# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-02-02T12:55:49+01:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Journal of Materials Chemistry A') AND volume = 5 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
"7229732","6.9587","0.0013","6.9587","0.0013","7.0832","0.0009","90","","90","","90","","342.99","0.1","300","","300","","","","","","","","","3","P -4 21 c","P -4 2n","114","","","alpha-Na3PS4","- Na3 P S4 -","- Na3 P S4 -","- Na6 P2 S8 -","2","0.25","","Nishimura, Shin-ichi; Tanibata, Naoto; Hayashi, Akitoshi; Tatsumisago, Masahiro; Yamada, Atsuo","The crystal structure and sodium disorder of high-temperature polymorph β-Na3PS4","Journal of Materials Chemistry A","2017","5","47","25025","","10.1039/C7TA08391B","powder diffraction","","0.70028","synchrotron","","","","","","","","","","","","","","","","","has coordinates","204276","2020-10-21","18:00:00",""
"7229733","7.06985","0.00004","7.06985","0.00004","7.06985","0.00004","90","","90","","90","","353.371","0.003","600","","600","","","","","","","","","3","I -4 3 m","I -4 2 3","217","","","beta-Na3PS4","- Na3 P S4 -","- Na3 P S4 -","- Na6 P2 S8 -","2","0.0416667","","Nishimura, Shin-ichi; Tanibata, Naoto; Hayashi, Akitoshi; Tatsumisago, Masahiro; Yamada, Atsuo","The crystal structure and sodium disorder of high-temperature polymorph β-Na3PS4","Journal of Materials Chemistry A","2017","5","47","25025","","10.1039/C7TA08391B","powder diffraction","","0.70028","synchrotron","","","","","","","","","","","","","","","","","has coordinates","204277","2020-10-21","18:00:00",""
"7236346","18.542","0.001","18.542","0.001","37.5167","0.0018","90","","90","","120","","11170.4","1","123","","123","","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","","- C10 H7 Cu N O5 -","- C10 H7 Cu N O5 -","- C180 H126 Cu18 N18 O90 -","18","0.5","","Zhang, Mingxing; Chen, Cong; Wang, Qian; Fu, Wensheng; Huang, Kunlin; Zhou, Wei","A metal‒organic framework functionalized with piperazine exhibiting enhanced CH4 storage","Journal of Materials Chemistry A","2017","5","1","349","","10.1039/C6TA06037D","","","0.71073","MoKα","","0.0955","0.0803","","","0.2415","0.252","","","","","","1.081","","","","has coordinates,has disorder","235431","2020-10-21","18:00:00",""
"7236355","23.0299","0.0011","23.0299","0.0011","24.3973","0.0016","90","","90","","90","","12939.7","1.2","150","2","150","2","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","Cobalt acetato 4-(1H-Imidazol-1-yl) benzoate","'Cobalt acetato 4-(1H-Imidazol-1-yl) benzoate'","","- C12 H10 Co N2 O4 -","- C12 H10 Co N2 O4 -","- C384 H320 Co32 N64 O128 -","32","1","","Nandi, Shyamapada; Haldar, Sattwick; Chakraborty, Debanjan; Vaidhyanathan, Ramanathan","Strategically designed azolyl-carboxylate MOFs for potential humid CO2 capture","Journal of Materials Chemistry A","2017","5","2","535","","10.1039/C6TA07145G","","","1.54178","CuKα","","0.1576","0.0727","","","0.1685","0.2015","","","","","","0.997","","","","has coordinates","235446","2020-10-21","18:00:00",""
"7236356","23.61","0.0007","23.61","0.0007","25.085","0.0007","90","","90","","90","","13983.2","0.7","150","2","150","2","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","Magnesium acetato 4-(1H-1,2,4-triazol-1-yl)benzoate","'Magnesium acetato 4-(1H-1,2,4-triazol-1-yl)benzoate'","","- C11 H9 Mg N3 O4 -","- C11 H9 Mg N3 O4 -","- C352 H288 Mg32 N96 O128 -","32","1","","Nandi, Shyamapada; Haldar, Sattwick; Chakraborty, Debanjan; Vaidhyanathan, Ramanathan","Strategically designed azolyl-carboxylate MOFs for potential humid CO2 capture","Journal of Materials Chemistry A","2017","5","2","535","","10.1039/C6TA07145G","","","1.54178","CuKα","","0.1059","0.0912","","","0.242","0.2523","","","","","","1.123","","","","has coordinates","235446","2020-10-21","18:00:00",""
"7236357","23.3159","0.0016","23.3159","0.0016","24.8737","0.0019","90","","90","","90","","13522.1","1.7","173","2","173","2","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","Manganese acetato 4-(1H-1,2,4-triazol-1-yl)benzoate","'Manganese acetato 4-(1H-1,2,4-triazol-1-yl)benzoate'","","- C11 H9 Mn N4 O3 -","- C11 H9 Mn N4 O3 -","- C352 H288 Mn32 N128 O96 -","32","1","","Nandi, Shyamapada; Haldar, Sattwick; Chakraborty, Debanjan; Vaidhyanathan, Ramanathan","Strategically designed azolyl-carboxylate MOFs for potential humid CO2 capture","Journal of Materials Chemistry A","2017","5","2","535","","10.1039/C6TA07145G","","","1.54178","CuKα","","0.1191","0.0687","","","0.1523","0.174","","","","","","0.966","","","","has coordinates","235446","2020-10-21","18:00:00",""
"7236358","23.1995","0.0006","23.1995","0.0006","24.6012","0.0006","90","","90","","90","","13240.8","0.6","173","2","173","2","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","Cobalt acetato 4-(1H-1,2,4-triazol-1-yl)benzoate","'Cobalt acetato 4-(1H-1,2,4-triazol-1-yl)benzoate'","","- C11 H9 Co N3 O4 -","- C11 H9 Co N3 O4 -","- C352 H288 Co32 N96 O128 -","32","1","","Nandi, Shyamapada; Haldar, Sattwick; Chakraborty, Debanjan; Vaidhyanathan, Ramanathan","Strategically designed azolyl-carboxylate MOFs for potential humid CO2 capture","Journal of Materials Chemistry A","2017","5","2","535","","10.1039/C6TA07145G","","","1.54178","CuKα","","0.0629","0.0558","","","0.1504","0.1564","","","","","","1.081","","","","has coordinates","235446","2020-10-21","18:00:00",""
"7236359","22.889","0.003","22.889","0.003","24.907","0.003","90","","90","","90","","13049","3","173","2","173","2","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","Mnganese acetato 4-(1H-Imidazol-1-yl) benzoate","'Mnganese acetato 4-(1H-Imidazol-1-yl) benzoate'","","- C12 H10 Mn N2 O4 -","- C12 H10 Mn N2 O4 -","- C384 H320 Mn32 N64 O128 -","32","1","","Nandi, Shyamapada; Haldar, Sattwick; Chakraborty, Debanjan; Vaidhyanathan, Ramanathan","Strategically designed azolyl-carboxylate MOFs for potential humid CO2 capture","Journal of Materials Chemistry A","2017","5","2","535","","10.1039/C6TA07145G","","","1.54178","CuKα","","0.1976","0.1016","","","0.2334","0.2792","","","","","","0.955","","","","has coordinates","235446","2020-10-21","18:00:00",""
"7236360","23.3323","0.0007","23.3323","0.0007","24.814","0.0008","90","","90","","90","","13508.6","0.7","173","2","173","2","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","Magnesium acetato 4-(1H-Imidazol-1-yl) benzoate","'Magnesium acetato 4-(1H-Imidazol-1-yl) benzoate'","","- C12 H10 Mg N2 O4 -","- C12 H10 Mg N2 O4 -","- C384 H320 Mg32 N64 O128 -","32","1","","Nandi, Shyamapada; Haldar, Sattwick; Chakraborty, Debanjan; Vaidhyanathan, Ramanathan","Strategically designed azolyl-carboxylate MOFs for potential humid CO2 capture","Journal of Materials Chemistry A","2017","5","2","535","","10.1039/C6TA07145G","","","1.54178","CuKα","","0.067","0.0542","","","0.1385","0.1451","","","","","","1.034","","","","has coordinates","235446","2020-10-21","18:00:00",""
"7236361","9.771","0.002","7.06","0.0014","23.868","0.005","90","","97.28","0.03","90","","1633.2","0.6","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H17 N17 O5 -","- C6 H17 N17 O5 -","- C24 H68 N68 O20 -","4","1","","Zhang, Man; Gao, Huiqi; Li, Chuan; Fu, Wei; Tang, Liwei; Zhou, Zhiming","Towards improved explosives with a high performance: N-(3,5-dinitro-1H-pyrazol-4-yl)-1H-tetrazol-5-amine and its salts","Journal of Materials Chemistry A","2017","5","4","1769","","10.1039/C6TA07740D","","","","","","0.084","","","","","","","","","","","","","","","has coordinates","301866","2025-08-22","21:38:31",""
"7236362","8.8823","0.0018","10.952","0.002","11.675","0.002","90","","107.38","0.03","90","","1083.9","0.4","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H2 K N9 O6 -","- C5 H2 K N9 O6 -","- C20 H8 K4 N36 O24 -","4","1","","Zhang, Man; Gao, Huiqi; Li, Chuan; Fu, Wei; Tang, Liwei; Zhou, Zhiming","Towards improved explosives with a high performance: N-(3,5-dinitro-1H-pyrazol-4-yl)-1H-tetrazol-5-amine and its salts","Journal of Materials Chemistry A","2017","5","4","1769","","10.1039/C6TA07740D","","","0.71073","MoKα","","0.0692","0.0625","","","0.1855","0.2025","","","","","","1.273","","","","has coordinates","301866","2025-08-22","21:38:31",""
"7236363","6.2881","0.0005","9.3424","0.0008","11.2935","0.0011","87.455","0.008","79.856","0.008","82.934","0.007","647.94","0.1","102.1","","102.1","","","","","","","","","4","P -1","-P 1","2","","","","- C6 H9 N15 O4 -","- C6 H9 N15 O4 -","- C12 H18 N30 O8 -","2","1","","Zhang, Man; Gao, Huiqi; Li, Chuan; Fu, Wei; Tang, Liwei; Zhou, Zhiming","Towards improved explosives with a high performance: N-(3,5-dinitro-1H-pyrazol-4-yl)-1H-tetrazol-5-amine and its salts","Journal of Materials Chemistry A","2017","5","4","1769","","10.1039/C6TA07740D","","","0.7107","MoKα","","0.0586","0.0462","","","0.1041","0.1154","","","","","","1.024","","","","has coordinates","301866","2025-08-22","21:38:31",""
"7236364","4.7451","0.0009","7.1473","0.0014","27.902","0.006","90","","90.22","0.03","90","","946.3","0.3","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H5 N9 O5 -","- C4 H5 N9 O5 -","- C16 H20 N36 O20 -","4","1","","Zhang, Man; Gao, Huiqi; Li, Chuan; Fu, Wei; Tang, Liwei; Zhou, Zhiming","Towards improved explosives with a high performance: N-(3,5-dinitro-1H-pyrazol-4-yl)-1H-tetrazol-5-amine and its salts","Journal of Materials Chemistry A","2017","5","4","1769","","10.1039/C6TA07740D","","","0.71073","MoKα","","0.092","0.0738","","","0.1968","0.2338","","","","","","1.179","","","","has coordinates","235448","2020-10-21","18:00:00",""
"7236365","10.035","0.002","6.9626","0.0014","16.699","0.003","90","","91.6","0.03","90","","1166.3","0.4","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H10 N10 O6 -","- C4 H10 N10 O6 -","- C16 H40 N40 O24 -","4","1","","Zhang, Man; Gao, Huiqi; Li, Chuan; Fu, Wei; Tang, Liwei; Zhou, Zhiming","Towards improved explosives with a high performance: N-(3,5-dinitro-1H-pyrazol-4-yl)-1H-tetrazol-5-amine and its salts","Journal of Materials Chemistry A","2017","5","4","1769","","10.1039/C6TA07740D","","","0.71073","MoKα","","0.0563","0.0466","","","0.1189","0.1348","","","","","","1.211","","","","has coordinates","235448","2020-10-21","18:00:00",""
"7236366","9.3074","0.0019","10.844","0.002","18.529","0.004","90","","90","","90","","1870.1","0.7","153","2","153","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C19 H16 Br F3 N2 O4 -","- C19 H16 Br F3 N2 O4 -","- C76 H64 Br4 F12 N8 O16 -","4","1","","Zhang, Man; Gao, Huiqi; Li, Chuan; Fu, Wei; Tang, Liwei; Zhou, Zhiming","Towards improved explosives with a high performance: N-(3,5-dinitro-1H-pyrazol-4-yl)-1H-tetrazol-5-amine and its salts","Journal of Materials Chemistry A","2017","5","4","1769","","10.1039/C6TA07740D","","","0.71073","MoKα","","0.0399","0.0366","","","0.1061","0.1263","","","","","","1.205","","","","has coordinates","301866","2025-08-22","21:38:31",""
"7236367","17.0993","0.0014","17.0993","0.0014","17.0993","0.0014","90","","90","","90","","4999.6","0.7","298","2","298","2","","","","","","","","5","I -4 3 m","I -4 2 3","217","","Zn/Co-ZIF","","- C48 H60 Co3 N24 Zn3 -","- C48 H60 Co3 N24 Zn3 -","- C96 H120 Co6 N48 Zn6 -","2","0.0416667","","Zhou, Kui; Mousavi, Bibimaryam; Luo, Zhixiong; Phatanasri, Shophot; Chaemchuen, Somboon; Verpoort, Francis","Characterization and properties of Zn/Co zeolitic imidazolate frameworks vs. ZIF-8 and ZIF-67","Journal of Materials Chemistry A","2017","5","3","952","","10.1039/C6TA07860E","","","0.71073","MoKα","","0.0309","0.0295","","","0.0761","0.0772","","","","","","1.117","","","","has coordinates,has disorder","235450","2020-10-21","18:00:00",""
"7236371","17.0656","0.0018","6.8365","0.0008","19.3505","0.0016","90","","93.333","0.009","90","","2253.8","0.4","105.5","","105.5","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C4 H6 K N9 O6 -","- C4 H6 K N9 O6 -","- C32 H48 K8 N72 O48 -","8","2","","Fu, Wei; Zhao, Baojing; Zhang, Man; Li, Chuan; Gao, Huiqi; Zhang, Jun; Zhou, Zhiming","3,4-Dinitro-1-(1H-tetrazol-5-yl)-1H-pyrazol-5-amine (HANTP) and its salts: primary and secondary explosives","Journal of Materials Chemistry A","2017","5","10","5044","","10.1039/C6TA08376E","","","0.7107","MoKα","","0.1003","0.0776","","","0.1851","0.2002","","","","","","1.087","","","","has coordinates,has disorder","235457","2020-10-21","18:00:00",""
"7236372","4.7451","0.0009","7.1473","0.0014","27.902","0.006","90","","90.22","0.03","90","","946.3","0.3","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H5 N9 O5 -","- C4 H5 N9 O5 -","- C16 H20 N36 O20 -","4","1","","Fu, Wei; Zhao, Baojing; Zhang, Man; Li, Chuan; Gao, Huiqi; Zhang, Jun; Zhou, Zhiming","3,4-Dinitro-1-(1H-tetrazol-5-yl)-1H-pyrazol-5-amine (HANTP) and its salts: primary and secondary explosives","Journal of Materials Chemistry A","2017","5","10","5044","","10.1039/C6TA08376E","","","0.71073","MoKα","","0.092","0.0738","","","0.1968","0.2338","","","","","","1.179","","","","has coordinates","235457","2020-10-21","18:00:00",""
"7236373","10.035","0.002","6.9626","0.0014","16.699","0.003","90","","91.6","0.03","90","","1166.3","0.4","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H10 N10 O6 -","- C4 H10 N10 O6 -","- C16 H40 N40 O24 -","4","1","","Fu, Wei; Zhao, Baojing; Zhang, Man; Li, Chuan; Gao, Huiqi; Zhang, Jun; Zhou, Zhiming","3,4-Dinitro-1-(1H-tetrazol-5-yl)-1H-pyrazol-5-amine (HANTP) and its salts: primary and secondary explosives","Journal of Materials Chemistry A","2017","5","10","5044","","10.1039/C6TA08376E","","","0.71073","MoKα","","0.0563","0.0466","","","0.1189","0.1348","","","","","","1.211","","","","has coordinates","235457","2020-10-21","18:00:00",""
"7236374","8.2623","0.0007","24.641","0.002","5.6882","0.0004","90","","90","","90","","1158.07","0.16","107.6","","107.6","","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C5 H8 N12 O4 -","- C5 H8 N12 O4 -","- C20 H32 N48 O16 -","4","1","","Fu, Wei; Zhao, Baojing; Zhang, Man; Li, Chuan; Gao, Huiqi; Zhang, Jun; Zhou, Zhiming","3,4-Dinitro-1-(1H-tetrazol-5-yl)-1H-pyrazol-5-amine (HANTP) and its salts: primary and secondary explosives","Journal of Materials Chemistry A","2017","5","10","5044","","10.1039/C6TA08376E","","","0.7107","MoKα","","0.0347","0.0313","","","0.071","0.0735","","","","","","1.107","","","","has coordinates","301866","2025-08-22","21:38:31",""
