# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2025-01-14T02:55:07+01:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'I 41 2 2' AND duplicateof IS NULL AND (status is NULL OR status != 'errors') AND (method is NULL OR method != 'theoretical'))
# ORDER BY file asc
file,a,siga,b,sigb,c,sigc,alpha,sigalpha,beta,sigbeta,gamma,siggamma,vol,sigvol,celltemp,sigcelltemp,diffrtemp,sigdiffrtemp,cellpressure,sigcellpressure,diffrpressure,sigdiffrpressure,thermalhist,pressurehist,compoundsource,nel,sg,sgHall,sgNumber,commonname,chemname,mineral,formula,calcformula,cellformula,Z,Zprime,acce_code,authors,title,journal,year,volume,issue,firstpage,lastpage,doi,method,radiation,wavelength,radType,radSymbol,Rall,Robs,Rref,wRall,wRobs,wRref,RFsqd,RI,gofall,gofobs,gofgt,gofref,duplicateof,optimal,status,flags,svnrevision,date,time,onhold
"1508086","15.7125","0.0003","15.7125","0.0003","47.3137","0.0014","90","","90","","90","","11680.9","0.5","293","2","293","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","","- C38 H8 Cu2 N2 O12 -","- C38 H8 Cu2 N2 O12 -","- C304 H64 Cu16 N16 O96 -","8","0.5","","Ma, Liqing; Falkowski, Joseph M.; Abney, Carter; Lin, Wenbin","A series of isoreticular chiral metal-organic frameworks as a tunable platform for asymmetric catalysis.","Nature chemistry","2010","2","10","838","846","10.1038/nchem.738","","","0.71073","MoKα","","0.0501","0.045","","","0.1267","0.1299","","","","","","0.975","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1508087","21.4169","0.0003","21.4169","0.0003","57.6768","0.0011","90","","90","","90","","26455.4","0.7","223","2","223","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C36 H26 Cu2 O12 -","- C36 H26 Cu2 O12 -","- C288 H208 Cu16 O96 -","8","0.5","","Ma, Liqing; Falkowski, Joseph M.; Abney, Carter; Lin, Wenbin","A series of isoreticular chiral metal-organic frameworks as a tunable platform for asymmetric catalysis.","Nature chemistry","2010","2","10","838","846","10.1038/nchem.738","","","1.54178","CuKα","","0.0716","0.0519","","","0.1163","0.1233","","","","","","0.856","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1508088","21.049","0.005","21.049","0.005","57.878","0.013","90","","90","","90","","25643","10","223","2","223","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C32 H16 Cu2 O12 -","- C32 H16 Cu2 O12 -","- C256 H128 Cu16 O96 -","8","0.5","","Ma, Liqing; Falkowski, Joseph M.; Abney, Carter; Lin, Wenbin","A series of isoreticular chiral metal-organic frameworks as a tunable platform for asymmetric catalysis.","Nature chemistry","2010","2","10","838","846","10.1038/nchem.738","","","0.71073","MoKα","","0.1121","0.0648","","","0.1596","0.1719","","","","","","0.849","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1508089","23.849","0.006","23.849","0.006","73.11","0.02","90","","90","","90","","41583","19","223","2","293","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C48 H26 Cu2 O12 -","- C48 H26 Cu2 O12 -","- C384 H208 Cu16 O96 -","8","0.5","","Ma, Liqing; Falkowski, Joseph M.; Abney, Carter; Lin, Wenbin","A series of isoreticular chiral metal-organic frameworks as a tunable platform for asymmetric catalysis.","Nature chemistry","2010","2","10","838","846","10.1038/nchem.738","","","1.54178","CuKα","","0.0851","0.0521","","","0.1261","0.1363","","","","","","0.891","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1508090","30.9491","0.0013","30.9491","0.0013","80.725","0.003","90","","90","","90","","77322","5","296","2","296","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C60 H32 Cu2 O12 -","- C60 H32 Cu2 O12 -","- C480 H256 Cu16 O96 -","8","0.5","","Ma, Liqing; Falkowski, Joseph M.; Abney, Carter; Lin, Wenbin","A series of isoreticular chiral metal-organic frameworks as a tunable platform for asymmetric catalysis.","Nature chemistry","2010","2","10","838","846","10.1038/nchem.738","","","1.54178","CuKα","","0.162","0.1249","","","0.3043","0.3226","","","","","","1.323","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1508091","30.7816","0.0018","30.7816","0.0018","81.603","0.005","90","","90","","90","","77319","8","296","2","296","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C56 H32 Cu2 O12 -","- C56 H32 Cu2 O12 -","- C448 H256 Cu16 O96 -","8","0.5","","Ma, Liqing; Falkowski, Joseph M.; Abney, Carter; Lin, Wenbin","A series of isoreticular chiral metal-organic frameworks as a tunable platform for asymmetric catalysis.","Nature chemistry","2010","2","10","838","846","10.1038/nchem.738","","","1.54178","CuKα","","0.1506","0.0923","","","0.2295","0.2515","","","","","","0.982","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1538401","7.94","","7.94","","4.67","","90","","90","","90","","294.414","","","","","","","","","","","","","3","I 41 2 2","I 4bw 2bw","98","","(Cd0.97 Zn0.03) As2","","- As2 Cd0.97 Zn0.03 -","- As2 Cd0.97 Zn0.03 -","- As8 Cd3.88 Zn0.12 -","4","0.25","","Mikhailov, S.G.; Marenkin, S.F.; Palkina, K.K.","Synthesis and structure of the Cd0.97 Zn0.03 As2 solid solution","Zhurnal Neorganicheskoi Khimii","2003","48","","363","365","","","","","","","","","","","","","","","","","","","","","","has coordinates","166936","2020-10-21","18:00:00",""
"1545269","9.281","0.017","9.281","0.017","22.07","0.05","90","","90","","90","","1901","7","293","2","293","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C12 H5 Cu2 N9 -","- C12 H5 Cu2 N9 -","- C48 H20 Cu8 N36 -","4","0.25","","Zhao, Nian; Li, Ping; Mu, Xin; Liu, Chuanfang; Sun, Fuxing; Zhu, Guangshan","Facile synthesis of an ultra-stable metal-organic framework with excellent acid and base resistance","Faraday Discuss.","2017","","","","","10.1039/C7FD00017K","","","0.71073","MoKα","","0.0993","0.0721","","","0.1753","0.1951","","","","","","1.056","","","","has coordinates,has disorder","192050","2020-10-21","18:00:00",""
"1548977","15.1723","0.0003","15.1723","0.0003","12.0747","0.0004","90","","90","","90","","2779.58","0.12","7","","7","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","MFM-300V3-1.4CD4","","","- C9.4 H4 D5.61 O5 V -","- C9.403 H4 D5.608 O5 V -","- C75.224 H32 D44.864 O40 V8 -","8","0.5","","Lu, Zhenzhong; Godfrey, Harry G. W.; da Silva, Ivan; Cheng, Yongqiang; Savage, Mathew; Manuel, Pascal; Rudić, Svemir; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin","Direct observation of supramolecular binding of light hydrocarbons in vanadium(iii) and (iv) metal-organic framework materials.","Chemical science","2018","9","13","3401","3408","10.1039/c8sc00330k","powder diffraction","neutron","","neutron","","","","","","","","","","1.49","","","","","","","has coordinates","228778","2020-10-21","18:00:00",""
"1548978","15.1668","0.0004","15.1668","0.0004","12.0716","0.0004","90","","90","","90","","2776.85","0.14","7","","7","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","MFM-300V3-1.5C2D6","","","- C10.63 H4 D8.95 O5 V -","- C10.984 H4 D8.952 O5 V -","- C87.872 H32 D71.616 O40 V8 -","8","0.5","","Lu, Zhenzhong; Godfrey, Harry G. W.; da Silva, Ivan; Cheng, Yongqiang; Savage, Mathew; Manuel, Pascal; Rudić, Svemir; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin","Direct observation of supramolecular binding of light hydrocarbons in vanadium(iii) and (iv) metal-organic framework materials.","Chemical science","2018","9","13","3401","3408","10.1039/c8sc00330k","powder diffraction","neutron","","neutron","","","","","","","","","","1.49","","","","","","","has coordinates","228778","2020-10-21","18:00:00",""
"1548979","15.16316","0.00015","15.16316","0.00015","12.0746","0.0002","90","","90","","90","","2776.21","0.06","7","","7","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","MFM-300V3-1.0CD4","","","- C9.01 H4 D4.06 O5 V -","- C9.0132 H4 D4.0568 O5 V -","- C72.1056 H32 D32.4544 O40 V8 -","8","0.5","","Lu, Zhenzhong; Godfrey, Harry G. W.; da Silva, Ivan; Cheng, Yongqiang; Savage, Mathew; Manuel, Pascal; Rudić, Svemir; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin","Direct observation of supramolecular binding of light hydrocarbons in vanadium(iii) and (iv) metal-organic framework materials.","Chemical science","2018","9","13","3401","3408","10.1039/c8sc00330k","powder diffraction","neutron","","neutron","","","","","","","","","","1.49","","","","","","","has coordinates","228778","2020-10-21","18:00:00",""
"1548980","15.1613","0.0003","15.1613","0.0003","12.0687","0.0003","90","","90","","90","","2774.17","0.1","7","","7","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","MFM-300(V3)-1.0C2D2","","","- C10 H4 D2 O5 V -","- C10.008 H4 D2.008 O5 V -","- C80.064 H32 D16.064 O40 V8 -","8","0.5","","Lu, Zhenzhong; Godfrey, Harry G. W.; da Silva, Ivan; Cheng, Yongqiang; Savage, Mathew; Manuel, Pascal; Rudić, Svemir; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin","Direct observation of supramolecular binding of light hydrocarbons in vanadium(iii) and (iv) metal-organic framework materials.","Chemical science","2018","9","13","3401","3408","10.1039/c8sc00330k","powder diffraction","neutron","","neutron","","","","","","","","","","1.49","","","","","","","has coordinates","228778","2020-10-21","18:00:00",""
"1548981","15.1594","0.0003","15.1594","0.0003","12.071","0.0003","90","","90","","90","","2774.01","0.1","7","","7","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","MFM-300V3-1.0C2D4","","","- C10.14 H4 D4.28 O5 V -","- C10.14 H4 D4.28 O5 V -","- C81.12 H32 D34.24 O40 V8 -","8","0.5","","Lu, Zhenzhong; Godfrey, Harry G. W.; da Silva, Ivan; Cheng, Yongqiang; Savage, Mathew; Manuel, Pascal; Rudić, Svemir; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin","Direct observation of supramolecular binding of light hydrocarbons in vanadium(iii) and (iv) metal-organic framework materials.","Chemical science","2018","9","13","3401","3408","10.1039/c8sc00330k","powder diffraction","neutron","","neutron","","","","","","","","","","1.49","","","","","","","has coordinates","228778","2020-10-21","18:00:00",""
"1548982","15.1661","0.0003","15.1661","0.0003","12.0725","0.0003","90","","90","","90","","2776.8","0.1","7","","7","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","MFM-300V3-1.0C2D6","","","- C10.07 H4 D6.2 O5 V -","- C10.068 H4 D6.204 O5 V -","- C80.544 H32 D49.632 O40 V8 -","8","0.5","","Lu, Zhenzhong; Godfrey, Harry G. W.; da Silva, Ivan; Cheng, Yongqiang; Savage, Mathew; Manuel, Pascal; Rudić, Svemir; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin","Direct observation of supramolecular binding of light hydrocarbons in vanadium(iii) and (iv) metal-organic framework materials.","Chemical science","2018","9","13","3401","3408","10.1039/c8sc00330k","powder diffraction","neutron","","neutron","","","","","","","","","","1.49","","","","","","","has coordinates","228778","2020-10-21","18:00:00",""
"1548983","15.1457","0.0004","15.1457","0.0004","12.0519","0.0004","90","","90","","90","","2764.61","0.14","7","","7","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","MFM-300V3-1.8C2D2","","","- C11.56 H4 D3.56 O5 V -","- C11.564 H4 D3.564 O5 V -","- C92.512 H32 D28.512 O40 V8 -","8","0.5","","Lu, Zhenzhong; Godfrey, Harry G. W.; da Silva, Ivan; Cheng, Yongqiang; Savage, Mathew; Manuel, Pascal; Rudić, Svemir; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin","Direct observation of supramolecular binding of light hydrocarbons in vanadium(iii) and (iv) metal-organic framework materials.","Chemical science","2018","9","13","3401","3408","10.1039/c8sc00330k","powder diffraction","neutron","","neutron","","","","","","","","","","1.49","","","","","","","has coordinates","228778","2020-10-21","18:00:00",""
"1551420","14.82958","0.000064","14.82958","0.000064","11.773164","0.000051","90","","90","","90","","2589.11","0.019","293","2","293","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C16 H20 Al2 O16 -","- C16 Al2 O22.5 -","- C64 Al8 O90 -","4","0.25","","Sihai Yang; Junliang Sun; Anibal J. Ramirez-Cuesta; Samantha K. Callear; William I. F. David; Daniel P. Anderson; Ruth Newby; Alexander J. Blake; Julia E. Parker; Chiu C. Tang; Martin Schroder","Selectivity and direct visualization of carbon dioxide and sulfur dioxide in a decorated porous host","Nature Chemistry","2012","4","","887","894","10.1038/nchem.1457","","","0.826949","","","","","","","","","","","","","","","","","","has coordinates","215958","2020-10-21","18:00:00",""
