses and structural studies of heterobimetallic thiocarboxylate complexes containing zinc and copper","Inorganica Chimica Acta","2013","396","","6","9","10.1016/j.ica.2012.11.022","","","0.71073","MoKα","","0.0685","0.0501","","","0.1127","0.1186","","","","","","0.987","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512969","10.553","0.005","20.054","0.005","25.727","0.005","90","0.005","92.567","0.005","90","0.005","5439","3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C55 H47 Cu O4 P2 S6 Zn -","- C55 H47 Cu O4 P2 S6 Zn -","- C220 H188 Cu4 O16 P8 S24 Zn4 -","4","1","","Suryabhan Singh; Jyotsna Chaturvedi; A.S. Aditya; N. Rajasekhar Reddy; Subrato Bhattacharya","Syntheses and structural studies of heterobimetallic thiocarboxylate complexes containing zinc and copper","Inorganica Chimica Acta","2013","396","","6","9","10.1016/j.ica.2012.11.022","","","0.71073","MoKα","","0.0901","0.0588","","","0.1272","0.1448","","","","","","1.039","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1512970","11.1333","0.0004","10.3317","0.0003","31.2018","0.001","90","","98.1855","0.0003","90","","3552.5","0.2","88","2","88","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C37 H52 Hf N4 O2 -","- C37 H52 Hf N4 O2 -","- C148 H208 Hf4 N16 O8 -","4","1","","Diego Gonzalez-Flores; Siddappa A. Patil; Phillip A. Medina; Seth Dever; Chananate Uthaisar; Leslie W. Pineda; Mavis L. Montero; Joseph W. Ziller; Bradley D. Fahlman","Synthesis of hafnium(IV) beta-ketoiminates as potential precursors for the MOCVD of HfO2","Inorganica Chimica Acta","2013","396","","60","65","10.1016/j.ica.2012.10.002","","","0.71073","MoKα","","0.0174","0.016","","","0.0379","0.0384","","","","","","1.038","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512971","18.1654","0.0007","9.0233","0.0003","17.0661","0.0006","90","","97.7347","0.0004","90","","2771.89","0.17","88","2","88","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H40 Hf N4 O2 -","- C28 H40 Hf N4 O2 -","- C112 H160 Hf4 N16 O8 -","4","1","","Diego Gonzalez-Flores; Siddappa A. Patil; Phillip A. Medina; Seth Dever; Chananate Uthaisar; Leslie W. Pineda; Mavis L. Montero; Joseph W. Ziller; Bradley D. Fahlman","Synthesis of hafnium(IV) beta-ketoiminates as potential precursors for the MOCVD of HfO2","Inorganica Chimica Acta","2013","396","","60","65","10.1016/j.ica.2012.10.002","","","0.71073","MoKα","","0.0147","0.0134","","","0.0334","0.0339","","","","","","1.034","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512972","8.8242","0.0017","10.931","0.002","12.043","0.002","66.977","0.002","83.821","0.002","77.396","0.002","1043","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H23 Cl Cu N2 O7 -","- C19 H23 Cl Cu N2 O7 -","- C38 H46 Cl2 Cu2 N4 O14 -","2","1","","Pallab Bhowmik; Shouvik Chattopadhyay; Ashutosh Ghosh","Synthesis and structure of mono-, di- and tri-nuclear copper(II) benzoate complexes with a tridentate N2O donor Schiff base ligand","Inorganica Chimica Acta","2013","396","","66","71","10.1016/j.ica.2012.10.003","","","0.71073","MoKα","","0.0534","0.0404","","","0.1064","0.114","","","","","","1.064","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512973","13.452","0.002","17.648","0.003","7.421","0.0017","90","","108.58","0.005","90","","1669.9","0.5","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C31 H39 Cl Cu2 N4 O8 -","- C31 H39 Cl Cu2 N4 O8 -","- C62 H78 Cl2 Cu4 N8 O16 -","2","0.5","","Pallab Bhowmik; Shouvik Chattopadhyay; Ashutosh Ghosh","Synthesis and structure of mono-, di- and tri-nuclear copper(II) benzoate complexes with a tridentate N2O donor Schiff base ligand","Inorganica Chimica Acta","2013","396","","66","71","10.1016/j.ica.2012.10.003","","","0.71073","MoKα","","0.1128","0.0993","","","0.2918","0.3028","","","","","","1.13","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512974","14.0418","0.0004","25.1942","0.0006","13.883","0.0003","90","","95.696","0.001","90","","4887.2","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C45 H41 Cl Cu3 N7 O18 -","- C45 H41 Cl Cu3 N7 O18 -","- C180 H164 Cl4 Cu12 N28 O72 -","4","1","","Pallab Bhowmik; Shouvik Chattopadhyay; Ashutosh Ghosh","Synthesis and structure of mono-, di- and tri-nuclear copper(II) benzoate complexes with a tridentate N2O donor Schiff base ligand","Inorganica Chimica Acta","2013","396","","66","71","10.1016/j.ica.2012.10.003","","","0.71073","MoKα","","0.0593","0.0388","","","0.0967","0.1064","","","","","","1.021","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1512975","23.719","0.002","10.757","0.0009","16.0846","0.0013","90","","105.226","0.002","90","","3959.9","0.6","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H38 N2 O14 Zn3 -","- C36 H38 N2 O14 Zn3 -","- C144 H152 N8 O56 Zn12 -","4","0.5","","De-Yun Ma; Kuan Lu; Liang Qin; Hai-Fu Guo; Xiong-Yi Peng; Jian-Qiang Liu","Syntheses, crystal structures, substituents steric effect, luminescent and moisture-stability studies of three two-dimensional zinc-organic frameworks","Inorganica Chimica Acta","2013","396","","84","91","10.1016/j.ica.2012.10.006","","","0.71073","MoKα","","0.0507","0.0348","","","0.0885","0.1007","","","","","","1.039","","","","has coordinates","288505","2023-12-22","15:12:00",""
"1512976","11.8253","0.0018","17.268","0.003","19.299","0.003","90","","90","","90","","3940.8","1.1","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C21 H19 N3 O4 Zn -","- C21 H19 N3 O4 Zn -","- C168 H152 N24 O32 Zn8 -","8","1","","De-Yun Ma; Kuan Lu; Liang Qin; Hai-Fu Guo; Xiong-Yi Peng; Jian-Qiang Liu","Syntheses, crystal structures, substituents steric effect, luminescent and moisture-stability studies of three two-dimensional zinc-organic frameworks","Inorganica Chimica Acta","2013","396","","84","91","10.1016/j.ica.2012.10.006","","","0.71073","MoKα","","0.1186","0.0641","","","0.1718","0.2067","","","","","","1.015","","","","has coordinates","288505","2023-12-22","15:12:00",""
"1512977","8.458","0.0007","21.6474","0.0018","9.4309","0.0008","90","","109.884","0.002","90","","1623.8","0.2","296","2","296","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C32 H29 N3 O9 Zn2 -","- C32 H29 N3 O9 Zn2 -","- C64 H58 N6 O18 Zn4 -","2","0.5","","De-Yun Ma; Kuan Lu; Liang Qin; Hai-Fu Guo; Xiong-Yi Peng; Jian-Qiang Liu","Syntheses, crystal structures, substituents steric effect, luminescent and moisture-stability studies of three two-dimensional zinc-organic frameworks","Inorganica Chimica Acta","2013","396","","84","91","10.1016/j.ica.2012.10.006","","","0.71073","MoKα","","0.0432","0.0352","","","0.0976","0.1029","","","","","","1.086","","","","has coordinates","288505","2023-12-22","15:12:00",""