"7236375","9.2793","0.0005","5.8543","0.0002","20.6029","0.0008","90","","100.757","0.004","90","","1099.56","0.08","106.2","","106.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C4 H6 N9 Na O6 -","- C4 H6 N9 Na O6 -","- C16 H24 N36 Na4 O24 -","4","1","","Fu, Wei; Zhao, Baojing; Zhang, Man; Li, Chuan; Gao, Huiqi; Zhang, Jun; Zhou, Zhiming","3,4-Dinitro-1-(1H-tetrazol-5-yl)-1H-pyrazol-5-amine (HANTP) and its salts: primary and secondary explosives","Journal of Materials Chemistry A","2017","5","10","5044","","10.1039/C6TA08376E","","","0.7107","MoKα","","0.0432","0.0353","","","0.0766","0.0815","","","","","","1.079","","","","has coordinates","301866","2025-08-22","21:38:31",""
"7236376","8.018","0.005","14.816","0.005","17.908","0.005","90","0.005","100.175","0.005","90","0.005","2093.9","1.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H32 Cu2 N8 O18 S4 -","- C38 H28 Cu2 N8 O18 S4 -","- C76 H56 Cu4 N16 O36 S8 -","2","0.5","","Wei, Mei-Jie; Fu, Jia-Qi; Wang, Yi-Di; Gu, Jing-Yang; Liu, Bai-Ling; Zang, Hong-Ying; Zhou, En-Long; Shao, Kui-Zhan; Su, Zhong-Min","Changes of coordination modes of Cu-based coordination complexes as tuneable proton-conducting solid electrolytes","Journal of Materials Chemistry A","2017","5","3","1085","","10.1039/C6TA08581D","","","0.71069","MoKα","","0.0685","0.0411","","","0.0908","0.1011","","","","","","1.017","","","","has coordinates","235460","2020-10-21","18:00:00",""
"7236377","28.561","0.005","9.43","0.005","13.827","0.005","90","0.005","90","0.005","90","0.005","3724","2","293","2","293","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C38 H24 Cu N8 O13 S4 -","- C38 H22 Cu N8 O13 S4 -","- C152 H88 Cu4 N32 O52 S16 -","4","0.5","","Wei, Mei-Jie; Fu, Jia-Qi; Wang, Yi-Di; Gu, Jing-Yang; Liu, Bai-Ling; Zang, Hong-Ying; Zhou, En-Long; Shao, Kui-Zhan; Su, Zhong-Min","Changes of coordination modes of Cu-based coordination complexes as tuneable proton-conducting solid electrolytes","Journal of Materials Chemistry A","2017","5","3","1085","","10.1039/C6TA08581D","","","0.71069","MoKα","","0.0485","0.0374","","","0.0963","0.1022","","","","","","1.034","","","","has coordinates","235460","2020-10-21","18:00:00",""
"7236378","9.688","0.005","13.529","0.005","15.76","0.005","90","0.005","104.136","0.005","90","0.005","2003.1","1.4","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C19 H13 Cl Cu N4 O7 S2 -","- C19 H12 Cl Cu N4 O7 S2 -","- C76 H48 Cl4 Cu4 N16 O28 S8 -","4","1","","Wei, Mei-Jie; Fu, Jia-Qi; Wang, Yi-Di; Gu, Jing-Yang; Liu, Bai-Ling; Zang, Hong-Ying; Zhou, En-Long; Shao, Kui-Zhan; Su, Zhong-Min","Changes of coordination modes of Cu-based coordination complexes as tuneable proton-conducting solid electrolytes","Journal of Materials Chemistry A","2017","5","3","1085","","10.1039/C6TA08581D","","","0.71069","MoKα","","0.0518","0.034","","","0.0816","0.0885","","","","","","1.025","","","","has coordinates","235460","2020-10-21","18:00:00",""
"7236379","10.4224","0.0008","24.105","0.002","8.1188","0.0006","90","","104.085","0.005","90","","1978.4","0.3","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(HxN3)2-SiPc","bis(6-azohexylacrylate) silicon phthalocyanine","","- C44 H36 N14 O4 Si -","- C44 H36 N14 O4 Si -","- C88 H72 N28 O8 Si2 -","2","0.5","","Grant, Trevor M.; Gorisse, Therese; Dautel, Olivier; Wantz, Guillaume; Lessard, Benoît H.","Multifunctional ternary additive in bulk heterojunction OPV: increased device performance and stability","Journal of Materials Chemistry A","2017","5","4","1581","","10.1039/C6TA08593H","","","0.71073","MoKα","","0.0581","0.042","","","0.1043","0.1167","","","","","","1.03","","","","has coordinates","235462","2020-10-21","18:00:00",""
"7236389","21.4934","0.0005","21.4934","0.0005","21.4934","0.0005","90","","90","","90","","9929.2","0.4","100","0.1","100","0.1","","","","","","","","5","P -4 3 n","P -4n 2 3","218","","","","- C24 H17 Al3 N3 O17.5 -","- C24 H14.0001 Al3 N3 O17.5 -","- C192 H112.001 Al24 N24 O140 -","8","0.333333","","Belmabkhout, Youssef; Pillai, Renjith S.; Alezi, Dalal; Shekhah, Osama; Bhatt, Prashant M.; Chen, Zhijie; Adil, Karim; Vaesen, Sebastien; De Weireld, Guy; Pang, Maolin; Suetin, Mikhail; Cairns, Amy J.; Solovyeva, Vera; Shkurenko, Aleksander; El Tall, Omar; Maurin, Guillaume; Eddaoudi, Mohamed","Metal‒organic frameworks to satisfy gas upgrading demands: fine-tuning thesoc-MOF platform for the operative removal of H2S","Journal of Materials Chemistry A","2017","5","7","3293","","10.1039/C6TA09406F","","","1.54178","CuKα","","0.0344","0.0332","","","0.0892","0.0902","","","","","","1.021","","","","has coordinates","235468","2020-10-21","18:00:00",""
"7236390","16.951","0.005","23.303","0.005","27.845","0.005","90","","125.992","0.011","90","","8899","4","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 Ag16 N27 Na O67 P2 W18 -","- C18 H18 Ag16 N27 Na O67 P2 W18 -","- C72 H72 Ag64 N108 Na4 O268 P8 W72 -","4","1","","Li, Mengting; Cong, Lina; Zhao, Jiao; Zheng, Tiantian; Tian, Rui; Sha, Jingquan; Su, Zhongmin; Wang, Xinlong","Self-organization towards complex multi-fold meso-helices in the structures of Wells‒Dawson polyoxometalate-based hybrid materials for lithium-ion batteries","Journal of Materials Chemistry A","2017","5","7","3371","","10.1039/C6TA09852E","","","0.71069","MoKα","","0.1804","0.0974","","","0.2484","0.3047","","","","","","1.058","","","","has coordinates","235470","2020-10-21","18:00:00",""
"7236391","15.025","0.005","15.036","0.005","28.658","0.005","85.652","0.005","86.867","0.005","77.497","0.005","6298","3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C32 H32 Ag26 N48 O66 P2 W18 -","- C32 H32 Ag26 N48 O66 P2 W18 -","- C64 H64 Ag52 N96 O132 P4 W36 -","2","1","","Li, Mengting; Cong, Lina; Zhao, Jiao; Zheng, Tiantian; Tian, Rui; Sha, Jingquan; Su, Zhongmin; Wang, Xinlong","Self-organization towards complex multi-fold meso-helices in the structures of Wells‒Dawson polyoxometalate-based hybrid materials for lithium-ion batteries","Journal of Materials Chemistry A","2017","5","7","3371","","10.1039/C6TA09852E","","","0.71069","MoKα","","0.1069","0.0633","","","0.1539","0.1767","","","","","","0.992","","","","has coordinates","235470","2020-10-21","18:00:00",""
"7236392","10.39","0.005","11.803","0.006","11.934","0.006","82.967","0.01","81.366","0.011","87.884","0.009","1435.8","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H76 Eu2 O47 P6 -","- C24 H34 Eu2 O47 P6 -","- C24 H34 Eu2 O47 P6 -","1","0.5","","Fu, Ruibiao; Hu, Shengmin; Wu, Xintao","Rapid and sensitive detection of nitroaromatic explosives by using new 3D lanthanide phosphonates","Journal of Materials Chemistry A","2017","5","5","1952","","10.1039/C6TA10152F","","","0.71073","MoKα","","0.0606","0.048","","","0.1042","0.1124","","","","","","1.082","","","","has coordinates","235472","2020-10-21","18:00:00",""
"7236393","10.35","0.02","11.94","0.03","12.75","0.03","104.97","0.04","90.47","0.02","93.06","0.03","1520","6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H76 La2 O47 P6 -","- C24 H34 La2 O47 P6 -","- C24 H34 La2 O47 P6 -","1","0.5","","Fu, Ruibiao; Hu, Shengmin; Wu, Xintao","Rapid and sensitive detection of nitroaromatic explosives by using new 3D lanthanide phosphonates","Journal of Materials Chemistry A","2017","5","5","1952","","10.1039/C6TA10152F","","","0.71073","MoKα","","0.1249","0.1099","","","0.3091","0.3246","","","","","","1.185","","","","has coordinates","235472","2020-10-21","18:00:00",""
"7236394","10.3912","0.001","11.8723","0.0004","11.879","0.0008","82.379","0.01","87.725","0.012","81.666","0.008","1436.89","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H76 Nd2 O47 P6 -","- C24 H34 Nd2 O47 P6 -","- C24 H34 Nd2 O47 P6 -","1","0.5","","Fu, Ruibiao; Hu, Shengmin; Wu, Xintao","Rapid and sensitive detection of nitroaromatic explosives by using new 3D lanthanide phosphonates","Journal of Materials Chemistry A","2017","5","5","1952","","10.1039/C6TA10152F","","","0.71073","MoKα","","0.0379","0.035","","","0.0927","0.0949","","","","","","1.049","","","","has coordinates","235472","2020-10-21","18:00:00",""
"7236395","27.799","0.003","19.3811","0.0019","19.24","0.002","90","","103.381","0.002","90","","10084.6","1.8","173","","173","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C34 H66 Cl3 F6 Mg3 N O13 S2 -","- C34 H66 Cl3 F6 Mg3 N O12.5 S2 -","- C272 H528 Cl24 F48 Mg24 N8 O100 S16 -","8","1","","Mandai, Toshihiko; Akita, Yasuhiro; Yagi, Shunsuke; Egashira, Minato; Munakata, Hirokazu; Kanamura, Kiyoshi","A key concept of utilization of both non-Grignard magnesium chloride and imide salts for rechargeable Mg battery electrolytes","Journal of Materials Chemistry A","2017","5","7","3152","","10.1039/C6TA10194A","","","0.71075","MoKα","","0.1012","0.0793","","","0.255","0.2786","","","","","","1.088","","","","has coordinates","235473","2020-10-21","18:00:00",""
"7236396","12.673","0.002","12.7426","0.0019","13.598","0.002","115.976","0.002","105.206","0.003","102.326","0.003","1763.2","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H29 Mo N4 Ni O4.5 -","- C26 H28 Mo N4 Ni O4 -","- C52 H56 Mo2 N8 Ni2 O8 -","2","1","","Li, Xiao; Yang, Liu; Su, Tan; Wang, Xinlong; Sun, Chunyi; Su, Zhongmin","Graphene-coated hybrid electrocatalysts derived from bimetallic metal‒organic frameworks for efficient hydrogen generation","Journal of Materials Chemistry A","2017","5","10","5000","","10.1039/C6TA10405C","","","0.71073","MoKα","","0.0895","0.0503","","","0.1219","0.1375","","","","","","0.858","","","","has coordinates","235476","2020-10-21","18:00:00",""
"7236397","5.79","0.003","13.286","0.007","13.788","0.007","90","","90","","90","","1060.7","1","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C8 H6 N6 O4 -","- C8 H6 N6 O4 -","- C32 H24 N24 O16 -","4","1","","Kommu, Nagarjuna; Balaraju, M.; Ghule, Vikas D.; Sahoo, Akhila K.","Synthetic manifestation of nitro substituted tetrazole-N-(hetero)aryl derivatives and energetic studies","Journal of Materials Chemistry A","2017","5","16","7366","","10.1039/C6TA10621H","","","0.71073","MoKα","","0.0644","0.04","","","0.0789","0.0845","","","","","","1.019","","","","has coordinates","301866","2025-08-22","21:38:31",""
"7236398","12.78","0.002","7.1353","0.0012","11.0435","0.0018","90","","109.625","0.003","90","","948.5","0.3","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H5 N7 O4 -","- C7 H5 N7 O4 -","- C28 H20 N28 O16 -","4","1","","Kommu, Nagarjuna; Balaraju, M.; Ghule, Vikas D.; Sahoo, Akhila K.","Synthetic manifestation of nitro substituted tetrazole-N-(hetero)aryl derivatives and energetic studies","Journal of Materials Chemistry A","2017","5","16","7366","","10.1039/C6TA10621H","","","0.71073","MoKα","","0.0711","0.0484","","","0.1082","0.1181","","","","","","1.021","","","","has coordinates","301866","2025-08-22","21:38:31",""
"7236399","7.141","0.0007","8.315","0.0007","10.267","0.0012","84.165","0.008","73.123","0.01","66.337","0.009","534.25","0.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C8 H6 N6 O5 -","- C8 H6 N6 O5 -","- C16 H12 N12 O10 -","2","1","","Kommu, Nagarjuna; Balaraju, M.; Ghule, Vikas D.; Sahoo, Akhila K.","Synthetic manifestation of nitro substituted tetrazole-N-(hetero)aryl derivatives and energetic studies","Journal of Materials Chemistry A","2017","5","16","7366","","10.1039/C6TA10621H","","","0.71073","MoKα","","0.054","0.0469","","","0.1205","0.1297","","","","","","0.934","","","","has coordinates","301866","2025-08-22","21:38:31",""
"7236400","13.9435","0.0018","6.957","0.0006","12.8193","0.0011","90","","117.363","0.004","90","","1104.4","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H3 N9 O4 -","- C7 H3 N9 O4 -","- C28 H12 N36 O16 -","4","1","","Kommu, Nagarjuna; Balaraju, M.; Ghule, Vikas D.; Sahoo, Akhila K.","Synthetic manifestation of nitro substituted tetrazole-N-(hetero)aryl derivatives and energetic studies","Journal of Materials Chemistry A","2017","5","16","7366","","10.1039/C6TA10621H","","","0.71073","MoKα","","0.0835","0.0712","","","0.196","0.2096","","","","","","1.117","","","","has coordinates","235480","2020-10-21","18:00:00",""
"7236401","8.162","0.007","12.424","0.011","9.201","0.008","90","","104.868","0.014","90","","901.8","1.4","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H7 N5 O2 -","- C8 H7 N5 O2 -","- C32 H28 N20 O8 -","4","1","","Kommu, Nagarjuna; Balaraju, M.; Ghule, Vikas D.; Sahoo, Akhila K.","Synthetic manifestation of nitro substituted tetrazole-N-(hetero)aryl derivatives and energetic studies","Journal of Materials Chemistry A","2017","5","16","7366","","10.1039/C6TA10621H","","","0.71073","MoKα","","0.0714","0.0433","","","0.1006","0.1105","","","","","","0.953","","","","has coordinates","301866","2025-08-22","21:38:31",""
"7236402","13.869","0.009","5.589","0.002","14.8","0.012","90","","117.46","0.09","90","","1018","1.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H6 N6 O4 -","- C8 H6 N6 O4 -","- C32 H24 N24 O16 -","4","1","","Kommu, Nagarjuna; Balaraju, M.; Ghule, Vikas D.; Sahoo, Akhila K.","Synthetic manifestation of nitro substituted tetrazole-N-(hetero)aryl derivatives and energetic studies","Journal of Materials Chemistry A","2017","5","16","7366","","10.1039/C6TA10621H","","","0.71073","MoKα","","0.1009","0.0639","","","0.1607","0.1992","","","","","","1.025","","","","has coordinates","235480","2020-10-21","18:00:00",""
"7236403","9.9081","0.0008","10.2255","0.0007","21.181","0.006","90","","90","","90","","2146","0.6","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C8 H6 N6 O5 -","- C8 H6 N6 O5 -","- C64 H48 N48 O40 -","8","1","","Kommu, Nagarjuna; Balaraju, M.; Ghule, Vikas D.; Sahoo, Akhila K.","Synthetic manifestation of nitro substituted tetrazole-N-(hetero)aryl derivatives and energetic studies","Journal of Materials Chemistry A","2017","5","16","7366","","10.1039/C6TA10621H","","","0.71073","MoKα","","0.0878","0.0531","","","0.1148","0.1419","","","","","","1.06","","","","has coordinates","235480","2020-10-21","18:00:00",""
"7236404","7.2628","0.0003","10.5375","0.0004","13.5924","0.0005","90","","90","","90","","1040.25","0.07","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C7 H3 N7 O6 -","- C7 H3 N7 O6 -","- C28 H12 N28 O24 -","4","1","","Kommu, Nagarjuna; Balaraju, M.; Ghule, Vikas D.; Sahoo, Akhila K.","Synthetic manifestation of nitro substituted tetrazole-N-(hetero)aryl derivatives and energetic studies","Journal of Materials Chemistry A","2017","5","16","7366","","10.1039/C6TA10621H","","","1.54184","CuKα","","0.0524","0.0515","","","0.1542","0.1584","","","","","","1.097","","","","has coordinates","301866","2025-08-22","21:38:31",""