"1551421","14.824318","0.000064","14.824318","0.000064","11.805704","0.000051","90","","90","","90","","2594.43","0.019","273","2","273","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C19.2 H8 Al2 O16.4 -","- C19.1862 H8 Al2 O16.3722 -","- C76.7448 H32 Al8 O65.4888 -","4","0.25","","Sihai Yang; Junliang Sun; Anibal J. Ramirez-Cuesta; Samantha K. Callear; William I. F. David; Daniel P. Anderson; Ruth Newby; Alexander J. Blake; Julia E. Parker; Chiu C. Tang; Martin Schroder","Selectivity and direct visualization of carbon dioxide and sulfur dioxide in a decorated porous host","Nature Chemistry","2012","4","","887","894","10.1038/nchem.1457","","","0.826126","","","","","","","","","","","","","","","","","","has coordinates","215959","2020-10-21","18:00:00",""
"1551422","14.84741","0.0001","14.84741","0.0001","11.805642","0.000082","90","","90","","90","","2602.5","0.03","273","2","273","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","","- C16 H8 Al2 O18 S4 -","- C16 H8 Al2 O18 S4 -","- C64 H32 Al8 O72 S16 -","4","0.25","","Sihai Yang; Junliang Sun; Anibal J. Ramirez-Cuesta; Samantha K. Callear; William I. F. David; Daniel P. Anderson; Ruth Newby; Alexander J. Blake; Julia E. Parker; Chiu C. Tang; Martin Schroder","Selectivity and direct visualization of carbon dioxide and sulfur dioxide in a decorated porous host","Nature Chemistry","2012","4","","887","894","10.1038/nchem.1457","","","0.826126","","","","","","","","","","","","","","","","","","has coordinates","215960","2020-10-21","18:00:00",""
"1551453","14.8228","0.00013","14.8228","0.00013","11.7919","0.0001","90","","90","","90","","2590.86","0.04","","","273","","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","NOTT-300-4C2H2","- C24 H16 Al2 O10 -","- C24 H16 Al2 O10 -","- C96 H64 Al8 O40 -","4","0.25","","Sihai Yang; Anibal J. Ramirez-Cuesta; Ruth Newby; Victoria Garcia-Sakai; Pascal Manuel; Samantha K. Callear; Stuart I. Campbell; Chiu C. Tang; Martin Schroder","Supramolecular binding and separation of hydrocarbons within a functionalized porous metal-organic framework","Nature Chemistry","2015","7","","121","129","10.1038/nchem.2114","powder diffraction","x-ray","0.826126","synchrotron","","","","","","","","","0.05","","","","1.73","","","","has coordinates","216022","2020-10-21","18:00:00",""
"1551454","14.80469","0.000033","14.80469","0.000033","11.801726","0.000035","90","","90","","90","","2586.69","0.011","","","273","","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","NOTT-300-2.5C2H4","- C21 H18 Al2 O10 -","- C21.0688 H18.1376 Al2 O10 -","- C84.2752 H72.5504 Al8 O40 -","4","0.25","","Sihai Yang; Anibal J. Ramirez-Cuesta; Ruth Newby; Victoria Garcia-Sakai; Pascal Manuel; Samantha K. Callear; Stuart I. Campbell; Chiu C. Tang; Martin Schroder","Supramolecular binding and separation of hydrocarbons within a functionalized porous metal-organic framework","Nature Chemistry","2015","7","","121","129","10.1038/nchem.2114","powder diffraction","x-ray","0.826126","synchrotron","","","","","","","","","0.05","","","","2.74","","","","has coordinates","216023","2020-10-21","18:00:00",""
"1551455","14.785355","0.000083","14.785355","0.000083","11.77396","0.00015","90","","90","","90","","2573.87","0.04","","","100","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","NOTT-300 C2D2","- C21.4 H8 Al2 D5.4 O10 -","- C21.0068 H8 Al2 D5.0068 O10 -","- C84.0272 H32 Al8 D20.0272 O40 -","4","0.25","","Sihai Yang; Anibal J. Ramirez-Cuesta; Ruth Newby; Victoria Garcia-Sakai; Pascal Manuel; Samantha K. Callear; Stuart I. Campbell; Chiu C. Tang; Martin Schroder","Supramolecular binding and separation of hydrocarbons within a functionalized porous metal-organic framework","Nature Chemistry","2015","7","","121","129","10.1038/nchem.2114","powder diffraction","neutron","","ToF","","","","","","","","","0.006","","","","3.31","","","","has coordinates","216024","2020-10-21","18:00:00",""
"1551456","14.794232","0.000096","14.794232","0.000096","11.77851","0.00018","90","","90","","90","","2577.95","0.05","","","10","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","NOTT-300 C2D4","- C19.6 H8 Al2 D7.2 O10 -","- C19.6416 H8 Al2 D7.2832 O10 -","- C78.5664 H32 Al8 D29.1328 O40 -","4","0.25","","Sihai Yang; Anibal J. Ramirez-Cuesta; Ruth Newby; Victoria Garcia-Sakai; Pascal Manuel; Samantha K. Callear; Stuart I. Campbell; Chiu C. Tang; Martin Schroder","Supramolecular binding and separation of hydrocarbons within a functionalized porous metal-organic framework","Nature Chemistry","2015","7","","121","129","10.1038/nchem.2114","powder diffraction","neutron","","ToF","","","","","","","","","0.015","","","","3.83","","","","has coordinates","216025","2020-10-21","18:00:00",""
"1551457","14.79549","0.00011","14.79549","0.00011","11.77847","0.0002","90","","90","","90","","2578.38","0.05","","","10","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","NOTT-300 C2D6","- C18.6 H8 Al2 D6.8 O10 -","- C18.7776 H8 Al2 D8.3328 O10 -","- C75.1104 H32 Al8 D33.3312 O40 -","4","0.25","","Sihai Yang; Anibal J. Ramirez-Cuesta; Ruth Newby; Victoria Garcia-Sakai; Pascal Manuel; Samantha K. Callear; Stuart I. Campbell; Chiu C. Tang; Martin Schroder","Supramolecular binding and separation of hydrocarbons within a functionalized porous metal-organic framework","Nature Chemistry","2015","7","","121","129","10.1038/nchem.2114","powder diffraction","neutron","","ToF","","","","","","","","","0.014","","","","4.17","","","","has coordinates","216026","2020-10-21","18:00:00",""
"1556348","24.4616","0.0004","24.4616","0.0004","71.8721","0.0012","90","","90","","90","","43006.1","1.2","298","2","298","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","","- C48 H24 Cu2 O14 P -","- C48 H24 Cu2 O14 P -","- C384 H192 Cu16 O112 P8 -","8","0.5","","Zheng, Min; Liu, Yan; Wang, Cheng; Liu, Shubin; Lin, Wenbin","Cavity-induced enantioselectivity reversal in a chiral metal‒organic framework Brønsted acid catalyst","Chemical Science","2012","3","8","2623","","10.1039/c2sc20379k","","","1.54178","CuKα","","0.0408","0.0271","","","0.0501","0.053","","","","","","0.811","","","","has coordinates","244375","2020-10-21","18:00:00",""
"1562008","42.697","0.006","42.697","0.006","37.907","0.008","90","","90","","90","","69106","2","293","2","293","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C61 H42 O17 Zr3 -","- C61 H42 O17 Zr3 -","- C976 H672 O272 Zr48 -","16","1","","Gong, Wei; Liu, Yan; Cui, Yong","Chiral and robust Zr(IV)-based metal-organic frameworks built from spiro skeletons.","Faraday discussions","2021","231","0","168","180","10.1039/d1fd00014d","","","0.71073","MoKα","","0.1252","0.0616","","","0.156","0.2058","","","","","","0.979","","","","has coordinates","270456","2021-11-06","20:11:42",""
"1568769","16.619","0.003","16.619","0.003","31.843","0.01","90","","90","","90","","8795","4","296","2","296","2","","","","","","","","7","I 41 2 2","I 4bw 2bw","98","","","","- C28 H21 Cu F6 N8 O4 Ti -","- C28 H21 Cu F6 N8 O4 Ti -","- C224 H168 Cu8 F48 N64 O32 Ti8 -","8","0.5","","Duan, Yuefeng; Huang, Yuhang; Wang, Chongqing; Wang, Qian; Ge, Kai; Lu, Zhiyong; Wang, Huijie; Duan, Jingui; Bai, Junfeng; Jin, Wanqin","Formation and fine-tuning of metal–organic frameworks with carboxylic pincers for the recognition of a C2H2 tetramer and highly selective separation of C2H2/C2H4","Chemical Science","2023","14","17","4605","4611","10.1039/D3SC00877K","","","0.71073","MoKα","","0.1176","0.0726","","","0.1992","0.2299","","","","","","1.112","","","","has coordinates,has disorder","283194","2023-05-05","01:16:14",""
"1568770","16.567","0.002","16.567","0.002","31.995","0.009","90","","90","","90","","8782","3","296","2","296","2","","","","","","","","7","I 41 2 2","I 4bw 2bw","98","","","","- C27 H22 Cu F6 N8 O4 Ti -","- C27 H22 Cu F6 N8 O4 Ti -","- C216 H176 Cu8 F48 N64 O32 Ti8 -","8","0.5","","Duan, Yuefeng; Huang, Yuhang; Wang, Chongqing; Wang, Qian; Ge, Kai; Lu, Zhiyong; Wang, Huijie; Duan, Jingui; Bai, Junfeng; Jin, Wanqin","Formation and fine-tuning of metal–organic frameworks with carboxylic pincers for the recognition of a C2H2 tetramer and highly selective separation of C2H2/C2H4","Chemical Science","2023","14","17","4605","4611","10.1039/D3SC00877K","","","0.71073","MoKα","","0.1373","0.0706","","","0.1679","0.1887","","","","","","1.072","","","","has coordinates","283194","2023-05-05","01:16:16",""
"1568771","16.5421","0.0004","16.5421","0.0004","31.7992","0.0014","90","","90","","90","","8701.6","0.5","293","2","293","2","","","","","","","","7","I 41 2 2","I 4bw 2bw","98","","","","- C26 H28 Cu F6 N8 O8 Ti -","- C26 H28 Cu F6 N8 O8 Ti -","- C208 H224 Cu8 F48 N64 O64 Ti8 -","8","0.5","","Duan, Yuefeng; Huang, Yuhang; Wang, Chongqing; Wang, Qian; Ge, Kai; Lu, Zhiyong; Wang, Huijie; Duan, Jingui; Bai, Junfeng; Jin, Wanqin","Formation and fine-tuning of metal–organic frameworks with carboxylic pincers for the recognition of a C2H2 tetramer and highly selective separation of C2H2/C2H4","Chemical Science","2023","14","17","4605","4611","10.1039/D3SC00877K","","","0.71073","MoKα","","0.0927","0.0773","","","0.227","0.2419","","","","","","1.083","","","","has coordinates","283194","2023-05-05","01:16:16",""
"1568772","16.848","0.005","16.848","0.005","31.093","0.017","90","","90","","90","","8826","6","296","2","296","2","","","","","","","","7","I 41 2 2","I 4bw 2bw","98","","","","- C26 H20 Cu F6 N8 O4 Zr -","- C26 H20 Cu F6 N8 O4 Zr -","- C208 H160 Cu8 F48 N64 O32 Zr8 -","8","0.5","","Duan, Yuefeng; Huang, Yuhang; Wang, Chongqing; Wang, Qian; Ge, Kai; Lu, Zhiyong; Wang, Huijie; Duan, Jingui; Bai, Junfeng; Jin, Wanqin","Formation and fine-tuning of metal–organic frameworks with carboxylic pincers for the recognition of a C2H2 tetramer and highly selective separation of C2H2/C2H4","Chemical Science","2023","14","17","4605","4611","10.1039/D3SC00877K","","","0.71073","MoKα","","0.0957","0.0583","","","0.1196","0.1283","","","","","","1.041","","","","has coordinates","283194","2023-05-05","01:16:16",""
"1568773","16.748","0.01","16.748","0.01","32.24","0.05","90","","90","","90","","9043","16","296","2","296","2","","","","","","","","7","I 41 2 2","I 4bw 2bw","98","","","","- C26 H20 Cu F6 N8 O4 Ti -","- C26 H20 Cu F6 N8 O4 Ti -","- C208 H160 Cu8 F48 N64 O32 Ti8 -","8","0.5","","Duan, Yuefeng; Huang, Yuhang; Wang, Chongqing; Wang, Qian; Ge, Kai; Lu, Zhiyong; Wang, Huijie; Duan, Jingui; Bai, Junfeng; Jin, Wanqin","Formation and fine-tuning of metal–organic frameworks with carboxylic pincers for the recognition of a C2H2 tetramer and highly selective separation of C2H2/C2H4","Chemical Science","2023","14","17","4605","4611","10.1039/D3SC00877K","","","0.71073","MoKα","","0.1083","0.0604","","","0.1118","0.1211","","","","","","1.045","","","","has coordinates","283194","2023-05-05","01:16:16",""
"1568774","16.228","0.004","16.228","0.004","32.536","0.018","90","","90","","90","","8568","6","296","2","296","2","","","","","","","","7","I 41 2 2","I 4bw 2bw","98","","","","- C26 H20 Cu F6 N8 O4 Si -","- C26 H20 Cu F6 N8 O4 Si -","- C208 H160 Cu8 F48 N64 O32 Si8 -","8","0.5","","Duan, Yuefeng; Huang, Yuhang; Wang, Chongqing; Wang, Qian; Ge, Kai; Lu, Zhiyong; Wang, Huijie; Duan, Jingui; Bai, Junfeng; Jin, Wanqin","Formation and fine-tuning of metal–organic frameworks with carboxylic pincers for the recognition of a C2H2 tetramer and highly selective separation of C2H2/C2H4","Chemical Science","2023","14","17","4605","4611","10.1039/D3SC00877K","","","0.71073","MoKα","","0.1293","0.0804","","","0.1806","0.2001","","","","","","1.04","","","","has coordinates","283194","2023-05-05","01:16:16",""
"1571464","15.4846","0.0003","15.4846","0.0003","12.3372","0.0004","90","","90","","90","","2958.13","0.13","114","3","110","","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","InOF-1_110K","","- C8 H3 In O5 -","- C8 H3 In O5 -","- C64 H24 In8 O40 -","8","0.5","","Liu, Zhanning; Xing, Chengyong; Wu, Shaowen; Ma, Min; Tian, Jian","Biphenyl tetracarboxylic acid-based metal-organic frameworks: a case of topology-dependent thermal expansion.","Materials horizons","2024","11","14","3345","3351","10.1039/d3mh02185h","","","1.54184","CuKα","","0.0247","0.0241","","","0.0631","0.0638","","","","","","1.128","","","","has coordinates","293946","2024-08-05","20:09:41",""
"1571465","15.4791","0.0002","15.4791","0.0002","12.3348","0.0003","90","","90","","90","","2955.45","0.09","200.06","0.1","200","","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","InOF-1_200K","","- C8 H3 In O5 -","- C8 H3 In O5 -","- C64 H24 In8 O40 -","8","0.5","","Liu, Zhanning; Xing, Chengyong; Wu, Shaowen; Ma, Min; Tian, Jian","Biphenyl tetracarboxylic acid-based metal-organic frameworks: a case of topology-dependent thermal expansion.","Materials horizons","2024","11","14","3345","3351","10.1039/d3mh02185h","","","1.54184","CuKα","","0.0225","0.0217","","","0.0623","0.0626","","","","","","1.167","","","","has coordinates","293946","2024-08-05","20:09:42",""