"1512993","11.0211","0.001","11.0211","0.001","31.958","0.006","90","","90","","120","","3361.7","0.8","","","","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C24 H48 B2 F8 N24 Ni -","- C24 H48 B2 F8 N24 Ni -","- C72 H144 B6 F24 N72 Ni3 -","3","0.166667","","Nader Hassan; Julia Stelzl; Peter Weinberger; Gabor Molnar; Azzedine Bousseksou; Frank Kubel; Kurt Mereiter; Roman Boca; Wolfgang Linert","Spectroscopic, structural and magnetic investigations of iron(II) complexes based on 1-isopropyl- and 1-isobutyl-substituted tetrazole ligands","Inorganica Chimica Acta","2013","396","","92","100","10.1016/j.ica.2012.10.007","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512994","10.8629","0.0003","10.8629","0.0003","36.4816","0.0016","90","","90","","120","","3728.2","0.2","","","","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C30 H60 B2 F8 N24 Ni -","- C30 H60 B2 F8 N24 Ni -","- C90 H180 B6 F24 N72 Ni3 -","3","0.166667","","Nader Hassan; Julia Stelzl; Peter Weinberger; Gabor Molnar; Azzedine Bousseksou; Frank Kubel; Kurt Mereiter; Roman Boca; Wolfgang Linert","Spectroscopic, structural and magnetic investigations of iron(II) complexes based on 1-isopropyl- and 1-isobutyl-substituted tetrazole ligands","Inorganica Chimica Acta","2013","396","","92","100","10.1016/j.ica.2012.10.007","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512995","8.486","0.003","10.694","0.004","11.541","0.004","74.122","0.005","68.625","0.005","68.974","0.005","898","0.6","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H20 Co K2 O12 -","- C10 H20 Co K2 O12 -","- C20 H40 Co2 K4 O24 -","2","1","","Ekaterina N. Zorina; Natalya V. Zauzolkova; Aleksei A. Sidorov; Grigory G. Aleksandrov; Anatoly S. Lermontov; Mikhail A. Kiskin; Artem S. Bogomyakov; Vladimir S. Mironov; Vladimir M. Novotortsev; Igor L. Eremenko","Novel polynuclear architectures incorporating Co2+ and K+ ions bound by dimethylmalonate anions: Synthesis, structure, and magnetic properties","Inorganica Chimica Acta","2013","396","","108","118","10.1016/j.ica.2012.10.016","","","0.71073","MoKα","","0.0361","0.0302","","","0.0735","0.076","","","","","","1.053","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1512996","22.053","0.001","28.8254","0.0014","24.7174","0.0012","90","","90.0248","0.0008","90","","15712.5","1.3","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C150 H374 Co36 K6 O226 -","- C150 H200 Co36 K6 O226 -","- C300 H400 Co72 K12 O452 -","2","0.5","","Ekaterina N. Zorina; Natalya V. Zauzolkova; Aleksei A. Sidorov; Grigory G. Aleksandrov; Anatoly S. Lermontov; Mikhail A. Kiskin; Artem S. Bogomyakov; Vladimir S. Mironov; Vladimir M. Novotortsev; Igor L. Eremenko","Novel polynuclear architectures incorporating Co2+ and K+ ions bound by dimethylmalonate anions: Synthesis, structure, and magnetic properties","Inorganica Chimica Acta","2013","396","","108","118","10.1016/j.ica.2012.10.016","","","0.71073","MoKα","","0.09","0.07","","","0.195","0.218","","","","","","0.999","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512997","18.601","0.003","17.417","0.002","14.613","0.002","90","","90.711","0.002","90","","4733.9","1.1","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H44 Br4 Ni4 O16 -","- C36 H44 Br4 Ni4 O16 -","- C144 H176 Br16 Ni16 O64 -","4","1","","Shu-Hua Zhang; Yi Dong Zhang; Hua Hong Zou; Jing Jing Guo; He Ping Li; You Song; Hong Liang","A family of cubane cobalt and nickel clusters: Syntheses, structures and magnetic properties","Inorganica Chimica