"7236405","71.027","0.005","9.0269","0.0007","13.8125","0.001","90","","100.138","0.002","90","","8717.7","1.1","273","2","273","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C8 H6 N6 O5 -","- C8 H6 N6 O5 -","- C256 H192 N192 O160 -","32","4","","Kommu, Nagarjuna; Balaraju, M.; Ghule, Vikas D.; Sahoo, Akhila K.","Synthetic manifestation of nitro substituted tetrazole-N-(hetero)aryl derivatives and energetic studies","Journal of Materials Chemistry A","2017","5","16","7366","","10.1039/C6TA10621H","","","0.71073","MoKα","","0.1239","0.0863","","","0.2279","0.2568","","","","","","1.025","","","","has coordinates","301866","2025-08-22","21:38:31",""
"7236406","7.9223","0.0005","18.592","0.0011","7.561","0.0006","90","","98.73","0.002","90","","1100.77","0.13","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H4 N8 O6 -","- C7 H3.987 N7.987 O6 -","- C28 H15.948 N31.948 O24 -","4","1","","Kommu, Nagarjuna; Balaraju, M.; Ghule, Vikas D.; Sahoo, Akhila K.","Synthetic manifestation of nitro substituted tetrazole-N-(hetero)aryl derivatives and energetic studies","Journal of Materials Chemistry A","2017","5","16","7366","","10.1039/C6TA10621H","","","0.71073","MoKα","","0.0616","0.0489","","","0.1164","0.1229","","","","","","1.064","","","","has coordinates","235480","2020-10-21","18:00:00",""
"7236407","10.4051","0.0006","11.1819","0.0007","11.9261","0.0007","97.44","0.002","102.813","0.002","103.84","0.002","1289.11","0.13","147","2","147","2","","","","","","","","5","P -1","-P 1","2","(3BS)2-SiPc","bis(tributylsilane)-silicon phthalocyanine","","- C56 H70 N8 O2 Si3 -","- C56 H70 N8 O2 Si3 -","- C56 H70 N8 O2 Si3 -","1","0.5","","Dang, Minh-Trung; Grant, Trevor M.; Yan, Han; Seferos, Dwight S.; Lessard, Benoît H.; Bender, Timothy P.","Bis(tri-n-alkylsilyl oxide) silicon phthalocyanines: a start to establishing a structure property relationship as both ternary additives and non-fullerene electron acceptors in bulk heterojunction organic photovoltaic devices","Journal of Materials Chemistry A","2017","5","24","12168","","10.1039/C6TA10739G","","","0.71073","MoKα","","0.0437","0.0323","","","0.0803","0.0887","","","","","","1.03","","","","has coordinates","235483","2020-10-21","18:00:00",""
"7236408","18.8605","0.0004","18.8605","0.0004","16.6183","0.0004","90","","90","","120","","5119.5","0.2","293","2","293","2","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","","","- C42 H24 Co5 N15 O15 -","- C42 H24 Co5 N15 O15 -","- C84 H48 Co10 N30 O30 -","2","0.0833333","","Chen, Di-Ming; Zhang, Nan-Nan; Tian, Jia-Yue; Liu, Chun-Sen; Du, Miao","Pore modulation of metal‒organic frameworks towards enhanced hydrothermal stability and acetylene uptake via incorporation of different functional brackets","Journal of Materials Chemistry A","2017","5","10","4861","","10.1039/C6TA10785K","","x-ray","1.54184","CuKα","","0.0987","0.0968","","","0.2788","0.2881","","","","","","1.106","","","","has coordinates,has disorder","235485","2020-10-21","18:00:00",""
"7236409","16.7919","0.001","16.7919","0.001","18.9208","0.0013","90","","90","","120","","4620.3","0.5","293","2","293","2","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","","","- C7.33 H5.33 Co0.5 N3.17 O1.17 -","- C7.3332 H5.3328 Co0.5 N3.1666 O1.16667 -","- C87.9984 H63.9936 Co6 N37.9992 O14 -","12","0.5","","Chen, Di-Ming; Zhang, Nan-Nan; Tian, Jia-Yue; Liu, Chun-Sen; Du, Miao","Pore modulation of metal‒organic frameworks towards enhanced hydrothermal stability and acetylene uptake via incorporation of different functional brackets","Journal of Materials Chemistry A","2017","5","10","4861","","10.1039/C6TA10785K","","x-ray","1.54184","CuKα","","0.0532","0.0518","","","0.1636","0.1651","","","","","","1.157","","","","has coordinates,has disorder","235485","2020-10-21","18:00:00",""
"7236410","8.1188","0.0003","13.891","0.0005","23.9522","0.0009","90","","92.0462","0.0017","90","","2699.56","0.17","123","","123","","","","","","","","F. Malzner","7","P 1 21/c 1","-P 2ybc","14","","","","- C26 H20 Cu F6 N4 P S2 -","- C26 H20 Cu F6 N4 P S2 -","- C104 H80 Cu4 F24 N16 P4 S8 -","4","1","","Malzner, Frederik J.; Prescimone, Alessandro; Constable, Edwin C.; Housecroft, Catherine E.; Willgert, Markus","Exploring simple ancillary ligands in copper-based dye-sensitized solar cells: effects of a heteroatom switch and of co-sensitization","Journal of Materials Chemistry A","2017","5","9","4671","","10.1039/C6TA10947K","","","1.54178","CuKα","","0.0888","0.0883","","0.2243","0.2242","0.2243","","","","","","0.9825","","","","has coordinates,has disorder","301866","2025-08-22","21:38:31",""
"7236411","29.0226","0.0018","14.9554","0.001","12.9437","0.0009","90","","90.929","0.004","90","","5617.4","0.6","123","","123","","","","","","","","F. Malzner","8","C 1 2/c 1","-C 2yc","15","","","","- C26.5 H21 Cl Cu F6 N4 O2 P -","- C26 H20 Cu F6 N4 O2 P -","- C208 H160 Cu8 F48 N32 O16 P8 -","8","1","","Malzner, Frederik J.; Prescimone, Alessandro; Constable, Edwin C.; Housecroft, Catherine E.; Willgert, Markus","Exploring simple ancillary ligands in copper-based dye-sensitized solar cells: effects of a heteroatom switch and of co-sensitization","Journal of Materials Chemistry A","2017","5","9","4671","","10.1039/C6TA10947K","","","1.54178","CuKα","","0.1171","0.1","","0.2359","0.2272","0.2353","","","","","","1.0095","","","","has coordinates","235487","2020-10-21","18:00:00",""
"7236412","13.9619","0.0016","41.194","0.005","17.1363","0.0016","90","","102.485","0.007","90","","9622.8","1.9","100","2","100","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","Tripticene triacid","","- C22 H11 Co N3 O4 -","- C22 H11 Co N3 O4 -","- C176 H88 Co8 N24 O32 -","8","1","","Chandrasekhar, Pujari; Mukhopadhyay, Arindam; Savitha, Govardhan; Moorthy, Jarugu Narasimha","Orthogonal self-assembly of a trigonal triptycene triacid: signaling of exfoliation of porous 2D metal‒organic layers by fluorescence and selective CO2 capture by the hydrogen-bonded MOF","Journal of Materials Chemistry A","2017","5","11","5402","","10.1039/C6TA11110F","","","0.71073","MoKα","","0.2324","0.1388","","","0.3957","0.4319","","","","","","1.23","","","","has coordinates","235490","2020-10-21","18:00:00",""
"7236413","13.7763","0.0011","40.73","0.006","17.9835","0.0014","90","","101.209","0.002","90","","9898.2","1.8","100","2","100","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","Tripticene triacid","","- C22 H11 Mn N3 O6 -","- C22 H11 Mn N3 O6 -","- C176 H88 Mn8 N24 O48 -","8","1","","Chandrasekhar, Pujari; Mukhopadhyay, Arindam; Savitha, Govardhan; Moorthy, Jarugu Narasimha","Orthogonal self-assembly of a trigonal triptycene triacid: signaling of exfoliation of porous 2D metal‒organic layers by fluorescence and selective CO2 capture by the hydrogen-bonded MOF","Journal of Materials Chemistry A","2017","5","11","5402","","10.1039/C6TA11110F","","","0.71073","MoKα","","0.3694","0.1177","","","0.3329","0.4213","","","","","","0.958","","","","has coordinates","235490","2020-10-21","18:00:00",""
"7236414","9.425","0.003","13.46","0.004","24.125","0.008","92.963","0.007","91.438","0.008","106.991","0.008","2920.4","1.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Tripticene triacid","","- C52 H26 F12 N6 O14 -","- C52 H26 F12 N6 O14 -","- C104 H52 F24 N12 O28 -","2","1","","Chandrasekhar, Pujari; Mukhopadhyay, Arindam; Savitha, Govardhan; Moorthy, Jarugu Narasimha","Orthogonal self-assembly of a trigonal triptycene triacid: signaling of exfoliation of porous 2D metal‒organic layers by fluorescence and selective CO2 capture by the hydrogen-bonded MOF","Journal of Materials Chemistry A","2017","5","11","5402","","10.1039/C6TA11110F","","","0.71073","MoKα","","0.2597","0.1317","","","0.3206","0.3729","","","","","","0.965","","","","has coordinates","235490","2020-10-21","18:00:00",""
"7236415","14.004","0.0014","41.869","0.005","17.1369","0.0017","90","","104.489","0.003","90","","9728.4","1.8","100","2","100","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","Tripticene triacid","","- C24 H17 Cd N3 O6 S -","- C24 H17 Cd N3 O6 S -","- C192 H136 Cd8 N24 O48 S8 -","8","1","","Chandrasekhar, Pujari; Mukhopadhyay, Arindam; Savitha, Govardhan; Moorthy, Jarugu Narasimha","Orthogonal self-assembly of a trigonal triptycene triacid: signaling of exfoliation of porous 2D metal‒organic layers by fluorescence and selective CO2 capture by the hydrogen-bonded MOF","Journal of Materials Chemistry A","2017","5","11","5402","","10.1039/C6TA11110F","","","0.71073","MoKα","","0.1801","0.1699","","","0.4741","0.4914","","","","","","2.383","","","","has coordinates,has disorder","235490","2020-10-21","18:00:00",""
"7236416","13.9438","0.0015","42.307","0.006","16.9583","0.0016","90","","104.249","0.007","90","","9696","2","100","2","100","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","Tripticene triacid","","- C25 H13 Br Cd N3 O7 -","- C25 H13 Br Cd N3 O7 -","- C200 H104 Br8 Cd8 N24 O56 -","8","1","","Chandrasekhar, Pujari; Mukhopadhyay, Arindam; Savitha, Govardhan; Moorthy, Jarugu Narasimha","Orthogonal self-assembly of a trigonal triptycene triacid: signaling of exfoliation of porous 2D metal‒organic layers by fluorescence and selective CO2 capture by the hydrogen-bonded MOF","Journal of Materials Chemistry A","2017","5","11","5402","","10.1039/C6TA11110F","","","0.71073","MoKα","","0.2267","0.1802","","","0.4784","0.5026","","","","","","1.84","","","","has coordinates,has disorder","235490","2020-10-21","18:00:00",""
"7236417","17.4696","0.0005","17.4696","0.0005","33.7023","0.0009","90","","90","","90","","10285.5","0.5","100","10","100","10","","","","","","","","5","I -4","I -4","82","","","","- C36 H24 Cu3 N9 O6 -","- C36 H24 Cu3 N9 O6 -","- C288 H192 Cu24 N72 O48 -","8","1","","Li, Ziyin; Zhang, Zhangjing; Ye, Yingxiang; Cai, Kaicong; Du, Fenfen; Zeng, Heng; Tao, Jin; Lin, Quanjie; Zheng, Ying; Xiang, Shengchang","Rationally tuning host‒guest interactions to free hydroxide ions within intertrimerically cuprophilic metal‒organic frameworks for high OH− conductivity","Journal of Materials Chemistry A","2017","5","17","7816","","10.1039/C6TA11242K","","x-ray","1.54184","CuKα","","0.1395","0.0813","","","0.2131","0.3106","","","","","","1.127","","","","has coordinates","235493","2020-10-21","18:00:00",""
"7236418","17.2079","0.0003","17.2079","0.0003","34.0361","0.001","90","","90","","90","","10078.5","0.4","100","2","100","2","","","","","","","","5","I -4","I -4","82","","","","- C36 H24 Cu3 N9 O6 -","- C36 H24 Cu3 N9 O6 -","- C288 H192 Cu24 N72 O48 -","8","1","","Li, Ziyin; Zhang, Zhangjing; Ye, Yingxiang; Cai, Kaicong; Du, Fenfen; Zeng, Heng; Tao, Jin; Lin, Quanjie; Zheng, Ying; Xiang, Shengchang","Rationally tuning host‒guest interactions to free hydroxide ions within intertrimerically cuprophilic metal‒organic frameworks for high OH− conductivity","Journal of Materials Chemistry A","2017","5","17","7816","","10.1039/C6TA11242K","","","1.54184","CuKα","","0.1121","0.0561","","","0.1215","0.1427","","","","","","1.013","","","","has coordinates","235493","2020-10-21","18:00:00",""
"7236419","17.3245","0.0003","17.3245","0.0003","33.9396","0.0006","90","","90","","90","","10186.6","0.3","100","2","100","2","","","","","","","","5","I -4","I -4","82","","","","- C38.02 H25.15 Cu3 N9.58 O6.29 -","- C38.0181 H25.1532 Cu3 N9.5766 O6.2883 -","- C304.145 H201.226 Cu24 N76.6128 O50.3064 -","8","1","","Li, Ziyin; Zhang, Zhangjing; Ye, Yingxiang; Cai, Kaicong; Du, Fenfen; Zeng, Heng; Tao, Jin; Lin, Quanjie; Zheng, Ying; Xiang, Shengchang","Rationally tuning host‒guest interactions to free hydroxide ions within intertrimerically cuprophilic metal‒organic frameworks for high OH− conductivity","Journal of Materials Chemistry A","2017","5","17","7816","","10.1039/C6TA11242K","","","1.54184","CuKα","","0.0844","0.0611","","","0.1618","0.179","","","","","","1.033","","","","has coordinates","235493","2020-10-21","18:00:00",""
"7236524","11.962","0.002","14.897","0.003","22.54","0.005","104.12","0.03","91.11","0.03","106.09","0.03","3726.3","1.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H44 O62 P12 Zn10 -","- C12 H44 O62 P12 Zn10 -","- C24 H88 O124 P24 Zn20 -","2","1","","Cai, Kun; Sun, Fuxing; Liang, Xiaoqiang; Liu, Cong; Zhao, Nian; Zou, Xiaoqin; Zhu, Guangshan","An acid-stable hexaphosphate ester based metal‒organic framework and its polymer composite as proton exchange membrane","Journal of Materials Chemistry A","2017","5","25","12943","","10.1039/C7TA00169J","","","0.71073","MoKα","","0.1388","0.0786","","","0.167","0.1869","","","","","","1.002","","","","has coordinates,has disorder","236272","2020-10-21","18:00:00",""
"7236525","29.1076","0.0013","29.1076","0.0013","23.5668","0.0019","90","","90","","90","","19967","2","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C24 H36 Cu5 In30 N4 S56 -","- C24 Cu4.9996 In30.0004 N4 S56 -","- C96 Cu19.9984 In120.002 N16 S224 -","4","0.25","","Li, Zhao-Qi; Mo, Chong-Jiao; Guo, Yao; Xu, Nan-Nan; Zhu, Qin-Yu; Dai, Jie","Discrete supertetrahedral CuInS nanoclusters and their application in fabrication of cluster-sensitized TiO2 photoelectrodes","Journal of Materials Chemistry A","2017","5","18","8519","","10.1039/C7TA00247E","","","0.71073","MoKα","","0.1647","0.0739","","","0.1276","0.1582","","","","","","1.166","","","","has coordinates","236274","2020-10-21","18:00:00",""
"7236526","17.4164","0.0006","14.2453","0.0004","20.4424","0.0007","90","","114.512","0.004","90","","4614.7","0.3","122.35","0.1","122.35","0.1","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C36 H29 Eu2 N11 O16 -","- C36 H29 Eu2 N11 O16 -","- C144 H116 Eu8 N44 O64 -","4","0.5","","Wang, Lu; Fan, Guilan; Xu, Xiufang; Chen, Diming; Wang, Liang; Shi, Wei; Cheng, Peng","Detection of polychlorinated benzenes (persistent organic pollutants) by a luminescent sensor based on a lanthanide metal‒organic framework","Journal of Materials Chemistry A","2017","5","11","5541","","10.1039/C7TA00256D","","","0.71073","MoKα","","0.0505","0.0412","","","0.1313","0.1417","","","","","","1.003","","","","has coordinates","236275","2020-10-21","18:00:00",""
"7236527","8","0.0015","10.601","0.002","16.4","0.004","93.857","0.007","102.755","0.007","101.878","0.006","1318.2","0.5","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H40 N4 O13 V -","- C17 H40 N4 O13 V -","- C34 H80 N8 O26 V2 -","2","1","","Huang, Haobo; Howland, Rachael; Agar, Ertan; Nourani, Mahnaz; Golen, James A.; Cappillino, Patrick J.","Bioinspired, high-stability, nonaqueous redox flow battery electrolytes","Journal of Materials Chemistry A","2017","5","23","11586","","10.1039/C7TA00365J","","","0.71073","MoKα","","0.0583","0.0418","","","0.1058","0.1156","","","","","","1.02","","","","has coordinates,has disorder","301866","2025-08-22","21:38:32",""