"1571466","15.4819","0.0002","15.4819","0.0002","12.3361","0.0003","90","","90","","90","","2956.83","0.09","150.01","0.1","150","","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","InOF-1_150K","","- C8 H3 In O5 -","- C8 H3 In O5 -","- C64 H24 In8 O40 -","8","0.5","","Liu, Zhanning; Xing, Chengyong; Wu, Shaowen; Ma, Min; Tian, Jian","Biphenyl tetracarboxylic acid-based metal-organic frameworks: a case of topology-dependent thermal expansion.","Materials horizons","2024","11","14","3345","3351","10.1039/d3mh02185h","","","1.54184","CuKα","","0.022","0.0214","","","0.0599","0.0602","","","","","","1.158","","","","has coordinates","293946","2024-08-05","20:09:42",""
"1571467","15.4763","0.0003","15.4763","0.0003","12.3336","0.0003","90","","90","","90","","2954.09","0.11","250","0.1","250","","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","InOF-1_250K","","- C8 H3 In O5 -","- C8 H3 In O5 -","- C64 H24 In8 O40 -","8","0.5","","Liu, Zhanning; Xing, Chengyong; Wu, Shaowen; Ma, Min; Tian, Jian","Biphenyl tetracarboxylic acid-based metal-organic frameworks: a case of topology-dependent thermal expansion.","Materials horizons","2024","11","14","3345","3351","10.1039/d3mh02185h","","","1.54184","CuKα","","0.0186","0.018","","","0.0512","0.0515","","","","","","1.21","","","","has coordinates","293946","2024-08-05","20:09:42",""
"1571468","15.4711","0.0002","15.4711","0.0002","12.331","0.0003","90","","90","","90","","2951.49","0.09","350","0.1","350","","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","InOF-1_350K","","- C8 H3 In O5 -","- C8 H3 In O5 -","- C64 H24 In8 O40 -","8","0.5","","Liu, Zhanning; Xing, Chengyong; Wu, Shaowen; Ma, Min; Tian, Jian","Biphenyl tetracarboxylic acid-based metal-organic frameworks: a case of topology-dependent thermal expansion.","Materials horizons","2024","11","14","3345","3351","10.1039/d3mh02185h","","","1.54184","CuKα","","0.025","0.0219","","","0.0552","0.0565","","","","","","1.111","","","","has coordinates","293946","2024-08-05","20:09:42",""
"1571469","15.4732","0.00014","15.4732","0.00014","12.3324","0.00017","90","","90","","90","","2952.62","0.06","300.1","0.18","300.1","0.18","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","InOF-1_300K","","- C8 H3 In O5 -","- C8 H3 In O5 -","- C64 H24 In8 O40 -","8","0.5","","Liu, Zhanning; Xing, Chengyong; Wu, Shaowen; Ma, Min; Tian, Jian","Biphenyl tetracarboxylic acid-based metal-organic frameworks: a case of topology-dependent thermal expansion.","Materials horizons","2024","11","14","3345","3351","10.1039/d3mh02185h","","x-ray","1.54184","CuKα","","0.0226","0.0217","","","0.062","0.0624","","","","","","1.163","","","","has coordinates","293946","2024-08-05","20:09:42",""
"1571680","16.9122","0.0007","16.9122","0.0007","31.516","0.003","90","","90","","90","","9014.3","1","273","2","273","2","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","","- C118 H138 Cu4 F24 N32 Zr4 -","- C118 H138 Cu4 F24 N32 Zr4 -","- C236 H276 Cu8 F48 N64 Zr8 -","2","0.125","","Li, Yi; Wu, Yanxin; Zhao, Jiaxin; Duan, Jingui; Jin, Wanqin","Systemic regulation of binding sites in porous coordination polymers for ethylene purification from ternary C2 hydrocarbons.","Chemical science","2024","15","24","9318","9324","10.1039/d4sc02659d","","","0.71073","MoKα","","0.0507","0.0447","","","0.1279","0.1323","","","","","","1.127","","","","has coordinates,has disorder","292855","2024-07-05","13:56:10",""
"1571681","16.7225","0.0005","16.7225","0.0005","31.858","0.0014","90","","90","","90","","8908.8","0.5","301","2","301","2","","","","","","","","7","I 41 2 2","I 4bw 2bw","98","","","","- C29 H24 Cu F12 N8 O0 Zr -","- C29 H24 Cu F12 N8 Zr -","- C232 H192 Cu8 F96 N64 Zr8 -","8","0.5","","Li, Yi; Wu, Yanxin; Zhao, Jiaxin; Duan, Jingui; Jin, Wanqin","Systemic regulation of binding sites in porous coordination polymers for ethylene purification from ternary C2 hydrocarbons.","Chemical science","2024","15","24","9318","9324","10.1039/d4sc02659d","","","0.71073","MoKα","","0.0918","0.0713","","","0.1896","0.1967","","","","","","1.347","","","","has coordinates,has disorder","292855","2024-07-05","13:56:11",""
"1571682","16.8758","0.0002","16.8758","0.0002","31.7415","0.0011","90","","90","","90","","9039.7","0.3","293","2","293","2","","","","","","","","7","I 41 2 2","I 4bw 2bw","98","","","","- C27 H25 Cu F12 N8 O0 Zr -","- C27 H25 Cu F12 N10 Zr -","- C216 H200 Cu8 F96 N80 Zr8 -","8","0.5","","Li, Yi; Wu, Yanxin; Zhao, Jiaxin; Duan, Jingui; Jin, Wanqin","Systemic regulation of binding sites in porous coordination polymers for ethylene purification from ternary C2 hydrocarbons.","Chemical science","2024","15","24","9318","9324","10.1039/d4sc02659d","","","0.71073","MoKα","","0.0405","0.0356","","","0.1015","0.1035","","","","","","1.169","","","","has coordinates","292855","2024-07-05","13:56:11",""
"1571683","17.0131","0.0003","17.0131","0.0003","31.454","0.0013","90","","90","","90","","9104.2","0.4","296","2","296","2","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","","- C118 H124 Cu4 F24 N32 Zr4 -","- C118 H124 Cu4 F24 N32 Zr4 -","- C236 H248 Cu8 F48 N64 Zr8 -","2","0.125","","Li, Yi; Wu, Yanxin; Zhao, Jiaxin; Duan, Jingui; Jin, Wanqin","Systemic regulation of binding sites in porous coordination polymers for ethylene purification from ternary C2 hydrocarbons.","Chemical science","2024","15","24","9318","9324","10.1039/d4sc02659d","","","0.71073","MoKα","","0.0495","0.044","","","0.1393","0.144","","","","","","1.182","","","","has coordinates,has disorder","292855","2024-07-05","13:56:11",""
"1571684","17.1374","0.0009","17.1374","0.0009","31.4","0.003","90","","90","","90","","9221.9","1.1","273","2","273","2","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","","- C26 H24 Cu F6 N8 Zr -","- C26 H24 Cu F6 N8 Zr -","- C208 H192 Cu8 F48 N64 Zr8 -","8","0.5","","Li, Yi; Wu, Yanxin; Zhao, Jiaxin; Duan, Jingui; Jin, Wanqin","Systemic regulation of binding sites in porous coordination polymers for ethylene purification from ternary C2 hydrocarbons.","Chemical science","2024","15","24","9318","9324","10.1039/d4sc02659d","","","0.71073","MoKα","","0.0388","0.0337","","","0.0906","0.093","","","","","","1.072","","","","has coordinates","292855","2024-07-05","13:56:11",""
"1571685","17.105","0.003","17.105","0.003","31.249","0.011","90","","90","","90","","9143","4","273","2","273","2","","","","","","","","7","I 41 2 2","I 4bw 2bw","98","","","","- C118 H108 Cu4 F24 N32 O16 Zr4 -","- C118 H108 Cu4 F24 N32 O16 Zr4 -","- C236 H216 Cu8 F48 N64 O32 Zr8 -","2","0.125","","Li, Yi; Wu, Yanxin; Zhao, Jiaxin; Duan, Jingui; Jin, Wanqin","Systemic regulation of binding sites in porous coordination polymers for ethylene purification from ternary C2 hydrocarbons.","Chemical science","2024","15","24","9318","9324","10.1039/d4sc02659d","","","0.71073","MoKα","","0.1107","0.0662","","","0.1793","0.212","","","","","","1.116","","","","has coordinates,has disorder","292855","2024-07-05","13:56:11",""
"1571686","16.8824","0.0016","16.8824","0.0016","31.921","0.006","90","","90","","90","","9098","2","273","2","273","2","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","","- C26 H18 Cu F12 N8 Zr -","- C26 H18 Cu F12 N8 Zr -","- C208 H144 Cu8 F96 N64 Zr8 -","8","0.5","","Li, Yi; Wu, Yanxin; Zhao, Jiaxin; Duan, Jingui; Jin, Wanqin","Systemic regulation of binding sites in porous coordination polymers for ethylene purification from ternary C2 hydrocarbons.","Chemical science","2024","15","24","9318","9324","10.1039/d4sc02659d","","","0.71073","MoKα","","0.0451","0.0409","","","0.1314","0.1338","","","","","","1.064","","","","has coordinates","292855","2024-07-05","13:56:11",""
"1571687","16.9799","0.0005","16.9799","0.0005","31.1337","0.0011","90","","90","","90","","8976.4","0.5","273","2","273","2","","","","","","","","7","I 41 2 2","I 4bw 2bw","98","","","","- C118 H122 Cu4 F24 N32 O16 Zr4 -","- C118 H122 Cu4 F24 N32 O16 Zr4 -","- C236 H244 Cu8 F48 N64 O32 Zr8 -","2","0.125","","Li, Yi; Wu, Yanxin; Zhao, Jiaxin; Duan, Jingui; Jin, Wanqin","Systemic regulation of binding sites in porous coordination polymers for ethylene purification from ternary C2 hydrocarbons.","Chemical science","2024","15","24","9318","9324","10.1039/d4sc02659d","","","0.71073","MoKα","","0.0648","0.0562","","","0.1682","0.1769","","","","","","1.192","","","","has coordinates,has disorder","292855","2024-07-05","13:56:11",""
"2005463","11.49","0.002","11.49","0.002","30.906","0.003","90","","90","","90","","4080.2","1.1","153.2","","153.2","","","","","","","","","7","I 41 2 2","I 4bw 2bw","98","","","","- C30 H32 Cd F10 N6 Nb2 O2 -","- C32 H32 Cd F10 N8 Nb2 O2 -","- C128 H128 Cd4 F40 N32 Nb8 O8 -","4","0.25","BK1219","Halasyamani, P.; Willis, M. J.; Heier, K. R.; Stern, C. L.; Poeppelmeier, K. R.","[pyH^+^]~2~[CdNb~2~(py)~4~O~2~F~10~]^2{-^}","Acta Crystallographica Section C","1996","52","10","2491","2493","10.1107/S0108270196007573","","","0.7107","MoKα","","","0.0245","","","0.0289","","","","","2.35","2.35","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2009153","7.419","0.002","7.419","","19.935","0.004","90","","90","","90","","1097.3","0.4","293","","293","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","Dichlorobis(pyrimidine)cobalt(II)","","- C8 H8 Cl2 Co N4 -","- C8 H8 Cl2 Co N4 -","- C32 H32 Cl8 Co4 N16 -","4","0.25","OA1090","Hashizume, Daisuke; Takayama, Ryo; Nakayama, Kensuke; Ishida, Takayuki; Nogami, Takashi; Yasui, Masanori; Iwasaki, Fujiko","Dichlorobis(pyrimidine-<i>N</i>)cobalt(II) and its bromo derivative","Acta Crystallographica Section C","1999","55","11","1793","1797","10.1107/S0108270199009221","","","0.71073","MoKα","","0.042","0.031","","","","0.0735","","","","","","1.025","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009154","7.576","0.001","7.576","","19.889","0.002","90","","90","","90","","1141.54","0.19","293","","293","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","Dibromobis(pyrimidine)cobalt(II)","","- C8 H8 Br2 Co N4 -","- C8 H8 Br2 Co N4 -","- C32 H32 Br8 Co4 N16 -","4","0.25","OA1090","Hashizume, Daisuke; Takayama, Ryo; Nakayama, Kensuke; Ishida, Takayuki; Nogami, Takashi; Yasui, Masanori; Iwasaki, Fujiko","Dichlorobis(pyrimidine-<i>N</i>)cobalt(II) and its bromo derivative","Acta Crystallographica Section C","1999","55","11","1793","1797","10.1107/S0108270199009221","","","0.71073","MoKα","","0.0636","0.051","","","","0.1398","","","","","","1.037","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2105970","17.63","0.0005","17.63","0.0005","16.8037","0.0006","90","","90","","90","","5222.9","0.3","296","2","296","2","","","","","","","","7","I 41 2 2","I 4bw 2bw","98","","","","- C36 H54 F12 N18 O8 Rh2 Si2 -","- C36 H38 F12 N18 O8 Rh2 Si2 -","- C144 H152 F48 N72 O32 Rh8 Si8 -","4","0.25","","Jin-Long; Uemura, Kazuhiro; Ebihara, Masahiro","Assembled structures of tetrakis(biimidazole)dirhodium complexes hydrogen-bonded with common inorganic anions","Acta Crystallographica Section B","2014","70","6","1006","1019","10.1107/S2052520614021428","","","0.71069","MoKα","","0.0275","0.0269","","","0.0725","0.0731","","","","","","1.124","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2206136","13.906","0.004","13.906","0.004","16.263","0.005","90","","90","","90","","3144.9","1.6","143","2","143","2","","","","","","","","3","I 41 2 2","I 4bw 2bw","98","","syn-exo-4,7,12,15-Tetrakis(trimethylsilyl)-4,7,12,15- tetrahydro[2.2]paracyclophane","","- C28 H52 Si4 -","- C28 H52 Si4 -","- C112 H208 Si16 -","4","0.25","BT6680","Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning; Savinsky, Rainer","<i>syn</i>-<i>exo</i>-4,7,12,15-Tetrakis(trimethylsilyl)-4,7,12,15-tetrahydro[2.2]paracyclophane","Acta Crystallographica Section E","2005","61","7","o2177","o2178","10.1107/S1600536805018350","","","0.71073","MoKα","","0.0489","0.0404","","","0.1065","0.1142","","","","","","1.068","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2221414","8.2269","0.0012","8.2269","0.0012","18.103","0.004","90","","90","","90","","1225.2","0.4","293","2","293","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","poly[μ-4,4'-bipyridine-di-μ-formato-cadmium(II)]","","- C12 H10 Cd N2 O4 -","- C12 H10 Cd N2 O4 -","- C48 H40 Cd4 N8 O16 -","4","0.25","JH2074","Zhao, Li; Lin, Jian-Li; Xu, Wei; Xie, Hong-Zhen","A chiral three-dimensional network in poly[μ-4,4'-bipyridine-di-μ-formato-cadmium(II)]","Acta Crystallographica Section