Acta","2013","396","","119","125","10.1016/j.ica.2012.10.032","","","0.71073","MoKα","","0.3643","0.163","","","0.2848","0.3798","","","","","","0.966","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512998","22.447","0.002","22.447","0.002","9.628","0.001","90","","90","","90","","4851.2","0.8","173","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C40 H56 Ni4 O20 -","- C40 H56 Ni4 O20 -","- C160 H224 Ni16 O80 -","4","0.25","","Shu-Hua Zhang; Yi Dong Zhang; Hua Hong Zou; Jing Jing Guo; He Ping Li; You Song; Hong Liang","A family of cubane cobalt and nickel clusters: Syntheses, structures and magnetic properties","Inorganica Chimica Acta","2013","396","","119","125","10.1016/j.ica.2012.10.032","","","0.71073","MoKα","","0.0617","0.0358","","","0.08","0.0934","","","","","","1.069","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1512999","16.915","0.002","18.429","0.002","15.172","0.002","90","","92.376","0.002","90","","4725.4","1","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H40 Cl8 Co4 O16 -","- C36 H40 Cl8 Co4 O16 -","- C144 H160 Cl32 Co16 O64 -","4","1","","Shu-Hua Zhang; Yi Dong Zhang; Hua Hong Zou; Jing Jing Guo; He Ping Li; You Song; Hong Liang","A family of cubane cobalt and nickel clusters: Syntheses, structures and magnetic properties","Inorganica Chimica Acta","2013","396","","119","125","10.1016/j.ica.2012.10.032","","","0.71073","MoKα","","0.0679","0.0382","","","0.0922","0.1084","","","","","","1.031","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513000","22.105","0.002","22.105","0.002","9.754","0.002","90","","90","","90","","4766.1","1.2","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C40 H56 Co4 O20 -","- C40 H56 Co4 O20 -","- C160 H224 Co16 O80 -","4","0.25","","Shu-Hua Zhang; Yi Dong Zhang; Hua Hong Zou; Jing Jing Guo; He Ping Li; You Song; Hong Liang","A family of cubane cobalt and nickel clusters: Syntheses, structures and magnetic properties","Inorganica Chimica Acta","2013","396","","119","125","10.1016/j.ica.2012.10.032","","","0.71073","MoKα","","0.073","0.0538","","","0.1331","0.1478","","","","","","1.058","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513001","9.6063","0.0014","44.885","0.006","11.7452","0.0017","90","","105.927","0.002","90","","4869.9","1.2","173","2","173","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C36 H40 Cl8 Ni4 O16 -","- C36 H40 Cl8 Ni4 O16 -","- C144 H160 Cl32 Ni16 O64 -","4","1","","Shu-Hua Zhang; Yi Dong Zhang; Hua Hong Zou; Jing Jing Guo; He Ping Li; You Song; Hong Liang","A family of cubane cobalt and nickel clusters: Syntheses, structures and magnetic properties","Inorganica Chimica Acta","2013","396","","119","125","10.1016/j.ica.2012.10.032","","","0.71073","MoKα","","0.058","0.0474","","","0.1184","0.1244","","","","","","1.053","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513002","8.6046","0.0012","27.135","0.004","18.405","0.003","90","","90.415","0.003","90","","4297.2","1.1","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","copper imidazole based phoshomolybdate","","","- C18 H28 Cu Mo5 N12 O28 P2 -","- C18 H28 Cu Mo5 N12 O28 P2 -","- C72 H112 Cu4 Mo20 N48 O112 P8 -","4","1","","Jency Thomas; Dinesh Kumar; Arunachalam Ramanan","Crystallization of phosphomolybdate clusters mediated by copper azole complexes: Influence of pH and temperature","Inorganica Chimica