"7236528","18.682","0.029","18.682","0.029","18.204","0.028","90","","90","","90","","6354","17","","","300","","","","100","","","","","4","I 4/m m m","-I 4 2","139","","MIL-125-NHCyp","","- C2.955 N0.315 O2.149 Ti0.25 -","- C2.955 N0.315 O2.15 Ti0.25 -","- C94.56 N10.08 O68.8 Ti8 -","32","1","","Logan, Matthew W.; Ayad, Suliman; Adamson, Jeremy D.; Dilbeck, Tristan; Hanson, Kenneth; Uribe-Romo, Fernando J.","Systematic variation of the optical bandgap in titanium based isoreticular metal‒organic frameworks for photocatalytic reduction of CO2 under blue light","Journal of Materials Chemistry A","2017","5","23","11854","","10.1039/C7TA00437K","powder diffraction","x-ray","1.5405","Kα~1,2~","","","","","","0.13306","","0.30104","","7.727","","","","","","","has coordinates","236279","2020-10-21","18:00:00",""
"7236529","18.626","0.02","18.626","0.02","18.088","0.018","90","","90","","90","","6275","11","","","300","","","","100","","","","","4","I 4/m m m","-I 4 2","139","","MIL-125-NHEt","","- C1.785 N0.315 O2.148 Ti0.25 -","- C1.785 N0.315 O2.4 Ti0.25 -","- C57.12 N10.08 O76.8 Ti8 -","32","1","","Logan, Matthew W.; Ayad, Suliman; Adamson, Jeremy D.; Dilbeck, Tristan; Hanson, Kenneth; Uribe-Romo, Fernando J.","Systematic variation of the optical bandgap in titanium based isoreticular metal‒organic frameworks for photocatalytic reduction of CO2 under blue light","Journal of Materials Chemistry A","2017","5","23","11854","","10.1039/C7TA00437K","powder diffraction","x-ray","1.5405","Kα~1,2~","","","","","","0.08551","","0.19468","","6.346","","","","","","","has coordinates","236279","2020-10-21","18:00:00",""
"7236530","18.675","0.023","18.675","0.023","18.147","0.022","90","","90","","90","","6329","13","","","300","","","","100","","","","","4","I 4/m m m","-I 4 2","139","","MIL-125-NHCy","","- C3.345 N0.315 O2.019 Ti0.25 -","- C3.345 N0.315 O2.02375 Ti0.25 -","- C107.04 N10.08 O64.76 Ti8 -","32","1","","Logan, Matthew W.; Ayad, Suliman; Adamson, Jeremy D.; Dilbeck, Tristan; Hanson, Kenneth; Uribe-Romo, Fernando J.","Systematic variation of the optical bandgap in titanium based isoreticular metal‒organic frameworks for photocatalytic reduction of CO2 under blue light","Journal of Materials Chemistry A","2017","5","23","11854","","10.1039/C7TA00437K","powder diffraction","x-ray","1.5405","Kα~1,2~","","","","","","0.05597","","0.1275","","3.563","","","","","","","has coordinates","236279","2020-10-21","18:00:00",""
"7236531","18.854","0.027","18.854","0.027","18.292","0.023","90","","90","","90","","6502","16","","","300","","","","100","","","","","4","I 4/m m m","-I 4 2","139","","MIL-125-NHhep","","- C3.735 N0.315 O2.361 Ti0.25 -","- C3.67 N0.315 O2.36 Ti0.25 -","- C117.44 N10.08 O75.52 Ti8 -","32","1","","Logan, Matthew W.; Ayad, Suliman; Adamson, Jeremy D.; Dilbeck, Tristan; Hanson, Kenneth; Uribe-Romo, Fernando J.","Systematic variation of the optical bandgap in titanium based isoreticular metal‒organic frameworks for photocatalytic reduction of CO2 under blue light","Journal of Materials Chemistry A","2017","5","23","11854","","10.1039/C7TA00437K","powder diffraction","x-ray","1.5405","Kα~1,2~","","","","","","0.09196","","0.15916","","5.623","","","","","","","has coordinates","236279","2020-10-21","18:00:00",""
"7236532","18.635","0.016","18.635","0.016","18.131","0.014","90","","90","","90","","6296","9","","","300","","","","100","","","","","4","I 4/m m m","-I 4 2","139","","MIL-125-NHMe","","- C1.395 N0.315 O2.415 Ti0.25 -","- C1.395 N0.315 O2.4135 Ti0.25 -","- C44.64 N10.08 O77.232 Ti8 -","32","1","","Logan, Matthew W.; Ayad, Suliman; Adamson, Jeremy D.; Dilbeck, Tristan; Hanson, Kenneth; Uribe-Romo, Fernando J.","Systematic variation of the optical bandgap in titanium based isoreticular metal‒organic frameworks for photocatalytic reduction of CO2 under blue light","Journal of Materials Chemistry A","2017","5","23","11854","","10.1039/C7TA00437K","powder diffraction","x-ray","1.5405","Kα~1,2~","","","","","","0.08686","","0.15433","","6.262","","","","","","","has coordinates","236279","2020-10-21","18:00:00",""
"7236533","18.7","0.04","18.7","0.04","18.21","0.04","90","","90","","90","","6368","2","","","300","","","","100","","","","","4","I 4/m m m","-I 4 2","139","","MIL-125-NHBu","","- C2.995 N0.315 O2.833 Ti0.25 -","- C2.995 N0.315 O3.16375 Ti0.25 -","- C95.84 N10.08 O101.24 Ti8 -","32","1","","Logan, Matthew W.; Ayad, Suliman; Adamson, Jeremy D.; Dilbeck, Tristan; Hanson, Kenneth; Uribe-Romo, Fernando J.","Systematic variation of the optical bandgap in titanium based isoreticular metal‒organic frameworks for photocatalytic reduction of CO2 under blue light","Journal of Materials Chemistry A","2017","5","23","11854","","10.1039/C7TA00437K","powder diffraction","x-ray","1.5405","Kα~1,2~","","","","","","0.20323","","0.32111","","13.399","","","","","","","has coordinates","236279","2020-10-21","18:00:00",""
"7236534","12.337","0.002","11.4124","0.0019","11.8204","0.0019","90","","100.961","0.006","90","","1633.9","0.5","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H8 N16 O10 -","- C7 H8 N16 O10 -","- C28 H32 N64 O40 -","4","1","","Dharavath, Srinivas; Zhang, Jiaheng; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M.","5-(Dinitromethyl)-3-(trinitromethyl)-1,2,4-triazole and its derivatives: a new application of oxidative nitration towards gem-trinitro-based energetic materials","Journal of Materials Chemistry A","2017","5","10","4785","","10.1039/C7TA00730B","","","0.71073","MoKα","","0.0556","0.0364","","","0.0921","0.0984","","","","","","0.983","","","","has coordinates","236281","2020-10-21","18:00:00",""
"7236535","17.4999","0.0015","22.61","0.003","19.1969","0.0016","90","","105.599","0.01","90","","7315.9","1.4","293","2","293","2","","","","","","","Synthesized","5","C 1 2/c 1","-C 2yc","15","","","","- C55 H90 N12 O38 Zn3 -","- C55 H90 N12 O38 Zn3 -","- C220 H360 N48 O152 Zn12 -","4","0.5","","Pandey, Vinay Kumar; Dixit, Manish Kumar; Manneville, Sébastien; Bucher, Christophe; Dubey, Mrigendra","A multi-stimuli responsive conductive sonometallogel: a mechanistic insight into the role of ultrasound in gelation","Journal of Materials Chemistry A","2017","5","13","6211","","10.1039/C7TA00854F","","","0.71073","MoKα","","0.1338","0.1025","","","0.2907","0.3597","","","","","","1.209","","","","has coordinates,has disorder","236283","2020-10-21","18:00:00",""
"7236536","19.658","0.006","9.753","0.003","8.341","0.003","90","","98.571","0.004","90","","1581.3","0.9","150","","150","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C8 H2 F12 Fe O8 -","- C8 H2 F12 Fe O8 -","- C32 H8 F48 Fe4 O32 -","4","0.5","","Guntlin, Christoph P.; Zünd, Tanja; Kravchyk, Kostiantyn V.; Wörle, Michael; Bodnarchuk, Maryna I.; Kovalenko, Maksym V.","Nanocrystalline FeF3 and MF2 (M = Fe, Co, and Mn) from metal trifluoroacetates and their Li(Na)-ion storage properties","Journal of Materials Chemistry A","2017","5","16","7383","","10.1039/C7TA00862G","","x-ray","0.71073","MoKα","","0.058","0.0508","","","0.1333","0.1408","","","","","","1.08","","","","has coordinates,has disorder","236285","2020-10-21","18:00:00",""
"7236537","8.136","0.0004","9.0331","0.0007","9.2695","0.0005","75.139","0.006","64.574","0.006","71.426","0.006","577.48","0.07","103","5","103","5","","","","","","","","5","P -1","-P 1","2","","","","- C4 H8 Co F6 O8 -","- C4 H8 Co F6 O8 -","- C8 H16 Co2 F12 O16 -","2","1","","Guntlin, Christoph P.; Zünd, Tanja; Kravchyk, Kostiantyn V.; Wörle, Michael; Bodnarchuk, Maryna I.; Kovalenko, Maksym V.","Nanocrystalline FeF3 and MF2 (M = Fe, Co, and Mn) from metal trifluoroacetates and their Li(Na)-ion storage properties","Journal of Materials Chemistry A","2017","5","16","7383","","10.1039/C7TA00862G","","x-ray","0.71073","MoKα","","0.0413","0.0308","","","0.0694","0.0712","","","","","","0.985","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236538","10.3229","0.0017","13.518","0.002","13.94","0.002","105.172","0.002","111.289","0.002","107.081","0.002","1577.4","0.4","100","2","100","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H4 F24 Mn2 O16 -","- C16 H4 F24 Mn2 O16 -","- C32 H8 F48 Mn4 O32 -","2","1","","Guntlin, Christoph P.; Zünd, Tanja; Kravchyk, Kostiantyn V.; Wörle, Michael; Bodnarchuk, Maryna I.; Kovalenko, Maksym V.","Nanocrystalline FeF3 and MF2 (M = Fe, Co, and Mn) from metal trifluoroacetates and their Li(Na)-ion storage properties","Journal of Materials Chemistry A","2017","5","16","7383","","10.1039/C7TA00862G","","x-ray","0.71073","MoKα","","0.0708","0.0473","","","0.1126","0.1262","","","","","","1.028","","","","has coordinates,has disorder","236285","2020-10-21","18:00:00",""
"7236539","9.7505","0.0011","21.236","0.002","16.0879","0.0018","90","","91.358","0.002","90","","3330.3","0.6","100","2","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H F24 Fe3 O17 -","- C16 F24 Fe3 O17 -","- C64 F96 Fe12 O68 -","4","1","","Guntlin, Christoph P.; Zünd, Tanja; Kravchyk, Kostiantyn V.; Wörle, Michael; Bodnarchuk, Maryna I.; Kovalenko, Maksym V.","Nanocrystalline FeF3 and MF2 (M = Fe, Co, and Mn) from metal trifluoroacetates and their Li(Na)-ion storage properties","Journal of Materials Chemistry A","2017","5","16","7383","","10.1039/C7TA00862G","","x-ray","0.71073","MoKα","","0.0884","0.071","","","0.1542","0.1632","","","","","","1.154","","","","has coordinates,has disorder","236285","2020-10-21","18:00:00",""
"7236540","18.409","0.006","11.458","0.004","33.879","0.01","90","","100.97","0.004","90","","7016","4","296","2","296.15","","","","","","","","","7","P 1 2/n 1","-P 2yac","13","","","","- C126 H88 Mo12 N42 O42 P Zn4 -","- C126 H88 Mo12 N42 O42 P Zn4 -","- C252 H176 Mo24 N84 O84 P2 Zn8 -","2","0.5","","Huang, Qing; Wei, Tao; Zhang, Mi; Dong, Long-Zhang; Zhang, A-Man; Li, Shun-Li; Liu, Wen-Jing; Liu, Jiang; Lan, Ya-Qian","A highly stable polyoxometalate-based metal‒organic framework with π‒π stacking for enhancing lithium ion battery performance","Journal of Materials Chemistry A","2017","5","18","8477","","10.1039/C7TA00900C","","x-ray","0.71073","MoKα","","0.1087","0.0637","","","0.1619","0.1751","","","","","","1.036","","","","has coordinates","236288","2020-10-21","18:00:00",""
"7236541","54.438","0.002","14.5003","0.0006","39.5817","0.0017","90","","128.01","0.001","90","","24617.6","1.8","296","2","296.15","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C32 H18 Mo12 N6 O48 P Zn4 -","- C32 H18 Mo12 N6 O48 P Zn4 -","- C256 H144 Mo96 N48 O384 P8 Zn32 -","8","1","","Huang, Qing; Wei, Tao; Zhang, Mi; Dong, Long-Zhang; Zhang, A-Man; Li, Shun-Li; Liu, Wen-Jing; Liu, Jiang; Lan, Ya-Qian","A highly stable polyoxometalate-based metal‒organic framework with π‒π stacking for enhancing lithium ion battery performance","Journal of Materials Chemistry A","2017","5","18","8477","","10.1039/C7TA00900C","","x-ray","0.71073","MoKα","","0.1406","0.1331","","","0.2917","0.297","","","","","","1.137","","","","has coordinates","236288","2020-10-21","18:00:00",""
"7236542","24.7816","0.0004","47.538","0.0008","15.4054","0.0003","90","","90","","90","","18148.6","0.6","150","2","150","2","","","","","","","","7","F d d 2","F 2 -2d","43","","Ferrocene-Co-corrole","","- C60 H42 Co Fe N4 O P -","- C60 H42 Co Fe N4 O P -","- C960 H672 Co16 Fe16 N64 O16 P16 -","16","1","","Samireddi, Satyanarayana; Shown, Indrajit; Shen, Tzu-Hsien; Huang, Hsin-Chih; Wong, Ken-Tsung; Chen, Li-Chyong; Chen, Kuei-Hsien","Hybrid bimetallic-N4 electrocatalyst derived from a pyrolyzed ferrocene‒Co-corrole complex for oxygen reduction reaction","Journal of Materials Chemistry A","2017","5","19","9279","","10.1039/C7TA00949F","","","1.54178","CuKα","","0.0634","0.0551","","","0.1407","0.1483","","","","","","1.024","","","","has coordinates,has disorder","236290","2020-10-21","18:00:00",""
"7236543","26.787","0.004","15.382","0.002","20.723","0.003","90","","118.439","0.003","90","","7508.3","1.9","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C42 H33 N3 O6 -","- C42 H33 N3 O6 -","- C336 H264 N24 O48 -","8","1","","Samanta, Partha; Desai, Aamod V.; Anothumakkool, Bihag; Shirolkar, Mandar M.; Karmakar, Avishek; Kurungot, Sreekumar; Ghosh, Sujit K.","Enhanced proton conduction by post-synthetic covalent modification in a porous covalent framework","Journal of Materials Chemistry A","2017","5","26","13659","","10.1039/C7TA00964J","","","0.71073","MoKα","","0.1509","0.125","","","0.3296","0.3445","","","","","","0.958","","","","has coordinates","236292","2020-10-21","18:00:00",""
"7236544","14.7811","0.0005","38.2896","0.0013","16.6609","0.0006","90","","94.001","0.002","90","","9406.5","0.6","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Zn-PDA2","","- C72 H60 N6 O20 Zn4 -","- C72 H60 N6 O20 Zn4 -","- C288 H240 N24 O80 Zn16 -","4","1","","Wu, Pengyan; Jiang, Min; Li, Yang; Liu, Yanhong; Wang, Jian","Highly efficient photocatalytic hydrogen production from pure water via a photoactive metal‒organic framework and its PDMS@MOF","Journal of Materials Chemistry A","2017","5","17","7833","","10.1039/C7TA01070B","","","0.71073","MoKα","","0.0967","0.0733","","","0.2149","0.2288","","","","","","0.963","","","","has coordinates,has disorder","236294","2020-10-21","18:00:00",""
"7236545","12.6446","0.0006","14.4368","0.0007","7.7331","0.0004","90","","96.954","0.002","90","","1401.27","0.12","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C3 H5 N7 O3 -","- C3 H5 N7 O3 -","- C24 H40 N56 O24 -","8","2","","Tang, Yongxing; He, Chunlin; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M.","High-performing and thermally stable energetic 3,7-diamino-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazole derivatives","Journal of Materials Chemistry A","2017","5","13","6100","","10.1039/C7TA01111C","","","0.71073","MoKα","","0.0545","0.0367","","","0.0928","0.1011","","","","","","1.062","","","","has coordinates,has disorder","301866","2025-08-22","21:38:32",""
"7236546","12.9443","0.0006","22.3674","0.001","6.8059","0.0003","90","","103.6","0.002","90","","1915.26","0.15","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H16 N20 O7 -","- C8 H16 N20 O7 -","- C32 H64 N80 O28 -","4","1","","Tang, Yongxing; He, Chunlin; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M.","High-performing and thermally stable energetic 3,7-diamino-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazole derivatives","Journal of Materials Chemistry A","2017","5","13","6100","","10.1039/C7TA01111C","","","0.71073","MoKα","","0.0699","0.0387","","","0.085","0.0963","","","","","","1.02","","","","has coordinates","236296","2020-10-21","18:00:00",""