E","2009","65","4","m433","m434","10.1107/S1600536809009969","","","0.71073","MoKα","","0.0189","0.0177","","","0.0457","0.0464","","","","","","1.125","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2236659","7.3059","0.0002","7.3059","0.0002","47.3659","0.0016","90","","90","","90","","2528.21","0.13","100","2","100","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","<i>trans</i>-Dichloridotetrapyrazineruthenium(II) dichloromethane disolvate","","- C18 H20 Cl6 N8 Ru -","- C18 H20 Cl6 N8 Ru -","- C72 H80 Cl24 N32 Ru4 -","4","0.25","TK5139","Nesterov, Vladimir N.; Khan, Wajiha; Rangel, Alexandra E.; Smucker, Bradley W.","<i>trans</i>-Dichloridotetrapyrazineruthenium(II) dichloromethane disolvate","Acta Crystallographica Section E","2012","68","9","m1193","","10.1107/S1600536812035817","","","0.71073","MoKα","","0.0168","0.0162","","","0.0398","0.0402","","","","","","1.032","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"4001329","7.68966","0.000032","7.68966","","10.85169","0.00008","90","","90","","90","","641.67","0.005","","","","","","","","","","","","3","I 41 2 2","I 4bw 2bw","98","","","","- Bi2 Hf2 O7 -","- Bi2 Hf2 O7 -","- Bi8 Hf8 O28 -","4","0.25","","Henderson, Stuart J.; Shebanova, Olga; Hector, Andrew L.; McMillan, Paul F.; Weller, Mark T.","Structural Variations in Pyrochlore-Structured Bi2Hf2O7, Bi2Ti2O7and Bi2Hf2-xTixO7Solid Solutions as a Function of Composition and Temperature by Neutron and X-ray Diffraction and Raman Spectroscopy","Chemistry of Materials","2007","19","7","1712","","10.1021/cm062864a","powder diffraction","neutron","","","","","","","","","","0.09258","","1.24","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4030714","9.086","0.002","9.086","0.002","52.4","0.02","90","","90","","90","","4326","2","","","295","","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- Cl13 Nb6 O3 Sc -","- Cl13 Nb6 O3 Se -","- Cl104 Nb48 O24 Se8 -","8","0.5","","Cordier, S.; Perrin, C.; Sergent, M.","Structure of the first ternary oxohalide with the Nb6 cluster: ScNb6Cl13O3","European Journal of Solid State and Inorganic Chemistry","1994","31","","1049","1060","","","x-ray","0.71073","MoKα","","","0.03","","","0.04","","","","","","","","","","","has coordinates","178486","2020-10-21","18:00:00",""
"4104581","38.237","0.002","38.237","0.002","11.1753","0.0012","90","","90","","90","","16339","2","203","2","273","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","bio-MOF-1","","","- C104 H64 N20 O25 Zn8 -","- C104 H64 N20 O25 Zn8 -","- C416 H256 N80 O100 Zn32 -","4","0.25","","Jihyun An; Steven J. Geib; Nathaniel L. Rosi","Cation-Triggered Drug Release from a Porous Zinc-Adeninate Metal-Organic Framework","Journal of the American Chemical Society","2009","131","","8376","8377","10.1021/ja902972w","","","0.71073","MoKα","","0.1267","0.094","","","0.2376","0.2501","","","","","","1.528","","","","has coordinates,has disorder","178791","2020-10-21","18:00:00",""
"4108510","24.5377","0.0002","24.5377","0.0002","72.0873","0.0016","90","","90","","90","","43403.7","1.1","293","2","293","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C26 H12 Cu O6 -","- C26 H12 Cu O6 -","- C416 H192 Cu16 O96 -","16","1","","Liqing Ma; Wenbin Lin","Chirality-Controlled and Solvent-Templated Catenation Isomerism in Metal-Organic Frameworks","Journal of the American Chemical Society","2008","130","","13834","13835","10.1021/ja804944r","","","1.54178","CuKα","","0.0766","0.0598","","","0.132","0.1389","","","","","","0.998","","","","has coordinates,has disorder","178831","2020-10-21","18:00:00",""
"4108512","24.5021","0.0005","24.5021","0.0005","71.8088","0.0019","90","","90","","90","","43110.6","1.7","243","2","243","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C26 H12 Cu O6 -","- C26 H12 Cu O6 -","- C416 H192 Cu16 O96 -","16","1","","Liqing Ma; Wenbin Lin","Chirality-Controlled and Solvent-Templated Catenation Isomerism in Metal-Organic Frameworks","Journal of the American Chemical Society","2008","130","","13834","13835","10.1021/ja804944r","","","1.54178","CuKα","","0.1193","0.0844","","","0.215","0.2318","","","","","","0.891","","","","has coordinates,has disorder","178831","2020-10-21","18:00:00",""
"4109313","17.0901","0.0009","17.0901","0.0009","23.987","0.002","90","","90","","90","","7005.9","0.8","298","2","298","2","","","","","","","","7","I 41 2 2","I 4bw 2bw","98","","","","- C22 H14 Ag F6 N4 O2 Sb -","- C22 H14 Ag F6 N4 O2 Sb -","- C176 H112 Ag8 F48 N32 O16 Sb8 -","8","0.5","","Yu-Bin Dong; You-Yun Jiang; Jie Li; Jian-Ping Ma; Feng-Ling Liu; Bo Tang; Ru-Qi Huang; Stuart R. Batten","Temperature-Dependent Synthesis of Metal-Organic Frameworks Based on a Flexible Tetradentate Ligand with Bidirectional Coordination Donors","Journal of the American Chemical Society","2007","129","","4520","4521","10.1021/ja0701917","","","0.71073","MoKα","","0.0692","0.0465","","","0.0965","0.1026","","","","","","0.98","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4130217","15.49394","0.00009","15.49394","0.00009","12.31213","0.00015","90","","90","","90","","2955.68","0.04","7","","7","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","MFM-300 (In) 0.90 D2","","","- C8 H4 D1.82 In O5 -","- C8 H4 D1.818 In O5 -","- C64 H32 D14.544 In8 O40 -","8","0.5","","Savage, Mathew; da Silva, Ivan; Johnson, Mark; Carter, Joseph H.; Newby, Ruth; Suyetin, Mikhail; Besley, Elena; Manuel, Pascal; Rudić, Svemir; Fitch, Andrew N.; Murray, Claire; David, William I. F.; Yang, Sihai; Schröder, Martin","Observation of Binding and Rotation of Methane and Hydrogen within a Functional Metal-Organic Framework.","Journal of the American Chemical Society","2016","138","29","9119","9127","10.1021/jacs.6b01323","powder diffraction","neutron","","neutron","","","","","","","","","","3.38841","","","","","","","has coordinates","240735","2020-10-21","18:00:00",""
"4130218","15.49227","0.0001","15.49227","0.0001","12.31047","0.00018","90","","90","","90","","2954.64","0.05","7","","7","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","MFM-300 (In) 1.60 D2","","","- C8 H4 D3.21 In O5 -","- C8 H4 D3.206 In O5 -","- C64 H32 D25.648 In8 O40 -","8","0.5","","Savage, Mathew; da Silva, Ivan; Johnson, Mark; Carter, Joseph H.; Newby, Ruth; Suyetin, Mikhail; Besley, Elena; Manuel, Pascal; Rudić, Svemir; Fitch, Andrew N.; Murray, Claire; David, William I. F.; Yang, Sihai; Schröder, Martin","Observation of Binding and Rotation of Methane and Hydrogen within a Functional Metal-Organic Framework.","Journal of the American Chemical Society","2016","138","29","9119","9127","10.1021/jacs.6b01323","powder diffraction","neutron","","neutron","","","","","","","","","","3.88994","","","","","","","has coordinates","240735","2020-10-21","18:00:00",""
"4130219","15.48888","0.00013","15.48888","0.00013","12.30827","0.00019","90","","90","","90","","2952.82","0.06","7","","7","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","MFM-300 (In) 2.99 D2","","","- C8 H4 D5.98 In O5 -","- C8 H4 D5.978 In O5 -","- C64 H32 D47.824 In8 O40 -","8","0.5","","Savage, Mathew; da Silva, Ivan; Johnson, Mark; Carter, Joseph H.; Newby, Ruth; Suyetin, Mikhail; Besley, Elena; Manuel, Pascal; Rudić, Svemir; Fitch, Andrew N.; Murray, Claire; David, William I. F.; Yang, Sihai; Schröder, Martin","Observation of Binding and Rotation of Methane and Hydrogen within a Functional Metal-Organic Framework.","Journal of the American Chemical Society","2016","138","29","9119","9127","10.1021/jacs.6b01323","powder diffraction","neutron","","neutron","","","","","","","","","","4.18031","","","","","","","has coordinates","240735","2020-10-21","18:00:00",""
"4130220","15.48281","0.00012","15.48281","0.00012","12.3009","0.0002","90","","90","","90","","2948.74","0.06","7","","7","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","MFM-300 (In) 4.83 D2","","","- C8 H4 D9.67 In O5 -","- C8 H4 D9.67 In O5 -","- C64 H32 D77.36 In8 O40 -","8","0.5","","Savage, Mathew; da Silva, Ivan; Johnson, Mark; Carter, Joseph H.; Newby, Ruth; Suyetin, Mikhail; Besley, Elena; Manuel, Pascal; Rudić, Svemir; Fitch, Andrew N.; Murray, Claire; David, William I. F.; Yang, Sihai; Schröder, Martin","Observation of Binding and Rotation of Methane and Hydrogen within a Functional Metal-Organic Framework.","Journal of the American Chemical Society","2016","138","29","9119","9127","10.1021/jacs.6b01323","powder diffraction","neutron","","neutron","","","","","","","","","","4.66617","","","","","","","has coordinates","240735","2020-10-21","18:00:00",""
"4130221","15.49785","0.00017","15.49785","0.00017","12.3052","0.0002","90","","90","","90","","2955.5","0.07","","","7","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","MFM-300 (In) 6.08 D2","","","- C8 H4 D12.17 In O5 -","- C8 H4 D12.168 In O5 -","- C64 H32 D97.344 In8 O40 -","8","0.5","","Savage, Mathew; da Silva, Ivan; Johnson, Mark; Carter, Joseph H.; Newby, Ruth; Suyetin, Mikhail; Besley, Elena; Manuel, Pascal; Rudić, Svemir; Fitch, Andrew N.; Murray, Claire; David, William I. F.; Yang, Sihai; Schröder, Martin","Observation of Binding and Rotation of Methane and Hydrogen within a Functional Metal-Organic Framework.","Journal of the American Chemical Society","2016","138","29","9119","9127","10.1021/jacs.6b01323","powder diffraction","neutron","","neutron","","","","","","","","","","5.45194","","","","","","","has coordinates","240735","2020-10-21","18:00:00",""
"4130222","15.46363","0.00005","15.46363","0.00005","12.29044","0.0001","90","","90","","90","","2938.94","0.03","7","","7","","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","NOTT-300 (In) Desolvated","","","- C8 H4 In O5 -","- C8 H4 In O5 -","- C64 H32 In8 O40 -","8","0.5","","Savage, Mathew; da Silva, Ivan; Johnson, Mark; Carter, Joseph H.; Newby, Ruth; Suyetin, Mikhail; Besley, Elena; Manuel, Pascal; Rudić, Svemir; Fitch, Andrew N.; Murray, Claire; David, William I. F.; Yang, Sihai; Schröder, Martin","Observation of Binding and Rotation of Methane and Hydrogen within a Functional Metal-Organic Framework.","Journal of the American Chemical Society","2016","138","29","9119","9127","10.1021/jacs.6b01323","powder diffraction","neutron","","neutron","","","","","","","","","","1.89138","","","","","","","has coordinates","240736","2020-10-21","18:00:00",""
"4130223","15.46363","0.00005","15.46363","0.00005","12.29044","0.0001","90","","90","","90","","2938.94","0.03","7","","7","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","NOTT-300 (In) 1.09 CD4","","","- C9.09 H4 D4.35 In O5 -","- C9.088 H4 D4.352 In O5 -","- C72.704 H32 D34.816 In8 O40 -","8","0.5","","Savage, Mathew; da Silva, Ivan; Johnson, Mark; Carter, Joseph H.; Newby, Ruth; Suyetin, Mikhail; Besley, Elena; Manuel, Pascal; Rudić, Svemir; Fitch, Andrew N.; Murray, Claire; David, William I. F.; Yang, Sihai; Schröder, Martin","Observation of Binding and Rotation of Methane and Hydrogen within a Functional Metal-Organic Framework.","Journal of the American Chemical Society","2016","138","29","9119","9127","10.1021/jacs.6b01323","powder diffraction","neutron","","neutron","","","","","","","","","","1.88888","","","","","","","has coordinates","240736","2020-10-21","18:00:00",""
"4130224","15.43745","0.0001","15.43745","0.0001","12.2848","0.0002","90","","90","","90","","2927.65","0.05","7","","7","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","NOTT-300 (In) 2.09 CD4","","","- C10.09 H4 D8.36 In O5 -","- C10.09 H4 D8.36 In O5 -","- C80.72 H32 D66.88 In8 O40 -","8","0.5","","Savage, Mathew; da Silva, Ivan; Johnson, Mark; Carter, Joseph H.; Newby, Ruth; Suyetin, Mikhail; Besley, Elena; Manuel, Pascal; Rudić, Svemir; Fitch, Andrew N.; Murray, Claire; David, William I. F.; Yang, Sihai; Schröder, Martin","Observation of Binding and Rotation of Methane and Hydrogen within a Functional Metal-Organic Framework.","Journal of the American Chemical Society","2016","138","29","9119","9127","10.1021/jacs.6b01323","powder diffraction","neutron","","neutron","","","","","","","","","","5.11525","","","","","","","has coordinates","240736","2020-10-21","18:00:00",""
"4130225","15.5019","0.0003","15.5019","0.0003","12.306","0.0003","90","","90","","90","","2957.24","0.11","7","","7","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","NOTT-300 (In) 3.11 CD4","","","- C11.11 H4 D12.44 In O5 -","- C11.11 H4 D12.44 In O5 -","- C88.88 H32 D99.52 In8 O40 -","8","0.5","","Savage, Mathew; da Silva, Ivan; Johnson, Mark; Carter, Joseph H.; Newby, Ruth; Suyetin, Mikhail; Besley, Elena; Manuel, Pascal; Rudić, Svemir; Fitch, Andrew N.; Murray, Claire; David, William I. F.; Yang, Sihai; Schröder, Martin","Observation of Binding and Rotation of Methane and Hydrogen within a Functional Metal-Organic Framework.","Journal of the American Chemical Society","2016","138","29","9119","9127","10.1021/jacs.6b01323","powder diffraction","neutron","","neutron","","","","","","","","","","5.47246","","","","","","","has coordinates","240736","2020-10-21","18:00:00",""