Acta","2013","396","","126","135","10.1016/j.ica.2012.10.034","","","0.71073","MoKα","","0.0953","0.0887","","","0.1485","0.151","","","","","","1.396","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513003","14.568","0.006","21.181","0.008","16.619","0.006","90","","90","","90","","5128","3","298","2","298","2","","","","","","","","7","P n m a","-P 2ac 2n","62","copper imidazole based phoshomolybdate","","","- C27 H37 Cu2 Mo5 N18 O26 P2 -","- C27 H37 Cu2 Mo5 N18 O26 P2 -","- C108 H148 Cu8 Mo20 N72 O104 P8 -","4","0.5","","Jency Thomas; Dinesh Kumar; Arunachalam Ramanan","Crystallization of phosphomolybdate clusters mediated by copper azole complexes: Influence of pH and temperature","Inorganica Chimica Acta","2013","396","","126","135","10.1016/j.ica.2012.10.034","","","0.71073","MoKα","","0.0682","0.0576","","","0.108","0.1121","","","","","","1.342","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513004","12.8917","0.0018","18.165","0.003","16.881","0.002","90","","94.444","0.002","90","","3941.3","1","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","phoshomolybdates","","","- C15 H25 Mo5 N10 O27 P2 -","- C15 H25 Mo5 N10 O27 P2 -","- C60 H100 Mo20 N40 O108 P8 -","4","1","","Jency Thomas; Dinesh Kumar; Arunachalam Ramanan","Crystallization of phosphomolybdate clusters mediated by copper azole complexes: Influence of pH and temperature","Inorganica Chimica Acta","2013","396","","126","135","10.1016/j.ica.2012.10.034","","","0.71073","MoKα","","0.0772","0.0603","","","0.1188","0.1313","","","","","","1.412","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513005","8.8032","0.0015","23.534","0.004","20.553","0.004","90","","90","","90","","4258.1","1.3","298","2","298","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C21 H31 Cu2 Mo5 N14 O23 P2 -","- C21 H31 Cu2 Mo5 N14 O23 P2 -","- C84 H124 Cu8 Mo20 N56 O92 P8 -","4","0.5","","Jency Thomas; Dinesh Kumar; Arunachalam Ramanan","Crystallization of phosphomolybdate clusters mediated by copper azole complexes: Influence of pH and temperature","Inorganica Chimica Acta","2013","396","","126","135","10.1016/j.ica.2012.10.034","","","0.71073","MoKα","","0.1123","0.0893","","","0.1565","0.1656","","","","","","1.211","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513006","8.77","0.003","18.565","0.006","13.97","0.005","90","","107.916","0.006","90","","2164.2","1.3","298","2","298","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C21 H31 Cu2 Mo5 N14 O27 P2 -","- C21 H31 Cu2 Mo5 N14 O27 P2 -","- C42 H62 Cu4 Mo10 N28 O54 P4 -","2","0.5","","Jency Thomas; Dinesh Kumar; Arunachalam Ramanan","Crystallization of phosphomolybdate clusters mediated by copper azole complexes: Influence of pH and temperature","Inorganica Chimica Acta","2013","396","","126","135","10.1016/j.ica.2012.10.034","","","0.71073","MoKα","","0.085","0.0708","","","0.1242","0.1277","","","","","","1.582","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513007","15.141","0.002","15.335","0.002","15.446","0.003","111.197","0.002","90.176","0.003","119.109","0.002","2850","0.8","298","2","298","2","","","","","","","","8","P -1","-P 1","2","","","","- C42 H62 Cu4 Mo12 N28 Na O71 P8 -","- C42 H62 Cu4 Mo12 N28 Na O71 P8 -","- C42 H62 Cu4 Mo12 N28 Na O71 P8 -","1","0.5","","Jency Thomas; Dinesh Kumar; Arunachalam Ramanan","Crystallization of phosphomolybdate clusters mediated by copper azole complexes: Influence of pH and temperature","Inorganica Chimica Acta","2013","396","","126","135","10.1016/j.ica.2012.10.034","","","0.71073","MoKα","","0.0971","0.0827","","","0.1842","0.1906","","","","","","1.361","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513008","13.172","0.002","17.525","0.004","16.41","0.003","90","","111.64","0.005","90","","3521.1","1.