"7236547","17.783","0.003","17.783","0.003","12.889","0.002","90","","90","","120","","3529.9","1","90","2","90","2","","","","","","","","6","P 63","P 6c","173","","","","- C36 H78 Ca Cu6 N6 O34 -","- C36 H48 Ca Cu6 N6 O34 -","- C72 H96 Ca2 Cu12 N12 O68 -","2","0.333333","","Grancha, Thais; Mon, Marta; Ferrando-Soria, Jesús; Gascon, Jorge; Seoane, Beatriz; Ramos-Fernandez, Enrique V.; Armentano, Donatella; Pardo, Emilio","Tuning the selectivity of light hydrocarbons in natural gas in a family of isoreticular MOFs","Journal of Materials Chemistry A","2017","5","22","11032","","10.1039/C7TA01179B","","","0.71073","MoKα","","0.2383","0.096","","","0.229","0.3194","","","","","","1.008","","","","has coordinates","236298","2020-10-21","18:00:00",""
"7236548","17.603","0.006","17.603","0.006","13.045","0.004","90","","90","","120","","3501","2","90","2","90","2","","","","","","","","6","P 63","P 6c","173","","","","- C42 H86 Ca Cu6 N6 O32 -","- C40 H53.9997 Ca Cu6 N6 O28 -","- C80 H107.999 Ca2 Cu12 N12 O56 -","2","0.333333","","Grancha, Thais; Mon, Marta; Ferrando-Soria, Jesús; Gascon, Jorge; Seoane, Beatriz; Ramos-Fernandez, Enrique V.; Armentano, Donatella; Pardo, Emilio","Tuning the selectivity of light hydrocarbons in natural gas in a family of isoreticular MOFs","Journal of Materials Chemistry A","2017","5","22","11032","","10.1039/C7TA01179B","","","0.71073","MoKα","","0.1175","0.071","","","0.181","0.2043","","","","","","0.959","","","","has coordinates","236298","2020-10-21","18:00:00",""
"7236549","10.8777","0.001","11.758","0.0012","15.752","0.0013","80.409","0.007","86.674","0.007","68.799","0.009","1852.1","0.3","100","0.16","100","0.16","","","","","","","","4","P -1","-P 1","2","","","","- C28 H35 N17 O2 -","- C28 H35 N17 O2 -","- C56 H70 N34 O4 -","2","1","","Wang, Hailong; Wu, Hui; Kan, Jinglan; Chang, Ganggang; Yao, Zizhu; Li, Bin; Zhou, Wei; Xiang, Shengchang; Cong-Gui Zhao, John; Chen, Banglin","A microporous hydrogen-bonded organic framework with amine sites for selective recognition of small molecules","Journal of Materials Chemistry A","2017","5","18","8292","","10.1039/C7TA01364G","","","1.54184","CuKα","","0.1386","0.1037","","","0.2951","0.3184","","","","","","1.332","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236550","11.3535","0.0009","11.3535","","11.701","0.0012","90","","90","","120","","1306.21","0.17","298","","298","","","","","","","","","3","P -6 2 c","P -6c -2c","190","","","","- C18 H21 N15 -","- C18 H21 N15 -","- C36 H42 N30 -","2","0.166667","","Wang, Hailong; Wu, Hui; Kan, Jinglan; Chang, Ganggang; Yao, Zizhu; Li, Bin; Zhou, Wei; Xiang, Shengchang; Cong-Gui Zhao, John; Chen, Banglin","A microporous hydrogen-bonded organic framework with amine sites for selective recognition of small molecules","Journal of Materials Chemistry A","2017","5","18","8292","","10.1039/C7TA01364G","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","0.08038","","1.44","","","","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236551","10.7844","0.0013","11.6088","0.001","15.9757","0.0014","79.642","0.007","86.726","0.009","69.981","0.009","1848.6","0.3","100","0.16","100","0.16","","","","","","","","5","P -1","-P 1","2","","","","- C18 H25 N15 O2 S0 -","- C18 H25 N15 O2 -","- C36 H50 N30 O4 -","2","1","","Wang, Hailong; Wu, Hui; Kan, Jinglan; Chang, Ganggang; Yao, Zizhu; Li, Bin; Zhou, Wei; Xiang, Shengchang; Cong-Gui Zhao, John; Chen, Banglin","A microporous hydrogen-bonded organic framework with amine sites for selective recognition of small molecules","Journal of Materials Chemistry A","2017","5","18","8292","","10.1039/C7TA01364G","","","1.54184","CuKα","","0.0899","0.0732","","","0.2107","0.2289","","","","","","1.084","","","","has coordinates","236300","2020-10-21","18:00:00",""
"7236552","7.9719","0.0003","7.8194","0.0003","38.2632","0.0016","90","","90","","90","","2385.15","0.16","296","2","296","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C12 H10 N2 O4 -","- C12 H10 N2 O4 -","- C96 H80 N16 O32 -","8","1","","Gong, Le Le; Yao, Wan Ting; Liu, Zhi Qiang; Zheng, An Min; Li, Jian Qiang; Feng, Xue Feng; Ma, Lu Fang; Yan, Chang Sheng; Luo, Ming Biao; Luo, Feng","Photoswitching storage of guest molecules in metal–organic framework for photoswitchable catalysis: exceptional product, ultrahigh photocontrol, and photomodulated size selectivity","Journal of Materials Chemistry A","2017","5","17","7961","","10.1039/C7TA01388D","","","0.71073","MoKα","","0.1074","0.074","","","0.2361","0.278","","","","","","1.046","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236553","7.4425","0.0003","7.545","0.0003","10.892","0.0005","100.835","0.003","96.718","0.004","113.445","0.003","538.5","0.04","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H11 N O2 -","- C12 H11 N O2 -","- C24 H22 N2 O4 -","2","1","","Gong, Le Le; Yao, Wan Ting; Liu, Zhi Qiang; Zheng, An Min; Li, Jian Qiang; Feng, Xue Feng; Ma, Lu Fang; Yan, Chang Sheng; Luo, Ming Biao; Luo, Feng","Photoswitching storage of guest molecules in metal–organic framework for photoswitchable catalysis: exceptional product, ultrahigh photocontrol, and photomodulated size selectivity","Journal of Materials Chemistry A","2017","5","17","7961","","10.1039/C7TA01388D","","","0.71073","MoKα","","0.0645","0.0554","","","0.1559","0.1699","","","","","","1.022","","","","has coordinates","298703","2025-04-03","05:34:22",""
"7236554","4.6524","0.0002","19.8872","0.0008","21.2306","0.0008","90","","100.61","0.003","90","","1930.74","0.14","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 N2 O6 -","- C20 H18 N2 O6 -","- C80 H72 N8 O24 -","4","1","","Gong, Le Le; Yao, Wan Ting; Liu, Zhi Qiang; Zheng, An Min; Li, Jian Qiang; Feng, Xue Feng; Ma, Lu Fang; Yan, Chang Sheng; Luo, Ming Biao; Luo, Feng","Photoswitching storage of guest molecules in metal–organic framework for photoswitchable catalysis: exceptional product, ultrahigh photocontrol, and photomodulated size selectivity","Journal of Materials Chemistry A","2017","5","17","7961","","10.1039/C7TA01388D","","","0.71073","MoKα","","0.0786","0.0509","","","0.1382","0.1608","","","","","","1.015","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236555","15.601","0.014","5.347","0.006","17.88","0.02","90","","124.97","0.07","90","","1222","2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 Br N O2 -","- C12 H10 Br N O2 -","- C48 H40 Br4 N4 O8 -","4","1","","Gong, Le Le; Yao, Wan Ting; Liu, Zhi Qiang; Zheng, An Min; Li, Jian Qiang; Feng, Xue Feng; Ma, Lu Fang; Yan, Chang Sheng; Luo, Ming Biao; Luo, Feng","Photoswitching storage of guest molecules in metal–organic framework for photoswitchable catalysis: exceptional product, ultrahigh photocontrol, and photomodulated size selectivity","Journal of Materials Chemistry A","2017","5","17","7961","","10.1039/C7TA01388D","","","0.71073","MoKα","","0.1624","0.0763","","","0.1872","0.2275","","","","","","0.845","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236556","9.2759","0.0005","8.5195","0.0004","21.3359","0.001","90","","93.68","0.003","90","","1682.61","0.14","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H17 N2 O5 -","- C17 H17 N2 O5 -","- C68 H68 N8 O20 -","4","1","","Gong, Le Le; Yao, Wan Ting; Liu, Zhi Qiang; Zheng, An Min; Li, Jian Qiang; Feng, Xue Feng; Ma, Lu Fang; Yan, Chang Sheng; Luo, Ming Biao; Luo, Feng","Photoswitching storage of guest molecules in metal‒organic framework for photoswitchable catalysis: exceptional product, ultrahigh photocontrol, and photomodulated size selectivity","Journal of Materials Chemistry A","2017","5","17","7961","","10.1039/C7TA01388D","","","0.71073","MoKα","","0.0745","0.0621","","","0.1709","0.1831","","","","","","1.066","","","","has coordinates","236303","2020-10-21","18:00:00",""
"7236557","12.2298","0.0018","25.203","0.003","20.219","0.002","90","","90","","90","","6232.1","1.3","110","2","110","2","","","","","","","","5","P n n a","-P 2a 2bc","52","","","","- C28 H16 In N4 O8 -","- C28 H16 In N4 O8 -","- C112 H64 In4 N16 O32 -","4","0.5","","Gong, Le Le; Yao, Wan Ting; Liu, Zhi Qiang; Zheng, An Min; Li, Jian Qiang; Feng, Xue Feng; Ma, Lu Fang; Yan, Chang Sheng; Luo, Ming Biao; Luo, Feng","Photoswitching storage of guest molecules in metal‒organic framework for photoswitchable catalysis: exceptional product, ultrahigh photocontrol, and photomodulated size selectivity","Journal of Materials Chemistry A","2017","5","17","7961","","10.1039/C7TA01388D","","","0.71073","MoKα","","0.0833","0.049","","","0.1161","0.1242","","","","","","0.928","","","","has coordinates","236303","2020-10-21","18:00:00",""
"7236558","4.0497","0.0019","10.774","0.005","13.882","0.006","103.934","0.008","96.959","0.009","91.161","0.009","582.8","0.5","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H10 N2 O4 -","- C12 H10 N2 O4 -","- C24 H20 N4 O8 -","2","1","","Gong, Le Le; Yao, Wan Ting; Liu, Zhi Qiang; Zheng, An Min; Li, Jian Qiang; Feng, Xue Feng; Ma, Lu Fang; Yan, Chang Sheng; Luo, Ming Biao; Luo, Feng","Photoswitching storage of guest molecules in metal–organic framework for photoswitchable catalysis: exceptional product, ultrahigh photocontrol, and photomodulated size selectivity","Journal of Materials Chemistry A","2017","5","17","7961","","10.1039/C7TA01388D","","","0.71073","MoKα","","0.3788","0.1114","","","0.2049","0.2493","","","","","","1.074","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236559","6.8919","0.0008","17.956","0.003","9.5863","0.0012","90","","95.958","0.009","90","","1179.9","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 F N O2 -","- C12 H10 F N O2 -","- C48 H40 F4 N4 O8 -","4","1","","Gong, Le Le; Yao, Wan Ting; Liu, Zhi Qiang; Zheng, An Min; Li, Jian Qiang; Feng, Xue Feng; Ma, Lu Fang; Yan, Chang Sheng; Luo, Ming Biao; Luo, Feng","Photoswitching storage of guest molecules in metal–organic framework for photoswitchable catalysis: exceptional product, ultrahigh photocontrol, and photomodulated size selectivity","Journal of Materials Chemistry A","2017","5","17","7961","","10.1039/C7TA01388D","","","0.71073","MoKα","","0.1229","0.0906","","","0.2792","0.318","","","","","","1.089","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236560","14.903","0.007","5.3559","0.0017","17.777","0.008","90","","124.5","0.03","90","","1169.4","0.9","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 Cl N O2 -","- C12 H10 Cl N O2 -","- C48 H40 Cl4 N4 O8 -","4","1","","Gong, Le Le; Yao, Wan Ting; Liu, Zhi Qiang; Zheng, An Min; Li, Jian Qiang; Feng, Xue Feng; Ma, Lu Fang; Yan, Chang Sheng; Luo, Ming Biao; Luo, Feng","Photoswitching storage of guest molecules in metal–organic framework for photoswitchable catalysis: exceptional product, ultrahigh photocontrol, and photomodulated size selectivity","Journal of Materials Chemistry A","2017","5","17","7961","","10.1039/C7TA01388D","","","0.71073","MoKα","","0.0983","0.0539","","","0.1368","0.1653","","","","","","1.006","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236561","6.3191","0.0002","6.3191","0.0002","6.3191","0.0002","90","","90","","90","","252.328","0.014","300","0.1","300","0.1","","","","","","","","5","P m -3 m","-P 4 2 3","221","","?CH3NH3?0.85[CH(NH2)2]0.15PbI3","","- C H5.85 I3 N1.15 Pb -","- C I3 N1.14 Pb -","- C I3 N1.14 Pb -","1","0.0208333","","Huang, Yuan; Li, Liang; Liu, Zonghao; Jiao, Haoyang; He, Yuqing; Wang, Xiaoge; Zhu, Rui; Wang, Dong; Sun, Junliang; Chen, Qi; Zhou, Huanping","The intrinsic properties of FA(1−x)MAxPbI3 perovskite single crystals","Journal of Materials Chemistry A","2017","5","18","8537","","10.1039/C7TA01441D","","","0.71073","MoKα","","0.0259","0.0259","","","0.0608","0.0608","","","","","","1.182","","","","has coordinates","236305","2020-10-21","18:00:00",""
"7236562","6.3749","0.0004","6.3749","0.0004","6.3749","0.0004","90","","90","","90","","259.07","0.03","300","0.1","300","0.1","","","","","","","","5","P m -3 m","-P 4 2 3","221","","[CH(NH2)2]0.85[CH3NH3]0.15PbI3","","- C H5.15 I3 N1.85 Pb -","- C I3 N1.86 Pb -","- C I3 N1.86 Pb -","1","0.0208333","","Huang, Yuan; Li, Liang; Liu, Zonghao; Jiao, Haoyang; He, Yuqing; Wang, Xiaoge; Zhu, Rui; Wang, Dong; Sun, Junliang; Chen, Qi; Zhou, Huanping","The intrinsic properties of FA(1−x)MAxPbI3 perovskite single crystals","Journal of Materials Chemistry A","2017","5","18","8537","","10.1039/C7TA01441D","","","0.71073","MoKα","","0.0281","0.0281","","","0.0595","0.0595","","","","","","1.199","","","","has coordinates","236305","2020-10-21","18:00:00",""
"7236563","6.3691","0.0002","6.3691","0.0002","6.3691","0.0002","90","","90","","90","","258.365","0.014","300","2","300","2","","","","","","","","5","P -4 3 m","P -4 2 3","215","","Formamidinium Lead Iodide","","- C H5 I3 N2 Pb -","- C I3 N2.04 Pb -","- C I3 N2.04 Pb -","1","0.0416667","","Huang, Yuan; Li, Liang; Liu, Zonghao; Jiao, Haoyang; He, Yuqing; Wang, Xiaoge; Zhu, Rui; Wang, Dong; Sun, Junliang; Chen, Qi; Zhou, Huanping","The intrinsic properties of FA(1−x)MAxPbI3 perovskite single crystals","Journal of Materials Chemistry A","2017","5","18","8537","","10.1039/C7TA01441D","","","0.71073","MoKα","","0.0125","0.0125","","","0.0343","0.0343","","","","","","1.235","","","","has coordinates","236305","2020-10-21","18:00:00",""
"7236564","15.673","0.004","15.378","0.004","15.991","0.004","90","","95.467","0.003","90","","3836.6","1.7","298","2","298.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C72 H48 Co4 N12 O16 -","- C72 H48 Co4 N12 O16 -","- C144 H96 Co8 N24 O32 -","2","0.5","","Chen, Wen-Miao; Meng, Xiao-Ling; Zhuang, Gui-Lin; Wang, Zhi; Kurmoo, Mohamedally; Zhao, Quan-Qin; Wang, Xing-Po; Shan, Bairong; Tung, Chen-Ho; Sun, Di","A superior fluorescent sensor for Al3+ and UO22+ based on a Co(ii) metal‒organic framework with exposed pyrimidyl Lewis base sites","Journal of Materials Chemistry A","2017","5","25","13079","","10.1039/C7TA01546A","","","0.71073","MoKα","","0.0988","0.0616","","","0.1539","0.1705","","","","","","1.046","","","","has coordinates","236307","2020-10-21","18:00:00",""
"7236565","19.8841","0.0001","19.8841","0.0001","19.8841","0.0001","90","","90","","90","","7861.72","0.07","293","2","293","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","","","","- C36 H25 O8 Pb6 S12 -","- C36 H24.3334 O8 Pb6 S12 -","- C144 H97.3336 O32 Pb24 S48 -","4","0.166667","","Huang, Jiahong; He, Yonghe; Yao, Ming-Shui; He, Jun; Xu, Gang; Zeller, Matthias; Xu, Zhengtao","A semiconducting gyroidal metal-sulfur framework for chemiresistive sensing","Journal of Materials Chemistry A","2017","5","31","16139","","10.1039/C7TA02069D","","","1.54178","CuKα","","0.0699","0.0574","","","0.1424","0.1535","","","","","","1.087","","","","has coordinates,has disorder","236309","2020-10-21","18:00:00",""