"4135625","15.135","0.005","15.135","0.005","12.033","0.004","90","","90","","90","","2756.4","1.6","7","","7","","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","MFM-300-V(III)_ND3loaded","- C8 H4 D1.46 N0.49 O5 V -","- C8 H3.9998 D1.463 N0.488 O5 V -","- C64 H31.9984 D11.704 N3.904 O40 V8 -","8","0.5","","Han, Xue; Lu, Wanpeng; Chen, Yinlin; da Silva, Ivan; Li, Jiangnan; Lin, Longfei; Li, Weiyao; Sheveleva, Alena M.; Godfrey, Harry G. W.; Lu, Zhenzhong; Tuna, Floriana; McInnes, Eric J. L.; Cheng, Yongqiang; Daemen, Luke L.; McPherson, Laura J McCormick; Teat, Simon J.; Frogley, Mark D.; Rudić, Svemir; Manuel, Pascal; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin","High Ammonia Adsorption in MFM-300 Materials: Dynamics and Charge Transfer in Host-Guest Binding.","Journal of the American Chemical Society","2021","143","8","3153","3161","10.1021/jacs.0c11930","powder diffraction","","","neutron","","0.569812","","","","","","","","7.27032","","","","","","","has coordinates","262445","2021-03-04","02:53:42",""
"4135626","15.0246","0.0009","15.0246","0.0009","11.9519","0.0007","90","","90","","90","","2698","0.3","7","","7","","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","MFM-300-V(IV)_empty","- C8 H3 O5 V -","- C8 H3 O5 V -","- C64 H24 O40 V8 -","8","0.5","","Han, Xue; Lu, Wanpeng; Chen, Yinlin; da Silva, Ivan; Li, Jiangnan; Lin, Longfei; Li, Weiyao; Sheveleva, Alena M.; Godfrey, Harry G. W.; Lu, Zhenzhong; Tuna, Floriana; McInnes, Eric J. L.; Cheng, Yongqiang; Daemen, Luke L.; McPherson, Laura J McCormick; Teat, Simon J.; Frogley, Mark D.; Rudić, Svemir; Manuel, Pascal; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin","High Ammonia Adsorption in MFM-300 Materials: Dynamics and Charge Transfer in Host-Guest Binding.","Journal of the American Chemical Society","2021","143","8","3153","3161","10.1021/jacs.0c11930","powder diffraction","","","neutron","","0.480466","","","","","","","","6.52286","","","","","","","has coordinates","262445","2021-03-04","02:53:43",""
"4135627","15.1215","0.0016","15.1215","0.0016","12.0683","0.0013","90","","90","","90","","2759.5","0.5","7","","7","","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","MFM-300-V(III)_empty","- C8 H4 O5 V -","- C8 H4 O5 V -","- C64 H32 O40 V8 -","8","0.5","","Han, Xue; Lu, Wanpeng; Chen, Yinlin; da Silva, Ivan; Li, Jiangnan; Lin, Longfei; Li, Weiyao; Sheveleva, Alena M.; Godfrey, Harry G. W.; Lu, Zhenzhong; Tuna, Floriana; McInnes, Eric J. L.; Cheng, Yongqiang; Daemen, Luke L.; McPherson, Laura J McCormick; Teat, Simon J.; Frogley, Mark D.; Rudić, Svemir; Manuel, Pascal; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin","High Ammonia Adsorption in MFM-300 Materials: Dynamics and Charge Transfer in Host-Guest Binding.","Journal of the American Chemical Society","2021","143","8","3153","3161","10.1021/jacs.0c11930","powder diffraction","","","neutron","","0.801436","","","","","","","","6.18068","","","","","","","has coordinates","262445","2021-03-04","02:53:43",""
"4135628","15.5056","0.0002","15.5056","0.0002","12.339","0.0002","90","","90","","90","","2966.59","0.07","7","","7","","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","MFM-300-In_empty","- C8 H4 In O5 -","- C8 H4 In O5 -","- C64 H32 In8 O40 -","8","0.5","","Han, Xue; Lu, Wanpeng; Chen, Yinlin; da Silva, Ivan; Li, Jiangnan; Lin, Longfei; Li, Weiyao; Sheveleva, Alena M.; Godfrey, Harry G. W.; Lu, Zhenzhong; Tuna, Floriana; McInnes, Eric J. L.; Cheng, Yongqiang; Daemen, Luke L.; McPherson, Laura J McCormick; Teat, Simon J.; Frogley, Mark D.; Rudić, Svemir; Manuel, Pascal; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin","High Ammonia Adsorption in MFM-300 Materials: Dynamics and Charge Transfer in Host-Guest Binding.","Journal of the American Chemical Society","2021","143","8","3153","3161","10.1021/jacs.0c11930","powder diffraction","","","neutron","","1.26279","","","","","","","","3.24874","","","","","","","has coordinates","262445","2021-03-04","02:53:43",""
"4135629","15.102","0.002","15.102","0.002","11.9998","0.0015","90","","90","","90","","2736.8","0.6","7","","7","","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","MFM-300-Fe_ND3loaded","- C8 H3 D5.04 Fe N2.23 O5 -","- C8 H3 D5.044 Fe N2.232 O5 -","- C64 H24 D40.352 Fe8 N17.856 O40 -","8","0.5","","Han, Xue; Lu, Wanpeng; Chen, Yinlin; da Silva, Ivan; Li, Jiangnan; Lin, Longfei; Li, Weiyao; Sheveleva, Alena M.; Godfrey, Harry G. W.; Lu, Zhenzhong; Tuna, Floriana; McInnes, Eric J. L.; Cheng, Yongqiang; Daemen, Luke L.; McPherson, Laura J McCormick; Teat, Simon J.; Frogley, Mark D.; Rudić, Svemir; Manuel, Pascal; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin","High Ammonia Adsorption in MFM-300 Materials: Dynamics and Charge Transfer in Host-Guest Binding.","Journal of the American Chemical Society","2021","143","8","3153","3161","10.1021/jacs.0c11930","powder diffraction","","","neutron","","1.08245","","","","","","","","2.83652","","","","","","","has coordinates","262445","2021-03-04","02:53:43",""
"4135630","15.4911","0.0012","15.4911","0.0012","12.3275","0.0009","90","","90","","90","","2958.3","0.4","7","","7","","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","MFM-300-In_ND3loaded","- C8 H3.3 D0.88 In N0.33 O5 -","- C8 H3.3 D0.882 In N0.334 O5 -","- C64 H26.4 D7.056 In8 N2.672 O40 -","8","0.5","","Han, Xue; Lu, Wanpeng; Chen, Yinlin; da Silva, Ivan; Li, Jiangnan; Lin, Longfei; Li, Weiyao; Sheveleva, Alena M.; Godfrey, Harry G. W.; Lu, Zhenzhong; Tuna, Floriana; McInnes, Eric J. L.; Cheng, Yongqiang; Daemen, Luke L.; McPherson, Laura J McCormick; Teat, Simon J.; Frogley, Mark D.; Rudić, Svemir; Manuel, Pascal; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin","High Ammonia Adsorption in MFM-300 Materials: Dynamics and Charge Transfer in Host-Guest Binding.","Journal of the American Chemical Society","2021","143","8","3153","3161","10.1021/jacs.0c11930","powder diffraction","","","neutron","","4.12994","","","","","","","","2.30191","","","","","","","has coordinates","262445","2021-03-04","02:53:43",""
"4135631","15.09","0.03","15.09","0.03","12.01","0.03","90","","90","","90","","2735","10","7","","7","","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","MFM-300-V(IV)_ND3loaded","- C8 H3 D6.65 N2.22 O5 V -","- C8 H3 D6.648 N2.216 O5 V -","- C64 H24 D53.184 N17.728 O40 V8 -","8","0.5","","Han, Xue; Lu, Wanpeng; Chen, Yinlin; da Silva, Ivan; Li, Jiangnan; Lin, Longfei; Li, Weiyao; Sheveleva, Alena M.; Godfrey, Harry G. W.; Lu, Zhenzhong; Tuna, Floriana; McInnes, Eric J. L.; Cheng, Yongqiang; Daemen, Luke L.; McPherson, Laura J McCormick; Teat, Simon J.; Frogley, Mark D.; Rudić, Svemir; Manuel, Pascal; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin","High Ammonia Adsorption in MFM-300 Materials: Dynamics and Charge Transfer in Host-Guest Binding.","Journal of the American Chemical Society","2021","143","8","3153","3161","10.1021/jacs.0c11930","powder diffraction","","","neutron","","1.17494","","","","","","","","4.77876","","","","","","","has coordinates","262445","2021-03-04","02:53:43",""
"4319127","6.7106","0.0006","6.7106","0.0006","26.797","0.004","90","","90","","90","","1206.7","0.2","293","2","293","2","","","","","","","","3","I 41 2 2","I 4bw 2bw","98","","","","- Sb8 Ti1.13 Zr3.88 -","- Sb8 Ti1.13 Zr3.87 -","- Sb32 Ti4.52 Zr15.48 -","4","0.25","","Holger Kleinke","A Three-Dimensional Extended Sb Network in the Metallic Antimonides (M',Ti)5Sb8 (M' = Zr, Hf, Nb, Mo)","Inorganic Chemistry","2001","40","","95","100","10.1021/ic000767s","","","0.71073","MoKα","","0.0942","0.0462","","0.1198","0.1063","","","","0.91","1.069","1.069","","","","","has coordinates","179271","2020-10-21","18:00:00",""
"4319128","6.5449","0.0003","6.5449","0.0003","26.624","0.002","90","","90","","90","","1140.46","0.11","293","2","293","2","","","","","","","","3","I 41 2 2","I 4bw 2bw","98","","","","- Sb8 Ti3.9 Zr1.1 -","- Sb8 Ti3.9 Zr1.1 -","- Sb32 Ti15.6 Zr4.4 -","4","0.25","","Holger Kleinke","A Three-Dimensional Extended Sb Network in the Metallic Antimonides (M',Ti)5Sb8 (M' = Zr, Hf, Nb, Mo)","Inorganic Chemistry","2001","40","","95","100","10.1021/ic000767s","","","0.71073","MoKα","","0.0437","0.0295","","0.0681","0.0663","","","","0.858","0.991","0.991","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4319129","6.6506","0.0006","6.6506","0.0006","26.68","0.004","90","","90","","90","","1180.1","0.2","293","2","293","2","","","","","","","","3","I 41 2 2","I 4bw 2bw","98","","","","- Sb8 Ti2.38 Zr2.63 -","- Sb8 Ti2.37 Zr2.63 -","- Sb32 Ti9.48 Zr10.52 -","4","0.25","","Holger Kleinke","A Three-Dimensional Extended Sb Network in the Metallic Antimonides (M',Ti)5Sb8 (M' = Zr, Hf, Nb, Mo)","Inorganic Chemistry","2001","40","","95","100","10.1021/ic000767s","","","0.71073","MoKα","","0.0847","0.0482","","0.1163","0.1077","","","","0.757","0.95","0.95","","","","","has coordinates","179271","2020-10-21","18:00:00",""
"4319130","6.6137","0.0007","6.6137","0.0007","26.85","0.005","90","","90","","90","","1174.4","0.3","293","2","293","2","","","","","","","","3","I 41 2 2","I 4bw 2bw","98","","","","- Hf2.58 Sb8 Ti2.42 -","- Hf2.608 Sb8 Ti2.392 -","- Hf10.432 Sb32 Ti9.568 -","4","0.25","","Holger Kleinke","A Three-Dimensional Extended Sb Network in the Metallic Antimonides (M',Ti)5Sb8 (M' = Zr, Hf, Nb, Mo)","Inorganic Chemistry","2001","40","","95","100","10.1021/ic000767s","","","0.71073","MoKα","","0.1119","0.0291","","0.0463","0.0365","","","","0.485","0.655","0.655","","","","","has coordinates","179271","2020-10-21","18:00:00",""
"4321799","11.339","0.002","11.339","0.002","30.489","0.006","90","","90","","90","","3920.1","1.2","153.2","","153.2","","","","","","","","hydro(solvo)thermal synthesis","7","I 41 2 2","I 4bw 2bw","98","","","","- C30 H32 Cu F8 N6 O4 W2 -","- C28 H18 Cu0.25 F7 N4 O3 W -","- C112 H72 Cu F28 N16 O12 W4 -","4","0.25","","Kevin R. Heier; Alexander J. Norquist; P. Shiv Halasyamani; Angel Duarte; Charlotte L. Stern; Kenneth R. Poeppelmeier","The Polar [WO2F4]2- Anion in the Solid State","Inorganic Chemistry","1999","38","","762","767","10.1021/ic980863h","","","0.7107","MoKα","","0.0364","0.036","","0.029","","0.029","","","1.461","","","1.46","","","","has coordinates","134363","2020-10-21","18:00:00",""
"4322231","17.4716","0.0013","17.4716","0.0013","26.435","0.004","90","","90","","90","","8069.5","1.5","158","","158","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","","- C70 H98 Cl12 N8 Os3 -","- C70 H60 Cl12 N8 Os3 -","- C280 H240 Cl48 N32 Os12 -","4","0.25","","Claire Newton; Kimberly D. Edwards; Joseph W. Ziller; Nancy M. Doherty","Electron-Rich Nitrido-Bridged Complexes. Structure and Bonding in Triosmium Dinitrido Compounds","Inorganic Chemistry","1999","38","","4032","4037","10.1021/ic981257p","","","0.71073","MoKα","","0.0406","0.0325","","0.085","0.0815","","","","1.119","1.143","1.143","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4323786","11.408","0.003","11.408","0.003","30.36","0.01","90","","90","","90","","3951","2","153.2","","153.2","","","","","","","","hydro(solvato)thermal synthesis","7","I 41 2 2","I 4bw 2bw","98","","","","- C30 H32 Cu F10 N6 Nb2 O2 -","- C32 H32 Cu F10 N8 Nb2 O2 -","- C128 H128 Cu4 F40 N32 Nb8 O8 -","4","0.25","","Paramasivan Halasyamani; Michael J. Willis; Charlotte L. Stern; Paul M. Lundquist; George K. Wong; Kenneth R. Poeppelmeier","Composition Space of the (CuO,1/2Nb~2~O~5~)/(HF)~x~.pyridine/H~2~O System. Structure and Synthesis of [pyH^+^]~2-~[CuNb~2~(py)~4~O~2~F~10~]^2+^ and CuNb(py)~4~OF~5~","Inorganic Chemistry","1996","35","","1367","1371","10.1021/ic951189w","","","0.7107","MoKalpha","","","0.043","","","0.044","","","","","2.424","2.424","","","","","has coordinates","179340","2020-10-21","18:00:00",""
"4344742","15.1675","0.0009","15.1675","0.0009","11.9197","0.0015","90","","90","","90","","2742.2","0.4","293","2","293","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","MFM-300 (Ga2) Original","","","- C20.65 H18.85 Ga2 N1.55 O15.55 -","- C20.656 H18.864 Ga2 N1.56 O15.56 -","- C82.624 H75.456 Ga8 N6.24 O62.24 -","4","0.25","","Krap, Cristina P.; Newby, Ruth; Dhakshinamoorthy, Amarajothi; García, Hermenegildo; Cebula, Izabela; Easun, Timothy L.; Savage, Mathew; Eyley, Jennifer E.; Gao, Shan; Blake, Alexander J.; Lewis, William; Beton, Peter H.; Warren, Mark R.; Allan, David R.; Frogley, Mark D.; Tang, Chiu C.; Cinque, Gianfelice; Yang, Sihai; Schröder, Martin","Enhancement of CO2 Adsorption and Catalytic Properties by Fe-Doping of [Ga2(OH)2(L)] (H4L = Biphenyl-3,3',5,5'-tetracarboxylic Acid), MFM-300(Ga2).","Inorganic chemistry","2016","55","3","1076","1088","10.1021/acs.inorgchem.5b02108","","","0.6889","synchrotron","","0.0533","0.0462","","","0.1104","0.1159","","","","","","1.059","","","","has coordinates,has disorder","175610","2020-10-21","18:00:00",""