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C39 H41 Cl3 Cr N O4 -","- C39 H41 Cl3 Cr N O4 -","- C156 H164 Cl12 Cr4 N4 O16 -","4","1","","Dmitry A. Kurmaev; Nicolai A. Kolosov; Svetlana Ch. Gagieva; Alexandra O. Borissova; Vladislav A. Tuskaev; Natalya M. Bravaya; Boris M. Bulychev","Coordination compounds of chromium (+3) and vanadium (+3) and (+5) with 2,6-bis(diphenylhydroxymethyl)pyridyl ligand: Synthesis and study of catalytic activity in the polymerization of ethylene","Inorganica Chimica Acta","2013","396","","136","143","10.1016/j.ica.2012.11.006","","","0.71073","MoKα","","0.2061","0.0542","","","0.0681","0.1089","","","","","","0.703","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513009","12.7934","0.0005","12.8886","0.0005","16.6146","0.0007","103.038","0.001","98.875","0.001","96.789","0.001","2603.45","0.18","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C135 H110 Cr2 N4 O9 -","- C65.5 H51 Cr N2 O4 -","- C131 H102 Cr2 N4 O8 -","2","1","","Dmitry A. Kurmaev; Nicolai A. Kolosov; Svetlana Ch. Gagieva; Alexandra O. Borissova; Vladislav A. Tuskaev; Natalya M. Bravaya; Boris M. Bulychev","Coordination compounds of chromium (+3) and vanadium (+3) and (+5) with 2,6-bis(diphenylhydroxymethyl)pyridyl ligand: Synthesis and study of catalytic activity in the polymerization of ethylene","Inorganica Chimica Acta","2013","396","","136","143","10.1016/j.ica.2012.11.006","","","0.71073","MoKα","","0.0875","0.055","","","0.089","0.0962","","","","","","1.091","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1513010","15.05","0.002","21.834","0.003","22.09","0.003","83.905","0.003","70.256","0.003","89.896","0.003","6789","1.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C39 H40 Cl2 N O4 V -","- C35 H32 Cl2 N O3 V -","- C280 H256 Cl16 N8 O24 V8 -","8","4","","Dmitry A. Kurmaev; Nicolai A. Kolosov; Svetlana Ch. Gagieva; Alexandra O. Borissova; Vladislav A. Tuskaev; Natalya M. Bravaya; Boris M. Bulychev","Coordination compounds of chromium (+3) and vanadium (+3) and (+5) with 2,6-bis(diphenylhydroxymethyl)pyridyl ligand: Synthesis and study of catalytic activity in the polymerization of ethylene","Inorganica Chimica Acta","2013","396","","136","143","10.1016/j.ica.2012.11.006","","","0.71073","MoKα","","0.2483","0.105","","","0.2066","0.2432","","","","","","0.872","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513011","10.5834","0.001","15.1756","0.001","16.0379","0.0012","90","","102.386","0.002","90","","2515.9","0.3","100","2","100","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C31 H23 Cl N O3 V -","- C31 H23 Cl N O3 V -","- C124 H92 Cl4 N4 O12 V4 -","4","1","","Dmitry A. Kurmaev; Nicolai A. Kolosov; Svetlana Ch. Gagieva; Alexandra O. Borissova; Vladislav A. Tuskaev; Natalya M. Bravaya; Boris M. Bulychev","Coordination compounds of chromium (+3) and vanadium (+3) and (+5) with 2,6-bis(diphenylhydroxymethyl)pyridyl ligand: Synthesis and study of catalytic activity in the polymerization of ethylene","Inorganica Chimica Acta","2013","396","","136","143","10.1016/j.ica.2012.11.006","","","0.71073","MoKα","","0.086","0.0576","","","0.1405","0.1546","","","","","","1","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""