"7236566","7.5171","0.0004","12.3224","0.0006","13.2336","0.0006","89.038","0.002","73.997","0.002","87.037","0.002","1176.73","0.1","200","","200","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H24 B F N7 -","- C28 H24 B F N7 -","- C56 H48 B2 F2 N14 -","2","1","","Li, Tian-yi; Meyer, Toni; Meerheim, Rico; Höppner, Marco; Körner, Christian; Vandewal, Koen; Zeika, Olaf; Leo, Karl","Aza-BODIPY dyes with heterocyclic substituents and their derivatives bearing a cyanide co-ligand: NIR donor materials for vacuum-processed solar cells","Journal of Materials Chemistry A","2017","5","21","10696","","10.1039/C7TA02133J","","x-ray","0.71073","MoKα","","0.099","0.0646","","","0.1733","0.1888","","","","","","1.054","","","","has coordinates","236312","2020-10-21","18:00:00",""
"7236567","9.0354","0.0004","11.8886","0.0005","13.4146","0.0006","102.045","0.003","108.397","0.003","99.521","0.003","1295.03","0.11","200","","200","","","","","","","","","3","P -1","-P 1","2","","","","- C34 H25 N5 -","- C34 H25 N5 -","- C68 H50 N10 -","2","1","","Li, Tian-yi; Meyer, Toni; Meerheim, Rico; Höppner, Marco; Körner, Christian; Vandewal, Koen; Zeika, Olaf; Leo, Karl","Aza-BODIPY dyes with heterocyclic substituents and their derivatives bearing a cyanide co-ligand: NIR donor materials for vacuum-processed solar cells","Journal of Materials Chemistry A","2017","5","21","10696","","10.1039/C7TA02133J","","x-ray","0.71073","MoKα","","0.0922","0.0427","","","0.0806","0.0937","","","","","","0.923","","","","has coordinates","236312","2020-10-21","18:00:00",""
"7236568","10.3714","0.0019","11.612","0.002","13.514","0.003","104.995","0.007","111.124","0.006","91.603","0.007","1453.1","0.5","200","","200","","","","","","","","","7","P -1","-P 1","2","","","","- C30 H30 B F2 N3 S2 Si2 -","- C30 H30 B F2 N3 S2 Si2 -","- C60 H60 B2 F4 N6 S4 Si4 -","2","1","","Li, Tian-yi; Meyer, Toni; Meerheim, Rico; Höppner, Marco; Körner, Christian; Vandewal, Koen; Zeika, Olaf; Leo, Karl","Aza-BODIPY dyes with heterocyclic substituents and their derivatives bearing a cyanide co-ligand: NIR donor materials for vacuum-processed solar cells","Journal of Materials Chemistry A","2017","5","21","10696","","10.1039/C7TA02133J","","x-ray","0.71073","MoKα","","0.0672","0.0426","","","0.0998","0.1125","","","","","","1.034","","","","has coordinates","236312","2020-10-21","18:00:00",""
"7236569","10.9204","0.0011","11.8225","0.0012","12.8908","0.0013","85.313","0.004","73.628","0.003","65.884","0.003","1456.4","0.3","100","2","100","","","","","","","","","5","P -1","-P 1","2","","","","- C34 H24 B F2 N5 -","- C34 H24 B F2 N5 -","- C68 H48 B2 F4 N10 -","2","1","","Li, Tian-yi; Meyer, Toni; Meerheim, Rico; Höppner, Marco; Körner, Christian; Vandewal, Koen; Zeika, Olaf; Leo, Karl","Aza-BODIPY dyes with heterocyclic substituents and their derivatives bearing a cyanide co-ligand: NIR donor materials for vacuum-processed solar cells","Journal of Materials Chemistry A","2017","5","21","10696","","10.1039/C7TA02133J","","x-ray","0.71073","MoKα","","0.1005","0.0709","","","0.1982","0.2122","","","","","","1.046","","","","has coordinates,has disorder","236312","2020-10-21","18:00:00",""
"7236570","11.5408","0.0008","11.6206","0.0008","18.3621","0.0012","90","","90","","90","","2462.6","0.3","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C8 H3 N11 O5 -","- C8 H3 N11 O5 -","- C64 H24 N88 O40 -","8","1","","Sun, Qi; Shen, Cheng; Li, Xin; Lin, Qiuhan; Lu, Ming","Combination of four oxadiazole rings for the generation of energetic materials with high detonation performance, low sensitivity and excellent thermal stability","Journal of Materials Chemistry A","2017","5","22","11063","","10.1039/C7TA02209C","","","0.71073","MoKα","","0.1102","0.0607","","","0.1218","0.143","","","","","","1.061","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236571","8.3476","0.0006","9.6589","0.0007","9.7715","0.0008","105.546","0.003","97.6","0.002","111.74","0.002","681.05","0.09","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C8 H6 N12 O6 -","- C8 H6 N12 O6 -","- C16 H12 N24 O12 -","2","1","","Sun, Qi; Shen, Cheng; Li, Xin; Lin, Qiuhan; Lu, Ming","Combination of four oxadiazole rings for the generation of energetic materials with high detonation performance, low sensitivity and excellent thermal stability","Journal of Materials Chemistry A","2017","5","22","11063","","10.1039/C7TA02209C","","","0.71073","MoKα","","0.1033","0.0558","","","0.1018","0.1202","","","","","","1.052","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236572","4.7289","0.0006","10.5845","0.0012","14.3425","0.0019","90","","90.185","0.005","90","","717.88","0.15","172","2","172","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H8 N12 O6 -","- C8 H8 N12 O6 -","- C16 H16 N24 O12 -","2","0.5","","Sun, Qi; Shen, Cheng; Li, Xin; Lin, Qiuhan; Lu, Ming","Combination of four oxadiazole rings for the generation of energetic materials with high detonation performance, low sensitivity and excellent thermal stability","Journal of Materials Chemistry A","2017","5","22","11063","","10.1039/C7TA02209C","","","0.71073","MoKα","","0.0855","0.0494","","","0.0939","0.1049","","","","","","1.038","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236573","15.8351","0.0017","7.8057","0.0008","12.8372","0.0011","90","","108.495","0.004","90","","1504.8","0.3","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C8 H12 N14 O6 -","- C8 H12 N14 O6 -","- C32 H48 N56 O24 -","4","0.5","","Sun, Qi; Shen, Cheng; Li, Xin; Lin, Qiuhan; Lu, Ming","Combination of four oxadiazole rings for the generation of energetic materials with high detonation performance, low sensitivity and excellent thermal stability","Journal of Materials Chemistry A","2017","5","22","11063","","10.1039/C7TA02209C","","","0.71073","MoKα","","0.068","0.0431","","","0.0956","0.1063","","","","","","1.044","","","","has coordinates","236314","2020-10-21","18:00:00",""
"7236574","4.588","0.0004","11.0597","0.001","14.3951","0.0011","90","","91.645","0.005","90","","730.13","0.11","172","2","172","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H8 N12 O7 -","- C8 H8 N12 O7 -","- C16 H16 N24 O14 -","2","0.5","","Sun, Qi; Shen, Cheng; Li, Xin; Lin, Qiuhan; Lu, Ming","Combination of four oxadiazole rings for the generation of energetic materials with high detonation performance, low sensitivity and excellent thermal stability","Journal of Materials Chemistry A","2017","5","22","11063","","10.1039/C7TA02209C","","","0.71073","MoKα","","0.0701","0.044","","","0.0828","0.0919","","","","","","1.044","","","","has coordinates","236314","2020-10-21","18:00:00",""
"7236575","38.042","0.005","47.94","0.005","31.301","0.004","90","","118.75","0.003","90","","50048","11","153","2","153","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C111.82 H58 In3 N8 O24 -","- C111.83 H58 In3 N8 O24 -","- C894.64 H464 In24 N64 O192 -","8","1","","Li, Qing; Xue, Dong-Xu; Zhang, Yu-Feng; Zhang, Zong-Hui; Gao, Ziwei; Bai, Junfeng","A dual-functional indium‒organic framework towards organic pollutant decontamination via physically selective adsorption and chemical photodegradation","Journal of Materials Chemistry A","2017","5","27","14182","","10.1039/C7TA02216F","","","0.71073","MoKα","","0.1417","0.1123","","","0.2966","0.332","","","","","","1.032","","","","has coordinates,has disorder","236315","2020-10-21","18:00:00",""
"7236576","22.0442","0.0011","66.069","0.003","22.1563","0.0011","90","","106.575","0.004","90","","30928","3","130.15","","130.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H38 B2 F48 Mg O14 -","- C36 H38 B2 F48 Mg O14 -","- C720 H760 B40 F960 Mg20 O280 -","20","2.5","","Zhao-Karger, Zhirong; Gil Bardaji, Maria Elisa; Fuhr, Olaf; Fichtner, Maximilian","A new class of non-corrosive, highly efficient electrolytes for rechargeable magnesium batteries","Journal of Materials Chemistry A","2017","5","22","10815","","10.1039/C7TA02237A","","x-ray","1.54186","CuKα","","0.1321","0.1032","","","0.2149","0.2278","","","","","","1.111","","","","has coordinates,has disorder","236318","2020-10-21","18:00:00",""
"7236577","19.7011","0.0009","10.5118","0.0005","17.6789","0.0008","90","","107.472","0.001","90","","3492.3","0.3","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C8 H13 N0 Na0 O10 Tb -","- C8 H13 O10 Tb -","- C64 H104 O80 Tb8 -","8","1","","Ji, Guanfeng; Liu, Jingjuan; Gao, Xuechuan; Sun, Wei; Wang, JinZeng; Zhao, Shenglu; Liu, ZhiLiang","A luminescent lanthanide MOF for selectively and ultra-high sensitively detecting Pb2+ ions in aqueous solution","Journal of Materials Chemistry A","2017","5","21","10200","","10.1039/C7TA02439H","","","0.71073","MoKα","","0.0242","0.023","","","0.0783","0.0791","","","","","","1.118","","","","has coordinates","236320","2020-10-21","18:00:00",""
"7236578","6.0874","0.0002","19.321","0.0008","8.3437","0.0003","90","","108.255","0.001","90","","931.95","0.06","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","TNNMP","3,4,5-Trinitro-1-(nitromethyl)-1H-pyrazole","","- C4 H2 N6 O8 -","- C4 H2 N6 O8 -","- C16 H8 N24 O32 -","4","1","","Kumar, Dheeraj; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M.","3,4,5-Trinitro-1-(nitromethyl)-1H-pyrazole (TNNMP): a perchlorate free high energy density oxidizer with high thermal stability","Journal of Materials Chemistry A","2017","5","21","10437","","10.1039/C7TA02585H","","","0.71073","MoKα","","0.0354","0.0325","","","0.0825","0.0849","","","","","","1.047","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236579","6.7081","0.0002","13.8115","0.0005","9.3931","0.0003","90","","99.282","0.002","90","","858.87","0.05","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C4 H4 N6 O6 -","- C4 H4 N6 O6 -","- C16 H16 N24 O24 -","4","1","","Kumar, Dheeraj; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M.","3,4,5-Trinitro-1-(nitromethyl)-1H-pyrazole (TNNMP): a perchlorate free high energy density oxidizer with high thermal stability","Journal of Materials Chemistry A","2017","5","21","10437","","10.1039/C7TA02585H","","","1.54178","CuKα","","0.0364","0.0333","","","0.0835","0.0859","","","","","","1.017","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236580","17.7662","0.0012","17.7662","0.0012","26.797","0.002","90","","90","","120","","7325","0.9","296","","296.15","","","","","","","","","5","P 63/m c m","-P 6c 2","193","","","","- C41 H38 Co3 N5 O10 -","- C36 H27 Co3 N4 O9 -","- C144 H108 Co12 N16 O36 -","4","0.166667","","Zhao, Jiao; Wang, Qi; Sun, Chunyi; Zheng, Tiantian; Yan, Likai; Li, Mengting; Shao, Kuizhan; Wang, Xinlong; Su, Zhongmin","A hexanuclear cobalt metal‒organic framework for efficient CO2 reduction under visible light","Journal of Materials Chemistry A","2017","5","24","12498","","10.1039/C7TA02611K","","","0.71073","MoKα","","0.092","0.0669","","","0.1847","0.2094","","","","","","1.078","","","","has coordinates","236324","2020-10-21","18:00:00",""
"7236581","10.915","0.01","11.321","0.01","14.814","0.012","90","","109.602","0.013","90","","1724","3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H8 Cu N2 O4 -","- C12 H8 Cu N2 O4 -","- C48 H32 Cu4 N8 O16 -","4","1","","Cheng, Fujun; Li, Qianqian; Duan, Jingui; Hosono, Nobuhiko; Noro, Shin-ichiro; Krishna, Rajamani; Lyu, Hongliang; Kusaka, Shinpei; Jin, Wanqin; Kitagawa, Susumu","Fine-tuning optimal porous coordination polymers using functional alkyl groups for CH4 purification","Journal of Materials Chemistry A","2017","5","34","17874","","10.1039/C7TA02760E","","","0.71073","MoKα","","0.1198","0.0979","","","0.2912","0.3139","","","","","","1.164","","","","has coordinates","236326","2020-10-21","18:00:00",""
"7236582","10.83","0.007","11.889","0.008","14.559","0.009","90","","109.594","0.008","90","","1766","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H6 Cu N2 O4 -","- C11 H6 Cu N2 O4 -","- C44 H24 Cu4 N8 O16 -","4","1","","Cheng, Fujun; Li, Qianqian; Duan, Jingui; Hosono, Nobuhiko; Noro, Shin-ichiro; Krishna, Rajamani; Lyu, Hongliang; Kusaka, Shinpei; Jin, Wanqin; Kitagawa, Susumu","Fine-tuning optimal porous coordination polymers using functional alkyl groups for CH4 purification","Journal of Materials Chemistry A","2017","5","34","17874","","10.1039/C7TA02760E","","","0.71073","MoKα","","0.1227","0.0899","","","0.2465","0.2592","","","","","","1.01","","","","has coordinates","236326","2020-10-21","18:00:00",""
"7236583","10.93","0.03","13.71","0.04","13.47","0.03","90","","111.86","0.03","90","","1873","9","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H10 Cu N2 O4 -","- C13 H10 Cu N2 O4 -","- C52 H40 Cu4 N8 O16 -","4","1","","Cheng, Fujun; Li, Qianqian; Duan, Jingui; Hosono, Nobuhiko; Noro, Shin-ichiro; Krishna, Rajamani; Lyu, Hongliang; Kusaka, Shinpei; Jin, Wanqin; Kitagawa, Susumu","Fine-tuning optimal porous coordination polymers using functional alkyl groups for CH4 purification","Journal of Materials Chemistry A","2017","5","34","17874","","10.1039/C7TA02760E","","","0.71073","MoKα","","0.1831","0.1122","","","0.2809","0.3116","","","","","","1.003","","","","has coordinates","236326","2020-10-21","18:00:00",""
"7236584","12.678","0.005","14.408","0.005","20.225","0.007","90","","90","","90","","3694","2","296","2","296","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C12 H8 Cu N2 O4 -","- C12 H8 Cu N2 O4 -","- C96 H64 Cu8 N16 O32 -","8","1","","Cheng, Fujun; Li, Qianqian; Duan, Jingui; Hosono, Nobuhiko; Noro, Shin-ichiro; Krishna, Rajamani; Lyu, Hongliang; Kusaka, Shinpei; Jin, Wanqin; Kitagawa, Susumu","Fine-tuning optimal porous coordination polymers using functional alkyl groups for CH4 purification","Journal of Materials Chemistry A","2017","5","34","17874","","10.1039/C7TA02760E","","","0.71073","MoKα","","0.1681","0.1032","","","0.2291","0.2639","","","","","","1.002","","","","has coordinates","236326","2020-10-21","18:00:00",""
"7236585","10.7984","0.0004","12.0726","0.0005","14.4123","0.0006","93.451","0.001","102.587","0.002","112.715","0.001","1669.59","0.12","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H29 Er3 N O26 P -","- C13 H29 Er3 N O26 P -","- C26 H58 Er6 N2 O52 P2 -","2","1","","Liang, Xiaoqiang; Cai, Kun; Zhang, Feng; Liu, Jia; Zhu, Guangshan","A proton-conductive lanthanide oxalatophosphonate framework featuring unique chemical stability: stabilities of bulk phase and surface structure","Journal of Materials Chemistry A","2017","5","48","25350","","10.1039/C7TA03744A","","","0.71073","MoKα","","0.0631","0.0568","","","0.1393","0.1408","","","","","","1.043","","","","has coordinates","236329","2020-10-21","18:00:00",""