"4344743","15.0174","0.0007","15.0174","0.0007","11.9111","0.0011","90","","90","","90","","2686.2","0.3","293","2","293","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","MFM-300 (Ga2) Desolvated","","","- C16 H8 Ga2 O10 -","- C16 H8 Ga2 O10 -","- C64 H32 Ga8 O40 -","4","0.25","","Krap, Cristina P.; Newby, Ruth; Dhakshinamoorthy, Amarajothi; García, Hermenegildo; Cebula, Izabela; Easun, Timothy L.; Savage, Mathew; Eyley, Jennifer E.; Gao, Shan; Blake, Alexander J.; Lewis, William; Beton, Peter H.; Warren, Mark R.; Allan, David R.; Frogley, Mark D.; Tang, Chiu C.; Cinque, Gianfelice; Yang, Sihai; Schröder, Martin","Enhancement of CO2 Adsorption and Catalytic Properties by Fe-Doping of [Ga2(OH)2(L)] (H4L = Biphenyl-3,3',5,5'-tetracarboxylic Acid), MFM-300(Ga2).","Inorganic chemistry","2016","55","3","1076","1088","10.1021/acs.inorgchem.5b02108","","","0.6889","synchrotron","","0.0481","0.038","","","0.0968","0.1027","","","","","","1.084","","","","has coordinates","175610","2020-10-21","18:00:00",""
"4344744","15.0535","0.0006","15.0535","0.0006","11.8737","0.001","90","","90","","90","","2690.7","0.3","195","2","195","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","MFM-300 (Ga2) 2.21CO2","","","- C18.21 H8 Ga2 O14.43 -","- C18.212 H8 Ga2 O14.424 -","- C72.848 H32 Ga8 O57.696 -","4","0.25","","Krap, Cristina P.; Newby, Ruth; Dhakshinamoorthy, Amarajothi; García, Hermenegildo; Cebula, Izabela; Easun, Timothy L.; Savage, Mathew; Eyley, Jennifer E.; Gao, Shan; Blake, Alexander J.; Lewis, William; Beton, Peter H.; Warren, Mark R.; Allan, David R.; Frogley, Mark D.; Tang, Chiu C.; Cinque, Gianfelice; Yang, Sihai; Schröder, Martin","Enhancement of CO2 Adsorption and Catalytic Properties by Fe-Doping of [Ga2(OH)2(L)] (H4L = Biphenyl-3,3',5,5'-tetracarboxylic Acid), MFM-300(Ga2).","Inorganic chemistry","2016","55","3","1076","1088","10.1021/acs.inorgchem.5b02108","","","0.6889","synchrotron","","0.0705","0.0571","","","0.1541","0.1673","","","","","","1.114","","","","has coordinates","175610","2020-10-21","18:00:00",""
"4344745","14.932","0.009","14.932","0.009","11.956","0.01","90","","90","","90","","2666","3","293","2","293","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","MFM-300 (Ga1.9Fe0.1) Original","","","- C16 H8 Fe0.1 Ga1.9 O13.15 -","- C16 H8 Fe0.1 Ga1.9 O13.18 -","- C64 H32 Fe0.4 Ga7.6 O52.72 -","4","0.25","","Krap, Cristina P.; Newby, Ruth; Dhakshinamoorthy, Amarajothi; García, Hermenegildo; Cebula, Izabela; Easun, Timothy L.; Savage, Mathew; Eyley, Jennifer E.; Gao, Shan; Blake, Alexander J.; Lewis, William; Beton, Peter H.; Warren, Mark R.; Allan, David R.; Frogley, Mark D.; Tang, Chiu C.; Cinque, Gianfelice; Yang, Sihai; Schröder, Martin","Enhancement of CO2 Adsorption and Catalytic Properties by Fe-Doping of [Ga2(OH)2(L)] (H4L = Biphenyl-3,3',5,5'-tetracarboxylic Acid), MFM-300(Ga2).","Inorganic chemistry","2016","55","3","1076","1088","10.1021/acs.inorgchem.5b02108","","","0.6889","synchrotron","","0.0373","0.0356","","","0.0928","0.0942","","","","","","1.084","","","","has coordinates,has disorder","175610","2020-10-21","18:00:00",""
"4344746","14.896","0.006","14.896","0.006","11.939","0.007","90","","90","","90","","2649","2","373","2","373.15","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","MFM-300 (Ga1.9Fe0.1) Desolvated","","","- C16 H8 Fe0.1 Ga1.9 O10 -","- C16 H8 Fe0.1 Ga1.9 O10 -","- C64 H32 Fe0.4 Ga7.6 O40 -","4","0.25","","Krap, Cristina P.; Newby, Ruth; Dhakshinamoorthy, Amarajothi; García, Hermenegildo; Cebula, Izabela; Easun, Timothy L.; Savage, Mathew; Eyley, Jennifer E.; Gao, Shan; Blake, Alexander J.; Lewis, William; Beton, Peter H.; Warren, Mark R.; Allan, David R.; Frogley, Mark D.; Tang, Chiu C.; Cinque, Gianfelice; Yang, Sihai; Schröder, Martin","Enhancement of CO2 Adsorption and Catalytic Properties by Fe-Doping of [Ga2(OH)2(L)] (H4L = Biphenyl-3,3',5,5'-tetracarboxylic Acid), MFM-300(Ga2).","Inorganic chemistry","2016","55","3","1076","1088","10.1021/acs.inorgchem.5b02108","","","0.6889","synchrotron","","0.0892","0.0634","","","0.149","0.1622","","","","","","1.132","","","","has coordinates","175610","2020-10-21","18:00:00",""
"4344747","14.924","0.008","14.924","0.008","11.929","0.009","90","","90","","90","","2657","3","195","2","195.15","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","MFM-300 (Ga1.9Fe0.1) 2.07CO2","","","- C18.06 H8 Fe0.1 Ga1.9 O14.12 -","- C18.068 H8 Fe0.1 Ga1.9 O14.136 -","- C72.272 H32 Fe0.4 Ga7.6 O56.544 -","4","0.25","","Krap, Cristina P.; Newby, Ruth; Dhakshinamoorthy, Amarajothi; García, Hermenegildo; Cebula, Izabela; Easun, Timothy L.; Savage, Mathew; Eyley, Jennifer E.; Gao, Shan; Blake, Alexander J.; Lewis, William; Beton, Peter H.; Warren, Mark R.; Allan, David R.; Frogley, Mark D.; Tang, Chiu C.; Cinque, Gianfelice; Yang, Sihai; Schröder, Martin","Enhancement of CO2 Adsorption and Catalytic Properties by Fe-Doping of [Ga2(OH)2(L)] (H4L = Biphenyl-3,3',5,5'-tetracarboxylic Acid), MFM-300(Ga2).","Inorganic chemistry","2016","55","3","1076","1088","10.1021/acs.inorgchem.5b02108","","","0.6889","synchrotron","","0.0544","0.05","","","0.139","0.1432","","","","","","1.137","","","","has coordinates","175610","2020-10-21","18:00:00",""
"4345886","15.4702","0.0008","15.4702","0.0008","12.3125","0.0006","90","","90","","90","","2946.7","0.3","100","2","100","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","","- C11 H11 In N O6 -","- C11 H11 In N O6 -","- C88 H88 In8 N8 O48 -","8","0.5","","Sánchez-González, Elí; González-Zamora, Eduardo; Martínez-Otero, Diego; Jancik, Vojtech; Ibarra, Ilich A.","Bottleneck Effect of N,N-Dimethylformamide in InOF-1: Increasing CO2 Capture in Porous Coordination Polymers.","Inorganic chemistry","2017","56","10","5863","5872","10.1021/acs.inorgchem.7b00519","","","0.71073","MoKα","","0.0185","0.018","","","0.0493","0.0496","","","","","","1.125","","","","has coordinates,has disorder","197233","2020-10-21","18:00:00",""
"4349788","15.33411","0.00015","15.33411","0.00015","12.21062","0.00017","90","","90","","90","","2871.14","0.06","293","2","293","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C8.5 H3 Co O5 -","- C8.5 H3 Co O5 -","- C68 H24 Co8 O40 -","8","0.5","","Yao, Ru-Xin; Fu, Huan-Huan; Yu, Bo; Zhang, Xian-Ming","Chiral metal‒organic frameworks constructed from four-fold helical chain SBUs for enantioselective recognition of α-hydroxy/amino acids","Inorganic Chemistry Frontiers","2018","5","1","153","","10.1039/C7QI00615B","","x-ray","0.71073","MoKα","","0.0475","0.0468","","","0.1362","0.1373","","","","","","0.833","","","","has coordinates","235834","2020-10-21","18:00:00",""
"4349789","15.2512","0.0005","15.2512","0.0005","12.1084","0.0005","90","","90","","90","","2816.4","0.17","293","2","293","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","","- C17.5 H6 Co Ni O10 -","- C17.5 H6 Co Ni O10 -","- C70 H24 Co4 Ni4 O40 -","4","0.25","","Yao, Ru-Xin; Fu, Huan-Huan; Yu, Bo; Zhang, Xian-Ming","Chiral metal‒organic frameworks constructed from four-fold helical chain SBUs for enantioselective recognition of α-hydroxy/amino acids","Inorganic Chemistry Frontiers","2018","5","1","153","","10.1039/C7QI00615B","","x-ray","1.54184","CuKα","","0.0969","0.0944","","","0.2659","0.2698","","","","","","1.08","","","","has coordinates,has disorder","235834","2020-10-21","18:00:00",""
"4349790","15.2538","0.0001","15.2538","0.0001","12.1148","0.0002","90","","90","","90","","2818.85","0.05","293","2","293","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C17 H6 Ni2 O10 -","- C17 H6 Ni2 O10 -","- C68 H24 Ni8 O40 -","4","0.25","","Yao, Ru-Xin; Fu, Huan-Huan; Yu, Bo; Zhang, Xian-Ming","Chiral metal‒organic frameworks constructed from four-fold helical chain SBUs for enantioselective recognition of α-hydroxy/amino acids","Inorganic Chemistry Frontiers","2018","5","1","153","","10.1039/C7QI00615B","","","0.71073","MoKα","","0.0291","0.0275","","","0.0749","0.0757","","","","","","1.167","","","","has coordinates","235834","2020-10-21","18:00:00",""
"4500562","29.141","0.002","29.141","0.002","17.527","0.003","90","","90","","90","","14884","3","180","2","180","2","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","","- C130 H156 B4 Cu4 F16 N24 -","- C130 H156 B4 Cu4 F16 N24 -","- C520 H624 B16 Cu16 F64 N96 -","4","0.25","","Carrión, M. Carmen; Ortiz, Isabel M.; Jalón, Félix A.; Manzano, Blanca R.; Rodríguez, Ana M.; Elguero, José","Ag(I) and Cu(I) [2 ×2] Chiral Grids Containing Pyrimidine Ligands with Camphor Moieties. Arene Encapsulation","Crystal Growth & Design","2011","11","5","1766","","10.1021/cg101709q","","","0.71073","MoKα","","0.1732","0.0712","","","0.1769","0.1956","","","","","","0.811","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500563","29.1306","0.001","29.1306","0.001","18.2305","0.0013","90","","90","","90","","15470.3","1.3","180","2","180","2","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","","- C118 H142 Ag4 B4 F16 N24 -","- C118 H142 Ag4 B4 F16 N24 -","- C472 H568 Ag16 B16 F64 N96 -","4","0.25","","Carrión, M. Carmen; Ortiz, Isabel M.; Jalón, Félix A.; Manzano, Blanca R.; Rodríguez, Ana M.; Elguero, José","Ag(I) and Cu(I) [2 ×2] Chiral Grids Containing Pyrimidine Ligands with Camphor Moieties. Arene Encapsulation","Crystal Growth & Design","2011","11","5","1766","","10.1021/cg101709q","","","0.71073","MoKα","","0.113","0.0641","","","0.1508","0.1704","","","","","","0.896","","","","has coordinates,has disorder","179536","2020-10-21","18:00:00",""
"4504190","11.9666","0.0017","11.9666","0.0017","15.485","0.003","90","","90","","90","","2217.4","0.6","293","2","293","2","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","","- C7 H7 Cl N2 O4 Pb -","- C7 H7 Cl N2 O4 Pb -","- C56 H56 Cl8 N16 O32 Pb8 -","8","0.5","","Wang, Xian-Wen; Han, Lei; Cai, Tie-Jun; Zheng, Yue-Qing; Chen, Jing-Zhong; Deng, Qian","A Novel Chiral Doubly Folded Interpenetrating 3D Metal-Organic Framework Based on the Flexible Zwitterionic Ligand","Crystal Growth & Design","2007","7","6","1027","","10.1021/cg060922z","","","0.71073","MoKα","","0.0215","0.0204","","","0.0514","0.0518","","","","","","1.166","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4508201","11.9482","0.0003","11.9482","0.0003","30.657","0.002","90","","90","","90","","4376.6","0.3","293","2","293","2","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","","- C40 H38 In N2 O12 P -","- C36 In N2 O12 P -","- C144 In4 N8 O48 P4 -","4","0.25","","Chen, Yan-Fei; Ma, Yun-Cui; Chen, Shu-Mei","A Chiral Tetrahedral Framework with Tetrahedral Guests for Catalysis and Photoluminescence","Crystal Growth & Design","2013","13","10","4154","","10.1021/cg400769p","","","0.71073","MoKα","","0.1348","0.1162","","","0.3521","0.3742","","","","","","1.148","","","","has coordinates","179618","2020-10-21","18:00:00",""
"4518950","15.1751","0.0003","15.1751","0.0003","12.0768","0.0004","90","","90","","90","","2781.09","0.12","100","2","100.15","","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C18 H10 Ni2 O15 -","- C18 H10 Ni2 O15 -","- C72 H40 Ni8 O60 -","4","0.25","","Gao, Hui; He, Yan-Bin; Hou, Juan-Juan; Zhang, Xian-Ming","<i>In Situ</i> Aliovalent Nickle Substitution and Acidic Modification of Nanowalls Promoted Proton Conductivity in InOF with 1D Helical Channel.","ACS applied materials & interfaces","2021","13","32","38289","38295","10.1021/acsami.1c09001","","","0.71073","MoKα","","0.0619","0.0575","","","0.1656","0.1711","","","","","","1.195","","","","has coordinates,has disorder","268385","2021-09-03","18:59:11",""
"7013615","12.869","0.001","12.869","","15.1892","0.0013","90","","90","","90","","2515.5","0.3","296","2","296","2","","","","","","","","7","I 41 2 2","I 4bw 2bw","98","trans-bis(pentane-2,4-dionato)bis(pyridine)chromium(iii) Hexafluorophosphate","trans-bis(pentane-2,4-dionato)bis(pyridine)chromium(III) Hexafluorophosphate","","- C20 H24 Cr F6 N2 O4 P -","- C20 H24 Cr F6 N2 O4 P -","- C80 H96 Cr4 F24 N8 O16 P4 -","4","0.25","","Iino, Atsushi; Suzuki, Takayoshi; Kaizaki, Sumio","Syntheses, structures, magnetic and spectroscopic properties of bis(pentane-2,4-dionato)chromium(iii) complexes incorporating 3- or 4-pyridyl-substituted nitronyl and imino nitroxides","Dalton Transactions","2003","","24","4604","","10.1039/b310571g","","","0.71069","MoKα","","0.0788","0.0473","","","0.1419","0.1646","","","","","","1.052","","","","has coordinates","179840","2020-10-21","18:00:00",""