"7236586","11.3815","0.0001","20.5728","0.0005","34.5573","0.0005","90","","90","","90","","8091.6","0.2","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C15 H12 Co N5 O6 -","- C15 H12 Co N5 O6 -","- C240 H192 Co16 N80 O96 -","16","0.5","","Rajak, Richa; Saraf, Mohit; Mohammad, Akbar; Mobin, Shaikh M.","Design and construction of a ferrocene based inclined polycatenated Co-MOF for supercapacitor and dye adsorption applications","Journal of Materials Chemistry A","2017","5","34","17998","","10.1039/C7TA03773B","","","1.5418","CuKα","","0.0549","0.0463","","","0.1393","0.1472","","","","","","1.104","","","","has coordinates","236331","2020-10-21","18:00:00",""
"7236587","16.027","0.0006","18.4421","0.0007","32.2078","0.0017","90","","90","","90","","9519.7","0.7","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C88 H98 Co4 Fe4 N8 O33 -","- C88 H98 Co4 Fe4 N8 O33 -","- C352 H392 Co16 Fe16 N32 O132 -","4","1","","Rajak, Richa; Saraf, Mohit; Mohammad, Akbar; Mobin, Shaikh M.","Design and construction of a ferrocene based inclined polycatenated Co-MOF for supercapacitor and dye adsorption applications","Journal of Materials Chemistry A","2017","5","34","17998","","10.1039/C7TA03773B","","","1.54184","CuKα","","0.3072","0.1322","","","0.2743","0.3831","","","","","","0.965","","","","has coordinates","236331","2020-10-21","18:00:00",""
"7236588","34.284","0.005","14.7645","0.0018","24.392","0.004","90","","127.042","0.003","90","","9855","3","113","2","113.15","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C74 H134 Br4 Mn Mo6 N7 O26 -","- C74 H134 Br4 Mn Mo6 N7 O26 -","- C296 H536 Br16 Mn4 Mo24 N28 O104 -","4","0.5","","Li, Yusen; Liu, Mingxuan; Chen, Long","Polyoxometalate built-in conjugated microporous polymers for visible-light heterogeneous photocatalysis","Journal of Materials Chemistry A","2017","5","26","13757","","10.1039/C7TA03776G","","","0.71073","MoKα","","0.0929","0.0625","","","0.1579","0.18","","","","","","1.091","","","","has coordinates,has disorder","236332","2020-10-21","18:00:00",""
"7236589","10.9405","0.0012","12.6609","0.0013","17.2175","0.0018","91.149","0.003","96.514","0.003","112.944","0.003","2176.7","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H32 Cd2 N6 O8 -","- C37 H32 Cd2 N6 O8 -","- C74 H64 Cd4 N12 O16 -","2","1","","Zhao, Dan; Liu, Xiao-Hui; Zhao, Yue; Wang, Peng; Liu, Yi; Azam, Mohammad; Al-Resayes, Saud I.; Lu, Yi; Sun, Wei-Yin","Luminescent Cd(ii)‒organic frameworks with chelating NH2 sites for selective detection of Fe(iii) and antibiotics","Journal of Materials Chemistry A","2017","5","30","15797","","10.1039/C7TA03849F","","","0.71073","MoKα","","0.0756","0.0524","","","0.1394","0.1486","","","","","","1.193","","","","has coordinates","236334","2020-10-21","18:00:00",""
"7236590","10.764","0.0015","10.8279","0.0015","14.278","0.002","69.098","0.002","85.433","0.003","64.744","0.002","1400.8","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H64 Cd2 N14 O11 -","- C48 H64 Cd2 N14 O11 -","- C48 H64 Cd2 N14 O11 -","1","0.5","","Zhao, Dan; Liu, Xiao-Hui; Zhao, Yue; Wang, Peng; Liu, Yi; Azam, Mohammad; Al-Resayes, Saud I.; Lu, Yi; Sun, Wei-Yin","Luminescent Cd(ii)‒organic frameworks with chelating NH2 sites for selective detection of Fe(iii) and antibiotics","Journal of Materials Chemistry A","2017","5","30","15797","","10.1039/C7TA03849F","","","0.71073","MoKα","","0.051","0.0413","","","0.1149","0.1217","","","","","","1.028","","","","has coordinates","236334","2020-10-21","18:00:00",""
"7236591","9.807","0.0014","13.1382","0.0019","18.607","0.003","89.278","0.002","76.577","0.002","70.256","0.002","2189.2","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H30 Cd2 N6 Na O10 -","- C33 H30 Cd2 N6 Na O10 -","- C66 H60 Cd4 N12 Na2 O20 -","2","1","","Zhao, Dan; Liu, Xiao-Hui; Zhao, Yue; Wang, Peng; Liu, Yi; Azam, Mohammad; Al-Resayes, Saud I.; Lu, Yi; Sun, Wei-Yin","Luminescent Cd(ii)‒organic frameworks with chelating NH2 sites for selective detection of Fe(iii) and antibiotics","Journal of Materials Chemistry A","2017","5","30","15797","","10.1039/C7TA03849F","","","0.71073","MoKα","","0.0628","0.0445","","","0.1144","0.1239","","","","","","0.992","","","","has coordinates","236334","2020-10-21","18:00:00",""
"7236592","24.068","0.003","10.0444","0.0013","43.667","0.005","90","","92.677","0.002","90","","10545","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C41 H36 Cd2 N6 O8 -","- C41 H36 Cd2 N6 O8 -","- C328 H288 Cd16 N48 O64 -","8","1","","Zhao, Dan; Liu, Xiao-Hui; Zhao, Yue; Wang, Peng; Liu, Yi; Azam, Mohammad; Al-Resayes, Saud I.; Lu, Yi; Sun, Wei-Yin","Luminescent Cd(ii)‒organic frameworks with chelating NH2 sites for selective detection of Fe(iii) and antibiotics","Journal of Materials Chemistry A","2017","5","30","15797","","10.1039/C7TA03849F","","","0.71073","MoKα","","0.0799","0.0736","","","0.163","0.1673","","","","","","1.219","","","","has coordinates,has disorder","236334","2020-10-21","18:00:00",""
"7236593","25.338","0.006","9.524","0.002","18.12","0.004","90","","129.684","0.003","90","","3365.1","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H26 Cd3 N2 O14 -","- C30 H26 Cd3 N2 O14 -","- C120 H104 Cd12 N8 O56 -","4","0.5","","Zhao, Dan; Liu, Xiao-Hui; Zhao, Yue; Wang, Peng; Liu, Yi; Azam, Mohammad; Al-Resayes, Saud I.; Lu, Yi; Sun, Wei-Yin","Luminescent Cd(ii)‒organic frameworks with chelating NH2 sites for selective detection of Fe(iii) and antibiotics","Journal of Materials Chemistry A","2017","5","30","15797","","10.1039/C7TA03849F","","","0.71073","MoKα","","0.0359","0.0288","","","0.0835","0.0876","","","","","","1.133","","","","has coordinates,has disorder","236334","2020-10-21","18:00:00",""
"7236594","33.0267","0.0005","33.0267","0.0005","9.1815","0.0003","90","","90","","120","","8673.1","0.3","100","0.1","100","0.1","","","","","","","","5","R -3 :H","-R 3","148","","BUT-83","","- C44 H24 Co N6 O4 -","- C44 H24 Co N6 O4 -","- C396 H216 Co9 N54 O36 -","9","0.5","","Wu, Hao; Yang, Fan; Lv, Xiu-Liang; Wang, Bin; Zhang, Yong-Zheng; Zhao, Min-Jian; Li, Jian-Rong","A stable porphyrinic metal‒organic framework pore-functionalized by high-density carboxylic groups for proton conduction","Journal of Materials Chemistry A","2017","5","28","14525","","10.1039/C7TA03917D","","x-ray","1.54178","CuKα","","0.124","0.0792","","","0.2131","0.2607","","","","","","1.064","","","","has coordinates","236337","2020-10-21","18:00:00",""
"7236595","14.185","0.002","10.6148","0.0016","30.936","0.005","90","","90","","90","","4658.1","1.2","153","2","153","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H36 B10 N4 -","- C14 H36 B10 N4 -","- C112 H288 B80 N32 -","8","1","","Jiao, Nianming; Zhang, Yanqiang; Liu, Long; Shreeve, Jean'ne M.; Zhang, Suojiang","Hypergolic fuels based on water-stable borohydride cluster anions with ultralow ignition delay times","Journal of Materials Chemistry A","2017","5","26","13341","","10.1039/C7TA04038E","","","0.71073","MoKα","","0.0648","0.0594","","","0.1602","0.1653","","","","","","1.003","","","","has coordinates,has disorder","236339","2020-10-21","18:00:00",""
"7236596","8.616","0.0017","17.164","0.003","15.238","0.003","90","","99.15","0.03","90","","2224.8","0.8","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H43 B6 N -","- C16 H43 B6 N -","- C64 H172 B24 N4 -","4","1","","Jiao, Nianming; Zhang, Yanqiang; Liu, Long; Shreeve, Jean'ne M.; Zhang, Suojiang","Hypergolic fuels based on water-stable borohydride cluster anions with ultralow ignition delay times","Journal of Materials Chemistry A","2017","5","26","13341","","10.1039/C7TA04038E","","","0.71073","MoKα","","0.0878","0.0766","","","0.1758","0.1911","","","","","","1.218","","","","has coordinates","236339","2020-10-21","18:00:00",""
"7236597","9.6","0.003","10.708","0.003","11.824","0.003","90","","98.996","0.003","90","","1200.5","0.6","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H38 B12 N4 -","- C14 H38 B12 N4 -","- C28 H76 B24 N8 -","2","0.5","","Jiao, Nianming; Zhang, Yanqiang; Liu, Long; Shreeve, Jean'ne M.; Zhang, Suojiang","Hypergolic fuels based on water-stable borohydride cluster anions with ultralow ignition delay times","Journal of Materials Chemistry A","2017","5","26","13341","","10.1039/C7TA04038E","","","0.71073","MoKα","","0.0565","0.0476","","","0.1056","0.1112","","","","","","1.001","","","","has coordinates","236339","2020-10-21","18:00:00",""
"7236598","17.452","0.01","17.834","0.01","20.187","0.011","106.59","0.008","100.966","0.009","109.185","0.007","5400","5","90","","90","","","","","","","","","6","P -1","-P 1","2","C6-DPP-CP","","","- C117 H132 Cl9 N8 O4 S4 -","- C117 H132 Cl9 N8 O4 S4 -","- C234 H264 Cl18 N16 O8 S8 -","2","1","","Takahashi, Kohtaro; Kumagai, Daichi; Yamada, Naoya; Kuzuhara, Daiki; Yamaguchi, Yuji; Aratani, Naoki; Koganezawa, Tomoyuki; Koshika, Sota; Yoshimoto, Noriyuki; Masuo, Sadahiro; Suzuki, Mitsuharu; Nakayama, Ken-ichi; Yamada, Hiroko","Side-chain engineering in a thermal precursor approach for efficient photocurrent generation","Journal of Materials Chemistry A","2017","5","27","14003","","10.1039/C7TA04162D","","","0.71073","MoKα","","0.1978","0.1093","","","0.273","0.3568","","","","","","1.047","","","","has coordinates","236341","2020-10-21","18:00:00",""
"7236599","4.481","0.003","13.193","0.009","22.544","0.015","90","","89.879","0.013","90","","1332.7","1.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bz-Pb-I","","- C6 H9 I3 N O Pb -","- C6 H7 I3 N O Pb -","- C24 H28 I12 N4 O4 Pb4 -","4","1","","Tathavadekar, Mukta; Krishnamurthy, Shrreya; Banerjee, Aparna; Nagane, Satyawan; Gawli, Yogesh; Suryawanshi, Anil; Bhat, Suresh; Puthusseri, Dhanya; Mohite, Aditya D.; Ogale, Satishchandra","Low-dimensional hybrid perovskites as high performance anodes for alkali-ion batteries","Journal of Materials Chemistry A","2017","5","35","18634","","10.1039/C7TA04529H","","","0.71073","MoKα","","0.074","0.0722","","","0.1792","0.1798","","","","","","1.387","","","","has coordinates,has disorder","236343","2020-10-21","18:00:00",""
"7236600","8.2438","0.0012","31.628","0.004","17.204","0.002","90","","93.388","0.002","90","","4477.8","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","MPHII","3-methyl-1-phenyl-1H-imidazol-3-ium iodide","","- C10 H11 I N2 -","- C10 H11 I N2 -","- C160 H176 I16 N32 -","16","4","","Zhang, Meirong; Jin, Zhitong; Feng, Chuanqi; Wang, Min; Wang, Zhong-Sheng","Phenyl and thienyl functionalized imidazolium iodides for highly efficient quasi-solid-state dye-sensitized solar cells","Journal of Materials Chemistry A","2017","5","32","16976","","10.1039/C7TA04717G","","","0.71073","MoKα","","0.099","0.0699","","","0.1785","0.19","","","","","","1.108","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236601","19.028","0.006","7.932","0.003","13.915","0.005","90","","90","","90","","2100.2","1.3","173","2","173","2","","","","","","","","5","P c a 21","P 2c -2ac","29","MT3II","3-methyl-1-(thiophen-3-yl)-1H-imidazol-3-ium iodide","","- C8 H9 I N2 S -","- C8 H9 I N2 S -","- C64 H72 I8 N16 S8 -","8","2","","Zhang, Meirong; Jin, Zhitong; Feng, Chuanqi; Wang, Min; Wang, Zhong-Sheng","Phenyl and thienyl functionalized imidazolium iodides for highly efficient quasi-solid-state dye-sensitized solar cells","Journal of Materials Chemistry A","2017","5","32","16976","","10.1039/C7TA04717G","","","0.71073","MoKα","","0.034","0.03","","","0.0842","0.0866","","","","","","1.091","","","","has coordinates,has disorder","301866","2025-08-22","21:38:32",""
"7236602","18.903","0.01","6.311","0.003","17.95","0.009","90","","90","","90","","2141.4","1.9","223","2","223","2","","","","","","","","5","P n a 21","P 2c -2n","33","MT2II","","","- C8 H9 I N2 S -","- C8 H9 I N2 S -","- C64 H72 I8 N16 S8 -","8","2","","Zhang, Meirong; Jin, Zhitong; Feng, Chuanqi; Wang, Min; Wang, Zhong-Sheng","Phenyl and thienyl functionalized imidazolium iodides for highly efficient quasi-solid-state dye-sensitized solar cells","Journal of Materials Chemistry A","2017","5","32","16976","","10.1039/C7TA04717G","","","0.71073","MoKα","","0.047","0.0419","","","0.1077","0.1118","","","","","","1.122","","","","has coordinates,has disorder","236346","2020-10-21","18:00:00",""
"7236603","21.074","0.0019","21.074","0.0019","12.766","0.002","90","","90","","90","","5669.6","1.1","296","2","296","2","","","","","","","","7","I 41/a m d :2","-I 4bd 2","141","","","","- C16 H8 Cu10 N24 O40 P W12 -","- C16 H8 Cu10 N24 O40 P W12 -","- C64 H32 Cu40 N96 O160 P4 W48 -","4","0.125","","Zhu, Pei-Pei; Sheng, Ning; Li, Meng-Ting; Li, Ji-Sen; Liu, Guo-Dong; Yang, Xi-Ya; Sha, Jing-Quan; Zhu, Meng-Liang; Jiang, Jianzhuang","Fabrication and electrochemical performance of unprecedented POM-based metal‒carbene frameworks","Journal of Materials Chemistry A","2017","5","34","17920","","10.1039/C7TA05254E","","","0.71073","MoKα","","0.0501","0.0414","","","0.107","0.1176","","","","","","1.116","","","","has coordinates","236348","2020-10-21","18:00:00",""
"7236604","21.0434","0.0008","21.0434","0.0008","12.7594","0.0009","90","","90","","90","","5650.2","0.5","296","2","296","2","","","","","","","","7","I 41/a m d :2","-I 4bd 2","141","","","","- C16 H8 Cu10 N24 O40 Si W12 -","- C16 H8 Cu10 N24 O40 Si W12 -","- C64 H32 Cu40 N96 O160 Si4 W48 -","4","0.125","","Zhu, Pei-Pei; Sheng, Ning; Li, Meng-Ting; Li, Ji-Sen; Liu, Guo-Dong; Yang, Xi-Ya; Sha, Jing-Quan; Zhu, Meng-Liang; Jiang, Jianzhuang","Fabrication and electrochemical performance of unprecedented POM-based metal‒carbene frameworks","Journal of Materials Chemistry A","2017","5","34","17920","","10.1039/C7TA05254E","","","0.71073","MoKα","","0.0235","0.0221","","","0.0575","0.0581","","","","","","1.162","","","","has coordinates","236348","2020-10-21","18:00:00",""
"7236605","17.631","0.002","18.379","0.003","24.555","0.003","91.948","0.006","98.062","0.006","114.16","0.005","7151.2","1.7","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C84 H70 N8 Ni O4 -","- C84 H70 N8 Ni O4 -","- C336 H280 N32 Ni4 O16 -","4","2","","Mishra, Ruchika; Regar, Ramprasad; Singhal, Rahul; Panini, Piyush; Sharma, Ganesh D.; Sankar, Jeyaraman","Porphyrin based push‒pull conjugates as donors for solution-processed bulk heterojunction solar cells: a case of metal-dependent power conversion efficiency","Journal of Materials Chemistry A","2017","5","30","15529","","10.1039/C7TA05338J","","","0.71073","MoKα","","0.3073","0.1506","","","0.3299","0.3937","","","","","","1.059","","","","has coordinates","236350","2020-10-21","18:00:00",""