"7013940","12.3176","0.0011","12.3176","0.0011","12.772","0.002","90","","90","","90","","1937.8","0.4","223","2","223","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","Copper(i) Bromide 2:1 Complex with 1,2,3,6,7,8-Hexahydro- cinnolino(5,4,3-cde)cinnoline","Copper(I) Bromide 2:1 Complex with 1,2,3,6,7,8-Hexahydro-cinnolino[5,4,3-cde]cinnoline","","- C12 H12 Br2 Cu2 N4 -","- C12 Br2 Cu2 N4 -","- C48 Br8 Cu8 N16 -","4","0.25","","Solntsev, Pavlo V.; Sieler, Joachim; Krautscheid, Harald; Domasevitch, Konstantin V.","Fused pyridazines: rigid multidentates for designing and fine-tuning the structure of hybrid organic/inorganic frameworks.","Dalton transactions (Cambridge, England : 2003)","2004","","8","1153","1158","10.1039/b316561b","","","0.71073","MoKα","","0.0303","0.03","","","0.0794","0.0795","","","","","","1.165","","","","has coordinates","179843","2020-10-21","18:00:00",""
"7013941","12.3475","0.001","12.3475","0.001","13.2122","0.0012","90","","90","","90","","2014.3","0.3","223","2","223","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","Copper(i) Iodide 2:1 Complex with 1,2,3,6,7,8-Hexahydro- cinnolino(5,4,3-cde)cinnoline","Copper(I) Iodide 2:1 Complex with 1,2,3,6,7,8-Hexahydro-cinnolino[5,4,3-cde]cinnoline","","- C12 H12 Cu2 I2 N4 -","- C12 Cu2 I2 N4 -","- C48 Cu8 I8 N16 -","4","0.25","","Solntsev, Pavlo V.; Sieler, Joachim; Krautscheid, Harald; Domasevitch, Konstantin V.","Fused pyridazines: rigid multidentates for designing and fine-tuning the structure of hybrid organic/inorganic frameworks.","Dalton transactions (Cambridge, England : 2003)","2004","","8","1153","1158","10.1039/b316561b","","","0.71073","MoKα","","0.0272","0.0269","","","0.0698","0.0699","","","","","","1.14","","","","has coordinates","179843","2020-10-21","18:00:00",""
"7017285","16.3848","0.0007","16.3848","0.0007","16.3848","0.0007","90","","90","","90","","4398.7","0.3","180","2","180","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","","- C32 H56 Dy2 Na2 O16 -","- C32 H56 Dy2 Na2 O16 -","- C128 H224 Dy8 Na8 O64 -","4","0.25","","Majeed, Zeeshan; Kostakis, George E.; Lan, Yanhua; Powell, Annie K.","Fine-tuning of lanthanide-monocarboxylate coordination networks through ligand decoration.","Dalton transactions (Cambridge, England : 2003)","2011","40","45","12210","12216","10.1039/c1dt10917k","","","0.71073","MoKα","","0.0242","0.0231","","","0.0576","0.0581","","","","","","1.052","","","","has coordinates","212870","2020-10-21","18:00:00",""
"7060778","15.1494","0.0001","15.1494","0.0001","12.0558","0.0002","90","","90","","90","","2766.86","0.05","293","2","293","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","","- C11 H13 Fe N O7 -","- C8 H4 Fe O6 -","- C64 H32 Fe8 O48 -","8","0.5","","Xie, A-Di; Hu, Ming-Gai; Luo, Yu-Hui; Zhu, Xiang-Gui; Wang, Zhi-Hui; Geng, Wu-Yue; Zhang, Hao; Zhang, Dong-En; Zhang, Hong","Synthesis of a stable iron(iii)‒organic framework for a visible light induced simultaneous photocatalytic reduction of Cr(vi) and the degradation of organic dyes in water","New Journal of Chemistry","2021","45","30","13406","13414","10.1039/D1NJ01643A","","","1.54178","CuKα","","0.0339","0.0329","","","0.1021","0.1032","","","","","","1.017","","","","has coordinates","268887","2021-09-06","12:08:56",""
"7062110","23.0816","0.0004","23.0816","0.0004","39.4683","0.0013","90","","90","","90","","21027.1","0.9","170","2","170","2","","","","","","","","7","I 41 2 2","I 4bw 2bw","98","","","","- C78 H134 Br6 N12 Ni3 O19 Si6 -","- C78 H96 Br6.015 N12 Ni3 O6 Si6 -","- C624 H768 Br48.12 N96 Ni24 O48 Si48 -","8","0.5","","Gwak, Geonwoo; An, Seonghyeon; Kim, Dongwon; Di Serio, Martino; Jung, Ok-Sang","Water-reservoir properties dependent on packing modes of [Ni(ii)3L6] cages","New Journal of Chemistry","2022","46","48","23239","23244","10.1039/D2NJ04751A","","","0.71073","MoKα","","0.0559","0.0436","","","0.1155","0.1234","","","","","","1.049","","","","has coordinates","280210","2023-01-06","09:56:35",""
"7103334","32.4729","0.0007","32.4729","0.0007","47.6641","0.0018","90","","90","","90","","50261","2","293","2","293","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","","- C81 H49 Na0.5 O20.5 Zn4.75 -","- C81 H48 Na0.5 O20.5 Zn4.75 -","- C1296 H768 Na8 O328 Zn76 -","16","1","","Hou, Lei; Zhang, Jie-Peng; Chen, Xiao-Ming; Ng, Seik Weng","Two highly-connected, chiral, porous coordination polymers featuring novel heptanuclear metal carboxylate clusters.","Chemical communications (Cambridge, England)","2008","","34","4019","4021","10.1039/b809069f","","","0.71073","MoKα","","0.1232","0.0592","","","0.1128","0.1241","","","","","","0.942","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7103335","32.441","0.002","32.441","0.002","47.814","0.003","90","","90","","90","","50320","4","293","2","293","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","","- C81 H49 K0.5 O20.5 Zn4.75 -","- C81 H48 K0.5 O20.5 Zn4.75 -","- C1296 H768 K8 O328 Zn76 -","16","1","","Hou, Lei; Zhang, Jie-Peng; Chen, Xiao-Ming; Ng, Seik Weng","Two highly-connected, chiral, porous coordination polymers featuring novel heptanuclear metal carboxylate clusters.","Chemical communications (Cambridge, England)","2008","","34","4019","4021","10.1039/b809069f","","","0.71073","MoKα","","0.1128","0.0594","","","0.1273","0.1429","","","","","","0.951","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7105946","18.779","0.0008","18.779","0.0008","35.798","0.003","90","","90","","90","","12624.2","1.3","172","2","172","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","","- C28 H42 Co N4 O2 -","- C28 H42 Co N4 O2 -","- C448 H672 Co16 N64 O32 -","16","1","","Savita K. Sharma; Philip S. May; Matthew B. Jones; Sheri Lense; Kenneth I. Hardcastle; Cora E. MacBeth","Catalytic dioxygen activation by Co(II) complexes employing a coordinatively versatile ligand scaffold","Chem.Commun.","2011","47","","1827","","10.1039/c0cc04671j","","","0.71073","MoKα","","0.0665","0.0506","","","0.1505","0.1573","","","","","","1.063","","","","has coordinates","180163","2020-10-21","18:00:00",""
"7106669","15.347","0.005","15.347","0.005","12.3845","0.0005","90","","90","","90","","2916.9","1.3","120","2","120","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C16 H10.5 O11.25 Sc2 -","- C16 H6 O10 Sc2 -","- C64 H24 O40 Sc8 -","4","0.25","","Ilich A. Ibarra; Sihai Yang; Xiang Lin; Alexander J. Blake; Pierre J. Rizkallah; Harriott Nowell; David R. Allan; Neil R. Champness; Peter Hubberstey; Martin Schroder","Highly Porous and Robust Scandium-based Metal-Organic Frameworks for Hydrogen Storage","Chem.Commun.","2011","47","","8304","","10.1039/c1cc11168j","","","0.6893","synchrotron","","0.035","0.0327","","","0.0912","0.0928","","","","","","1.09","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7106993","15.2927","0.0011","15.2927","0.0011","12.301","0.0018","90","","90","","90","","2876.8","0.5","296","2","296","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C8 H5 Mg O5 -","- C8 H3 Mg O5 -","- C64 H24 Mg8 O40 -","8","0.5","","Qipu Lin; Tao Wu; Shoutian Zheng; Xianhui Bu; Pingyun Feng","A Chiral Tetragonal Magnesium-Carboxylate Framework with Nanotubular Channels","Chem.Commun.","2011","47","","11852","","10.1039/c1cc14836b","","","0.71073","MoKα","","0.0896","0.0875","","","0.2672","0.279","","","","","","1.383","","","","has coordinates","180173","2020-10-21","18:00:00",""
"7108380","15.5665","0.0006","15.5665","0.0006","12.3201","0.0014","90","","90","","90","","2985.4","0.4","293","2","293","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C8 H9 In O7.5 -","- C8 H4 In O5 -","- C64 H32 In8 O40 -","8","0.5","","Jinjie Qian; Feilong Jiang; Daqiang Yuan; Mingyan Wu; Shuquan Zhang; Linjie Zhang; Maochun Hong","Highly selective carbon dioxide adsorption in a water-stable indium-organic framework material","Chem.Commun.","2012","48","","9696","","10.1039/c2cc35068h","","","0.71073","MoKα","","0.0164","0.0156","","","0.0475","0.048","","","","","","1.175","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7108422","16.6307","0.0008","16.6307","0.0008","16.3071","0.0016","90","","90","","90","","4510.2","0.5","273","2","273","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","","- C28 H22 Cu2 N2 O11.5 -","- C28 H19 Cu2 N2 O10 -","- C112 H76 Cu8 N8 O40 -","4","0.25","","Qingxiang Yang; Xingqiu Chen; Zhijun Chen; Ying Hao; Yizhi Li; Qingyi Lu; Hegen Zheng","Metal-organic frameworks constructed from flexible V-shaped ligands: adjustment of the topology, interpenetration and porosity via a solvent system","Chem.Commun.","2012","48","","10016","","10.1039/c2cc35340g","","","0.71073","MoKα","","0.0404","0.0358","","","0.0993","0.1023","","","","","","1.066","","","","has coordinates","180188","2020-10-21","18:00:00",""
"7124806","15.4625","0.0007","15.4625","0.0007","12.337","0.0006","90","","90","","90","","2949.6","0.2","100","2","100","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","InOF-1","","- C8 H4 In O5 -","- C8 H4 In O5 -","- C64 H32 In8 O40 -","8","0.5","","Peralta, Ricardo A.; Campos-Reales-Pineda, Alberto; Pfeiffer, Heriberto; Álvarez, J Raziel; Zárate, J Antonio; Balmaseda, Jorge; González-Zamora, Eduardo; Martínez, Ana; Martínez-Otero, Diego; Jancik, Vojtech; Ibarra, Ilich A.","CO2 capture enhancement in InOF-1 via the bottleneck effect of confined ethanol.","Chemical communications (Cambridge, England)","2016","52","67","10273","10276","10.1039/c6cc04734c","","","0.71073","MoKα","","0.023","0.0211","","","0.0445","0.0451","","","","","","0.994","","","","has coordinates,has disorder","234245","2020-10-21","18:00:00",""
"7124807","15.483","0.002","15.483","0.002","12.308","0.003","90","","90","","90","","2950.5","0.9","100","2","100","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","InOF-1.Ethanol","","- C10 H10 In O6 -","- C10 H10 In O6 -","- C80 H80 In8 O48 -","8","0.5","","Peralta, Ricardo A.; Campos-Reales-Pineda, Alberto; Pfeiffer, Heriberto; Álvarez, J Raziel; Zárate, J Antonio; Balmaseda, Jorge; González-Zamora, Eduardo; Martínez, Ana; Martínez-Otero, Diego; Jancik, Vojtech; Ibarra, Ilich A.","CO2 capture enhancement in InOF-1 via the bottleneck effect of confined ethanol.","Chemical communications (Cambridge, England)","2016","52","67","10273","10276","10.1039/c6cc04734c","","","0.71073","MoKα","","0.0226","0.0222","","","0.0612","0.0615","","","","","","1.175","","","","has coordinates,has disorder","234245","2020-10-21","18:00:00",""
"7129999","15.3819","0.0003","15.3819","0.0003","12.4454","0.0002","90","","90","","90","","2944.62","0.09","7","","7","","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","?MFM-300-Sc_empty?","- C8 H4 O5 Sc -","- C8 H4 O5 Sc -","- C64 H32 O40 Sc8 -","8","0.5","","Guo, Lixia; Han, Xue; Ma, Yujie; Li, Jiangnan; Lu, Wanpeng; Li, Weiyao; Lee, Daniel; da Silva, Ivan; Cheng, Yongqiang; Rudić, Svemir; Manuel, Pascal; Frogley, Mark D.; Ramirez-Cuesta, Anibal J.; Schröder, Martin; Yang, Sihai","High capacity ammonia adsorption in a robust metal–organic framework mediated by reversible host–guest interactions","Chemical Communications","2022","","","","","10.1039/D2CC01197B","powder diffraction","","","","","","","","","","","","","3.77","","","","","","","has coordinates","274623","2022-04-21","21:55:12",""
"7130000","15.397","0.0003","15.397","0.0003","12.4104","0.0002","90","","90","","90","","2942.1","0.09","7","","7","","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","?MFM-300-Sc_1ND3?","- C64 H32 D15 N5 O40 Sc8 -","- C64 H32 D15 N5 O40 Sc8 -","- C64 H32 D15 N5 O40 Sc8 -","1","0.0625","","Guo, Lixia; Han, Xue; Ma, Yujie; Li, Jiangnan; Lu, Wanpeng; Li, Weiyao; Lee, Daniel; da Silva, Ivan; Cheng, Yongqiang; Rudić, Svemir; Manuel, Pascal; Frogley, Mark D.; Ramirez-Cuesta, Anibal J.; Schröder, Martin; Yang, Sihai","High capacity ammonia adsorption in a robust metal–organic framework mediated by reversible host–guest interactions","Chemical Communications","2022","","","","","10.1039/D2CC01197B","powder diffraction","","","","","","","","","","","","","3.77","","","","","","","has coordinates","274623","2022-04-21","21:55:15",""
"7130001","15.402","0.0003","15.402","0.0003","12.3825","0.0003","90","","90","","90","","2937.4","0.11","7","","7","","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","?MFM-300-Sc_3ND3?","- C8 H4 D3.91 N1.3 O5 Sc -","- C8 H3.9998 D3.9134 N1.3044 O5 Sc -","- C64 H31.9984 D31.3072 N10.4352 O40 Sc8 -","8","0.5","","Guo, Lixia; Han, Xue; Ma, Yujie; Li, Jiangnan; Lu, Wanpeng; Li, Weiyao; Lee, Daniel; da Silva, Ivan; Cheng, Yongqiang; Rudić, Svemir; Manuel, Pascal; Frogley, Mark D.; Ramirez-Cuesta, Anibal J.; Schröder, Martin; Yang, Sihai","High capacity ammonia adsorption in a robust metal–organic framework mediated by reversible host–guest interactions","Chemical Communications","2022","","","","","10.1039/D2CC01197B","powder diffraction","","","","","","","","","","","","","4.34","","","","","","","has coordinates","274623","2022-04-21","21:55:15",""
"7130974","17.45","0.003","17.45","0.003","16.295","0.004","90","","90","","90","","4961.9","1.7","304","2","304","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","","- C10 H9 Ce N2 O6 -","- C10 H9 Ce N2 O6 -","- C80 H72 Ce8 N16 O48 -","8","0.5","","Feng, Xuan; Li, Wenying; Yang, Lei; Song, Ting; Xia, Zhaoming; Lai, Qiuxue; Zhou, Xuemei; Hai, Xiao; Liu, Chong","Ce-Hydroxamate Metal-Organic Frameworks for Photocatalytic H2 Generation","Chemical Communications","2022","","","","","10.1039/D2CC05189C","","","0.71073","MoKα","","0.0349","0.0307","","","0.08","0.082","","","","","","1.045","","","","has coordinates","279158","2022-11-09","22:57:00",""
"7132981","15.1203","0.0004","15.1203","0.0004","11.9863","0.0003","90","","90","","90","","2740.35","0.12","10","","10","","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","MFM-300Ti-desolvated","- C8 H3 O5 Ti -","- C8 H3 O5 Ti -","- C64 H24 O40 Ti8 -","8","0.5","","Zeng, Xiangdi; Li, Jiangnan; He, Meng; Lu, Wanpeng; Crawshaw, Danielle; Guo, Lixia; Ma, Yujie; Kippax-Jones, Meredydd; Cheng, Yongqiang; Manuel, Pascal; Rudić, Svemir; Frogley, Mark D.; Schröder, Martin; Yang, Sihai","High adsorption of ammonia in a titanium-based metal-organic framework.","Chemical communications (Cambridge, England)","2024","60","46","5912","5915","10.1039/d4cc01449a","powder diffraction","neutron","","neutron","","0.36239","","","","","","","","3.581","","","","","","","has coordinates","292802","2024-07-05","13:25:06",""
"7132982","15.0507","0.0008","15.0507","0.0008","12.0595","0.0006","90","","90","","90","","2731.8","0.2","10","","10","","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","MFM-300Ti-0.42ND3","- C8 H3 D1.25 N0.42 O5 Ti -","- C8 H3 D1.2516 N0.4172 O5 Ti -","- C64 H24 D10.0128 N3.3376 O40 Ti8 -","8","0.5","","Zeng, Xiangdi; Li, Jiangnan; He, Meng; Lu, Wanpeng; Crawshaw, Danielle; Guo, Lixia; Ma, Yujie; Kippax-Jones, Meredydd; Cheng, Yongqiang; Manuel, Pascal; Rudić, Svemir; Frogley, Mark D.; Schröder, Martin; Yang, Sihai","High adsorption of ammonia in a titanium-based metal-organic framework.","Chemical communications (Cambridge, England)","2024","60","46","5912","5915","10.1039/d4cc01449a","powder diffraction","neutron","","neutron","","0.49151","","","","","","","","3.312","","","","","","","has coordinates","292802","2024-07-05","13:25:07",""
"7132983","14.92","0.0004","14.92","0.0004","12.1536","0.0003","90","","90","","90","","2705.47","0.12","10","","10","","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","MFM-300Ti-1.27ND3","- C8 H3 D3.82 N1.27 O5 Ti -","- C8 H3 D3.816 N1.272 O5 Ti -","- C64 H24 D30.528 N10.176 O40 Ti8 -","8","0.5","","Zeng, Xiangdi; Li, Jiangnan; He, Meng; Lu, Wanpeng; Crawshaw, Danielle; Guo, Lixia; Ma, Yujie; Kippax-Jones, Meredydd; Cheng, Yongqiang; Manuel, Pascal; Rudić, Svemir; Frogley, Mark D.; Schröder, Martin; Yang, Sihai","High adsorption of ammonia in a titanium-based metal-organic framework.","Chemical communications (Cambridge, England)","2024","60","46","5912","5915","10.1039/d4cc01449a","powder diffraction","neutron","","neutron","","0.86843","","","","","","","","2.808","","","","","","","has coordinates","292802","2024-07-05","13:25:07",""
"7209533","27.6","0.004","27.6","0.004","26.7","0.005","90","","90","","90","","20339","6","293","2","293","2","","","","","","","","7","I 41 2 2","I 4bw 2bw","98","","","","- C78 H76 Cl Cu5 N20 O38.5 V16 -","- C78 H66 Cl Cu5 N20 O38.5 V16 -","- C624 H528 Cl8 Cu40 N160 O308 V128 -","8","0.5","","Teng, Yun-lei; Dong, Bao-xia; Peng, Jun; Zhang, Shi-yang; Chen, Lu; Song, Liang; Ge, Jun","Spontaneous resolution of 3D chiral hexadecavanadate-based frameworks incorporating achiral flexible and rigid ligands","CrystEngComm","2013","15","15","2783","","10.1039/c2ce26719e","","","0.71073","MoKα","","0.1116","0.0748","","","0.1861","0.2084","","","","","","1.041","","","","has coordinates","180426","2020-10-21","18:00:00",""
"7209534","27.672","0.004","27.672","0.004","26.693","0.005","90","","90","","90","","20440","6","293","2","293","2","","","","","","","","7","I 41 2 2","I 4bw 2bw","98","","","","- C78 H76 Cl Cu5 N20 O38.5 V16 -","- C78 H70 Cl Cu5 N20 O38.5 V16 -","- C624 H560 Cl8 Cu40 N160 O308 V128 -","8","0.5","","Teng, Yun-lei; Dong, Bao-xia; Peng, Jun; Zhang, Shi-yang; Chen, Lu; Song, Liang; Ge, Jun","Spontaneous resolution of 3D chiral hexadecavanadate-based frameworks incorporating achiral flexible and rigid ligands","CrystEngComm","2013","15","15","2783","","10.1039/c2ce26719e","","","0.71073","MoKα","","0.1204","0.062","","","0.1471","0.1721","","","","","","0.926","","","","has coordinates","180426","2020-10-21","18:00:00",""
"7216238","21.7076","0.0009","21.7076","0.0009","59.216","0.004","90","","90","","90","","27904","2","100","2","100","2","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","","- C72 H80 Ca4 Cl8 N24 O100 -","- C72 H88 Ca4 Cl N24 O60 -","- C576 H704 Ca32 Cl8 N192 O480 -","8","0.5","","Marino, Nadia; Armentano, Donatella; Zanchini, Claudia; De Munno, G.","Ca2+ metal ion adducts with cytosine, cytidine and cytidine 5’-monophosphate. A comprehensive study of calcium reactivity towards building units of nucleic acids.","CrystEngComm","2014","","","","","10.1039/c4ce00511b","","","0.71073","MoKα","","0.068","0.0597","","","0.1704","0.1748","","","","","","1.049","","","","has coordinates,has disorder","180493","2020-10-21","18:00:00",""
"7218227","16.26","0.003","16.26","0.003","16.549","0.003","90","","90","","90","","4375.4","1.4","223","2","223","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","","- C26 H20 N O5 Zn -","- C26 H20 N O5 Zn -","- C208 H160 N8 O40 Zn8 -","8","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","","0.0487","0.0421","","","0.1117","0.1189","","","","","","1.052","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7224108","9.946","0.004","9.946","0.004","31.544","0.013","90","","90","","90","","3120","2","293","2","293","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","","- C15 H11 N O4 Zn -","- C15 H11 N O4 Zn -","- C120 H88 N8 O32 Zn8 -","8","0.5","","Ma, De-Yun; Qin, Liang; Lei, Jia-Mei; Liang, Yun-Qiu; Lin, Wei-Jie; Yan, Jing-Jing; Ding, Wan-Qiu; Guo, Hai-Fu; Ling, Yun","Structural diversity of a series of coordination polymers built from 5-substituted isophthalic acid with or without a methyl-functionalized N-donor ligand","CrystEngComm","2016","18","8","1363","","10.1039/C5CE02314A","","","0.71073","MoKα","","0.0359","0.0282","","","0.0631","0.0678","","","","","","1.07","","","","has coordinates,has disorder","177757","2020-10-21","18:00:00",""
"7229231","33.5891","0.0007","33.5891","0.0007","35.8422","0.0009","90","","90","","90","","40438.2","1.6","173","2","173","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","calixsalen","","","- C84 H104 N12 O17.5 -","- C84 H104 N12 O17.5 -","- C1344 H1664 N192 O280 -","16","1","","Petryk, Małgorzata; Janiak, Agnieszka; Kwit, Marcin","Unexpected formation of a tubular architecture by optically active pure organic calixsalen","CrystEngComm","2017","","","","","10.1039/C7CE01529A","","","1.54178","CuKα","","0.0647","0.0588","","","0.1695","0.1761","","","","","","1.047","","","","has coordinates,has disorder","201248","2020-10-21","18:00:00",""
"7229827","16.25176","0.00016","16.25176","0.00016","16.6475","0.0003","90","","90","","90","","4396.93","0.1","173","0.1","173","0.1","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","","- C48 H32 N6 O8 S Zn2 -","- C48 H32 N6 O8 S1.002 Zn2 -","- C192 H128 N24 O32 S4.008 Zn8 -","4","0.25","","Song, Wei-Chao; Liang, Ling; Cui, Xun-Zhe; Wang, Xiu-Guang; Yang, En-Cui; Zhao, Xiao-Jun","Assembly of ZnII-coordination polymers constructed from benzothiadiazole functionalized bipyridines and V-shaped dicarboxylic acids: topology variety, photochemical and visible-light-driven photocatalytic properties","CrystEngComm","2018","20","5","668","","10.1039/C7CE01933E","","x-ray","1.54184","CuKα","","0.0422","0.0398","","","0.0998","0.1021","","","","","","1.054","","","","has coordinates,has disorder","228960","2020-10-21","18:00:00",""
"7236347","15.178","0.0005","15.178","0.0005","12.0813","0.0005","90","","90","","90","","2783.19","0.17","129.6","0.1","129.6","0.1","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C8 H3 Ni O6 -","- C8 H3 Ni O6 -","- C64 H24 Ni8 O48 -","8","0.5","","Zhang, Xiaoping; Chen, Wenjie; Shi, Wei; Cheng, Peng","Highly selective sorption of CO2 and N2O and strong gas-framework interactions in a nickel(ii) organic material","Journal of Materials Chemistry A","2016","4","41","16198","","10.1039/C6TA06572D","","","0.7107","MoKα","","0.0732","0.0691","","","0.1735","0.1792","","","","","","1.066","","","","has coordinates","235433","2020-10-21","18:00:00",""
"7243416","30.983","0.004","30.983","0.004","31.523","0.007","90","","90","","90","","30260","9","120","","120","","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","","- C80 H294 Cl10 N16 O179 Y14 -","- C80 H112 Cl6 N16 O108 Y14 -","- C320 H448 Cl24 N64 O432 Y56 -","4","0.25","","Lu, Tian-Qi; Yin, Jia-Jia; Chen, Cheng; Shi, Hai-Yan; Zheng, Jun; Liu, Zhengjie; Fang, Xiaolong; Zheng, Xiu-Ying","Two pairs of chiral lanthanide–oxo clusters Ln14 induced by amino acid derivatives","CrystEngComm","2021","23","39","6923","6929","10.1039/D1CE00948F","","","1.54186","CuKα","","0.1048","0.0631","","","0.1582","0.1943","","","","","","1.006","","","","has coordinates,has disorder","270435","2021-11-06","19:54:24",""
"7243417","31.0292","0.0005","31.0292","0.0005","31.3898","0.0006","90","","90","","90","","30222.5","0.9","120","","120","","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","","- C80 H318 Cl10 Dy14 N16 O191 -","- C80 H112 Cl6 Dy14 N16 O108 -","- C320 H448 Cl24 Dy56 N64 O432 -","4","0.25","","Lu, Tian-Qi; Yin, Jia-Jia; Chen, Cheng; Shi, Hai-Yan; Zheng, Jun; Liu, Zhengjie; Fang, Xiaolong; Zheng, Xiu-Ying","Two pairs of chiral lanthanide–oxo clusters Ln14 induced by amino acid derivatives","CrystEngComm","2021","23","39","6923","6929","10.1039/D1CE00948F","","","0.71073","MoKα","","0.0851","0.0427","","","0.0835","0.0895","","","","","","0.807","","","","has coordinates,has disorder","270435","2021-11-06","19:54:24",""
"7243418","31.008","0.004","31.008","0.004","30.85","0.004","90","","90","","90","","29662","7","120","","120","","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","","- C80 H294 Cl10 N16 O179 Y14 -","- C80 H112 Cl6 N16 O108 Y14 -","- C320 H448 Cl24 N64 O432 Y56 -","4","0.25","","Lu, Tian-Qi; Yin, Jia-Jia; Chen, Cheng; Shi, Hai-Yan; Zheng, Jun; Liu, Zhengjie; Fang, Xiaolong; Zheng, Xiu-Ying","Two pairs of chiral lanthanide–oxo clusters Ln14 induced by amino acid derivatives","CrystEngComm","2021","23","39","6923","6929","10.1039/D1CE00948F","","","1.54186","CuKα","","0.0514","0.0432","","","0.1208","0.1296","","","","","","1.032","","","","has coordinates,has disorder","270435","2021-11-06","19:54:24",""
"7243419","31.0353","0.0011","31.0353","0.0011","31.3981","0.0012","90","","90","","90","","30242.3","1.9","120","","120","","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","","- C80 H318 Cl10 Dy14 N16 O191 -","- C80 H112 Cl6 Dy14 N16 O108 -","- C320 H448 Cl24 Dy56 N64 O432 -","4","0.25","","Lu, Tian-Qi; Yin, Jia-Jia; Chen, Cheng; Shi, Hai-Yan; Zheng, Jun; Liu, Zhengjie; Fang, Xiaolong; Zheng, Xiu-Ying","Two pairs of chiral lanthanide–oxo clusters Ln14 induced by amino acid derivatives","CrystEngComm","2021","23","39","6923","6929","10.1039/D1CE00948F","","","1.54186","CuKα","","0.1078","0.0976","","","0.2507","0.2673","","","","","","1.068","","","","has coordinates,has disorder","270435","2021-11-06","19:54:24",""
"9008973","3.325","","3.325","","11.38","","90","","90","","90","","125.813","","","","","","","","","","","","","2","I 41 2 2","I 4bw 2bw","98","","","","- Nb P -","- Nb P -","- Nb4 P4 -","4","0.25","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: beta form","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:29",""
"9008974","3.33","","3.33","","11.39","","90","","90","","90","","126.303","","","","","","","","","","","","","2","I 41 2 2","I 4bw 2bw","98","","","","- P Ta -","- P Ta -","- P4 Ta4 -","4","0.25","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: beta form","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:29",""