"7236606","5.8835","0.0003","16.3726","0.0007","10.507","0.0004","90","","98.424","0.001","90","","1001.2","0.08","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C3 H10 N12 O2 -","- C3 H10 N12 O2 -","- C12 H40 N48 O8 -","4","1","","Kumar, Dheeraj; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M.","Aminoacetonitrile as precursor for nitrogen rich stable and insensitive asymmetric N-methylene-C linked tetrazole-based energetic compounds","Journal of Materials Chemistry A","2017","5","32","16767","","10.1039/C7TA05394K","","","0.71073","MoKα","","0.0324","0.0303","","","0.0798","0.0818","","","","","","1.052","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236607","15.6803","0.0006","6.6171","0.0003","17.0112","0.0007","90","","115.87","0.001","90","","1588.17","0.12","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N-(1-((1H-tetrazol-5-yl)methyl)-1H-tetrazol-5(4H)-ylidene)nitramide","","- C3 H4 N10 O2 -","- C3 H4 N10 O2 -","- C24 H32 N80 O16 -","8","1","","Kumar, Dheeraj; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M.","Aminoacetonitrile as precursor for nitrogen rich stable and insensitive asymmetric N-methylene-C linked tetrazole-based energetic compounds","Journal of Materials Chemistry A","2017","5","32","16767","","10.1039/C7TA05394K","","","0.71073","MoKα","","0.0385","0.0336","","","0.0863","0.0899","","","","","","1.053","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236608","6.8412","0.0002","16.3568","0.0004","17.7892","0.0004","90","","91.272","0.001","90","","1990.12","0.09","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H16 N26 O2 -","- C9 H16 N26 O2 -","- C36 H64 N104 O8 -","4","1","","Kumar, Dheeraj; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M.","Aminoacetonitrile as precursor for nitrogen rich stable and insensitive asymmetric N-methylene-C linked tetrazole-based energetic compounds","Journal of Materials Chemistry A","2017","5","32","16767","","10.1039/C7TA05394K","","","0.71073","MoKα","","0.0463","0.037","","","0.0922","0.0977","","","","","","1.026","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236609","4.94","0.003","5.906","0.004","12.109","0.007","97.538","0.009","90.277","0.008","105.359","0.009","337.4","0.4","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","1-((1H-tetrazol-5-yl)methyl)-1H-tetrazol-5-amine","","- C3 H5 N9 -","- C3 H5 N9 -","- C6 H10 N18 -","2","1","","Kumar, Dheeraj; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M.","Aminoacetonitrile as precursor for nitrogen rich stable and insensitive asymmetric N-methylene-C linked tetrazole-based energetic compounds","Journal of Materials Chemistry A","2017","5","32","16767","","10.1039/C7TA05394K","","","0.71073","MoKα","","0.0332","0.0293","","","0.0676","0.0725","","","","","","1.106","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236610","8.1638","0.001","12.1332","0.0016","16.74","0.002","90","","99.227","0.009","90","","1636.7","0.4","140","","140","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C6 H12 Co N10 O14 -","- C6 H12 Co N10 O14 -","- C24 H48 Co4 N40 O56 -","4","2","","Shen, Cheng; Xu, Yuan-gang; Lu, Ming","A series of high-energy coordination polymers with 3,6-bis(4-nitroamino-1,2,5-oxadiazol-3-yl)-1,4,2,5-dioxadiazine, a ligand with multi-coordination sites, high oxygen content and detonation performance: syntheses, structures, and performance","Journal of Materials Chemistry A","2017","5","35","18854","","10.1039/C7TA05479C","","","0.71073","MoKα","","0.0768","0.0518","","","0.1211","0.1336","","","","","","1.026","","","","has coordinates","236355","2020-10-21","18:00:00",""
"7236611","5.1863","0.0004","16.5502","0.0014","10.248","0.0009","90","","93.952","0.004","90","","877.54","0.13","296.15","","296.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H12 Cu N10 O14 -","- C6 H12 Cu N10 O14 -","- C12 H24 Cu2 N20 O28 -","2","0.5","","Shen, Cheng; Xu, Yuan-gang; Lu, Ming","A series of high-energy coordination polymers with 3,6-bis(4-nitroamino-1,2,5-oxadiazol-3-yl)-1,4,2,5-dioxadiazine, a ligand with multi-coordination sites, high oxygen content and detonation performance: syntheses, structures, and performance","Journal of Materials Chemistry A","2017","5","35","18854","","10.1039/C7TA05479C","","","0.71073","MoKα","","0.035","0.0301","","","0.0883","0.0909","","","","","","1.093","","","","has coordinates","236355","2020-10-21","18:00:00",""
"7236612","10.724","0.002","8.2255","0.0019","12.527","0.003","90","","103.154","0.005","90","","1076","0.4","173","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H7 Ag N6 O5 -","- C6 H7 Ag N6 O5 -","- C24 H28 Ag4 N24 O20 -","4","1","","Shen, Cheng; Xu, Yuan-gang; Lu, Ming","A series of high-energy coordination polymers with 3,6-bis(4-nitroamino-1,2,5-oxadiazol-3-yl)-1,4,2,5-dioxadiazine, a ligand with multi-coordination sites, high oxygen content and detonation performance: syntheses, structures, and performance","Journal of Materials Chemistry A","2017","5","35","18854","","10.1039/C7TA05479C","","","0.71073","MoKα","","0.0376","0.0296","","","0.0762","0.0805","","","","","","1.032","","","","has coordinates","236355","2020-10-21","18:00:00",""
"7236613","8.6085","0.0012","8.3879","0.001","8.7084","0.0012","90","","99.777","0.005","90","","619.68","0.14","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 Ag2 N10 O8 -","- C6 Ag2 N10 O8 -","- C12 Ag4 N20 O16 -","2","0.5","","Shen, Cheng; Xu, Yuan-gang; Lu, Ming","A series of high-energy coordination polymers with 3,6-bis(4-nitroamino-1,2,5-oxadiazol-3-yl)-1,4,2,5-dioxadiazine, a ligand with multi-coordination sites, high oxygen content and detonation performance: syntheses, structures, and performance","Journal of Materials Chemistry A","2017","5","35","18854","","10.1039/C7TA05479C","","","0.71073","MoKα","","0.0724","0.0399","","","0.0566","0.0631","","","","","","1.049","","","","has coordinates,has disorder","236355","2020-10-21","18:00:00",""
"7236614","27.315","0.005","14.9299","0.0029","16.5157","0.0029","90","","110.786","0.011","90","","6297","2","297","","297","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C24.43 H16 Cu D2.43 F6 N4 O6 S2 -","- C24.434 H16 Cu D2.434 F6 N4 O6 S2 -","- C195.472 H128 Cu8 D19.472 F48 N32 O48 S16 -","8","1","","Li, Libo; Lin, Rui-Biao; Krishna, Rajamani; Wang, Xiaoqing; Li, Bin; Wu, Hui; Li, Jinping; Zhou, Wei; Chen, Banglin","Efficient separation of ethylene from acetylene/ethylene mixtures by a flexible-robust metal‒organic framework","Journal of Materials Chemistry A","2017","5","36","18984","","10.1039/C7TA05598F","powder diffraction","neutron","2.0775","","","","","","","","","0.16371","","1.32","","","","","","","has coordinates","236357","2020-10-21","18:00:00",""
"7236615","12.9644","0.0012","13.163","0.0012","23.03","0.002","90","","104.724","0.003","90","","3801","0.6","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H45 Br O11 Ti2 -","- C36 H45 Br O11 Ti2 -","- C144 H180 Br4 O44 Ti8 -","4","1","","Guo, Yao; Hou, Jin-Le; Luo, Wen; Li, Zhao-Qi; Zou, Dan-Hong; Zhu, Qin-Yu; Dai, Jie","Effects of co-coordinated auxiliary ligands on the photoelectrochemical behaviour of titanium-alkoxide-dyes","Journal of Materials Chemistry A","2017","5","34","18270","","10.1039/C7TA05639G","","","0.71073","MoKα","","0.098","0.0543","","","0.094","0.1345","","","","","","1.124","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236616","9.6859","0.0003","21.755","0.0006","19.0222","0.0005","90","","93.686","0.003","90","","4000","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H45 N O13 Ti2 -","- C36 H45 N O13 Ti2 -","- C144 H180 N4 O52 Ti8 -","4","1","","Guo, Yao; Hou, Jin-Le; Luo, Wen; Li, Zhao-Qi; Zou, Dan-Hong; Zhu, Qin-Yu; Dai, Jie","Effects of co-coordinated auxiliary ligands on the photoelectrochemical behaviour of titanium-alkoxide-dyes","Journal of Materials Chemistry A","2017","5","34","18270","","10.1039/C7TA05639G","","","0.71073","MoKα","","0.1144","0.0665","","","0.1243","0.1442","","","","","","1.065","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236617","9.6424","0.0013","21.475","0.003","18.64","0.002","90","","96.606","0.004","90","","3834.2","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H45 F O11 Ti2 -","- C36 H38 F O11 Ti2 -","- C144 H152 F4 O44 Ti8 -","4","1","","Guo, Yao; Hou, Jin-Le; Luo, Wen; Li, Zhao-Qi; Zou, Dan-Hong; Zhu, Qin-Yu; Dai, Jie","Effects of co-coordinated auxiliary ligands on the photoelectrochemical behaviour of titanium-alkoxide-dyes","Journal of Materials Chemistry A","2017","5","34","18270","","10.1039/C7TA05639G","","","0.71073","MoKα","","0.1764","0.0902","","","0.1451","0.1731","","","","","","1.084","","","","has coordinates","236359","2020-10-21","18:00:00",""
"7236618","13.42","0.007","14.187","0.006","26.269","0.014","80","0.02","81.54","0.02","66.431","0.016","4498","4","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C160 H186 Br2 Co8 N12 O50 S8 -","- C160 H184 Br2 Co8 N12 O50 S8 -","- C160 H184 Br2 Co8 N12 O50 S8 -","1","0.5","","Bhuvaneswari, Nagarajan; Annamalai, K. P.; Dai, Feng-Rong; Chen, Zhong-Ning","Pyridinium functionalized coordination containers as highly efficient electrocatalysts for sustainable oxygen evolution","Journal of Materials Chemistry A","2017","5","45","23559","","10.1039/C7TA05797K","","","0.71073","MoKα","","0.1266","0.1021","","","0.2987","0.3256","","","","","","1.063","","","","has coordinates","236362","2020-10-21","18:00:00",""
"7236619","13.404","0.008","13.953","0.007","26.278","0.017","79.49","0.03","81.51","0.03","65.614","0.019","4387","5","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C136 H130 Br2 N4 Ni8 O42 S8 -","- C136 H128 Br2 N4 Ni8 O42 S8 -","- C136 H128 Br2 N4 Ni8 O42 S8 -","1","0.5","","Bhuvaneswari, Nagarajan; Annamalai, K. P.; Dai, Feng-Rong; Chen, Zhong-Ning","Pyridinium functionalized coordination containers as highly efficient electrocatalysts for sustainable oxygen evolution","Journal of Materials Chemistry A","2017","5","45","23559","","10.1039/C7TA05797K","","","0.71073","MoKα","","0.1498","0.0989","","","0.2727","0.3053","","","","","","1.005","","","","has coordinates,has disorder","236363","2020-10-21","18:00:00",""
"7236620","22.156","0.008","22.156","0.008","8.111","0.004","90","","90","","90","","3982","3","293","2","293","2","","","","","","","","5","P -4 21 c","P -4 2n","114","","","","- C10 H15 I3 N Pb -","- C10 H15 I3 N Pb -","- C80 H120 I24 N8 Pb8 -","8","1","","Wang, Guan-E; Yao, Ming-Shui; Cai, Min-Lan; Xiu, Jing-Wei; Li, Yan-Zhou; Xu, Gang; Guo, Guo-Cong","Constructing semiconductive crystalline microporous materials by Coulomb interactions","Journal of Materials Chemistry A","2017","5","35","18409","","10.1039/C7TA05805E","","","0.71073","MoKα","","0.1135","0.0637","","","0.1507","0.1769","","","","","","1.026","","","","has coordinates","236364","2020-10-21","18:00:00",""
"7236627","8.4668","0.0003","7.9589","0.0003","10.4031","0.0004","90","","92.847","0.002","90","","700.16","0.05","90","0.2","90","0.2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H17 N O2 S -","- C16 H17 N O2 S -","- C32 H34 N2 O4 S2 -","2","1","","Kowalski, Jeffrey A.; Casselman, Matthew D.; Kaur, Aman Preet; Milshtein, Jarrod D.; Elliott, Corrine F.; Modekrutti, Subrahmanyam; Attanayake, N. Harsha; Zhang, Naijao; Parkin, Sean R.; Risko, Chad; Brushett, Fikile R.; Odom, Susan A.","A stable two-electron-donating phenothiazine for application in nonaqueous redox flow batteries","Journal of Materials Chemistry A","2017","5","46","24371","","10.1039/C7TA05883G","","","0.71073","MoKα","","0.0484","0.039","","","0.0883","0.0921","","","","","","1.067","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236628","8.2143","0.0005","9.7414","0.0006","10.4899","0.0006","107.352","0.002","101.099","0.002","111.798","0.002","699","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H13 N O6 Zn -","- C14 H13 N O6 Zn -","- C28 H26 N2 O12 Zn2 -","2","1","","Guo, Xiao-Yu; Zhao, Fei; Liu, Jing-Juan; Liu, Zhi-Liang; Wang, Yan-Qin","An ultrastable zinc(ii)‒organic framework as a recyclable multi-responsive luminescent sensor for Cr(iii), Cr(vi) and 4-nitrophenol in the aqueous phase with high selectivity and sensitivity","Journal of Materials Chemistry A","2017","5","37","20035","","10.1039/C7TA05896A","","","0.71073","MoKα","","0.0259","0.0253","","","0.0693","0.0698","","","","","","0.971","","","","has coordinates","236368","2020-10-21","18:00:00",""
"7236635","9.859","0.0011","11.0355","0.0013","12.5671","0.0014","104.782","0.002","89.974","0.002","109.954","0.002","1237","0.2","300","2","300","2","","","","","","","","6","P -1","-P 1","2","Nickel 5-sulphoisophthalate","","","- C16 H19 Na Ni3 O21 S2 -","- C16 H11 Na Ni3 O20.655 S2 -","- C32 H22 Na2 Ni6 O41.31 S4 -","2","1","","Bell, Jon G.; Morris, Samuel A.; Aidoudi, Farida; McCormick, Laura J.; Morris, Russell E.; Thomas, K. Mark","Physisorption-induced structural change directing carbon monoxide chemisorption and nitric oxide coordination on hemilabile porous metal organic framework NaNi3(OH)(SIP)2(H2O)5·H2O (SIP = 5-sulfoisophthalate)","Journal of Materials Chemistry A","2017","5","45","23577","","10.1039/C7TA05910H","","","0.7749","synchrotron","","0.0869","0.0497","","","0.1037","0.1172","","","","","","1.014","","","","has coordinates,has disorder","236373","2020-10-21","18:00:00",""
"7236636","9.8418","0.0016","10.9891","0.0018","12.587","0.002","104.34","0.003","91.715","0.003","110.678","0.003","1223.5","0.3","400","2","400","2","","","","","","","","6","P -1","-P 1","2","CO loaded Nickel 5-sulphoisophthalate","","","- C16.3 H11 Na Ni3 O17.3 S2 -","- C16.31 H11 Na Ni3 O17 S2 -","- C32.62 H22 Na2 Ni6 O34 S4 -","2","1","","Bell, Jon G.; Morris, Samuel A.; Aidoudi, Farida; McCormick, Laura J.; Morris, Russell E.; Thomas, K. Mark","Physisorption-induced structural change directing carbon monoxide chemisorption and nitric oxide coordination on hemilabile porous metal organic framework NaNi3(OH)(SIP)2(H2O)5·H2O (SIP = 5-sulfoisophthalate)","Journal of Materials Chemistry A","2017","5","45","23577","","10.1039/C7TA05910H","","","0.7749","synchrotron","","0.1018","0.0534","","","0.099","0.1134","","","","","","0.994","","","","has coordinates","236373","2020-10-21","18:00:00",""
"7236637","9.8979","0.0017","10.9915","0.0018","12.589","0.002","104.603","0.003","91.331","0.003","110.658","0.003","1230.6","0.4","400","2","400","2","","","","","","","","7","P -1","-P 1","2","NO loaded Nickel 5-sulphoisophthalate","","","- C16 H11 N0.4 Na Ni3 O17.4 S2 -","- C16 H9 N0.4 Na Ni3 O17.374 S2 -","- C32 H18 N0.8 Na2 Ni6 O34.748 S4 -","2","1","","Bell, Jon G.; Morris, Samuel A.; Aidoudi, Farida; McCormick, Laura J.; Morris, Russell E.; Thomas, K. Mark","Physisorption-induced structural change directing carbon monoxide chemisorption and nitric oxide coordination on hemilabile porous metal organic framework NaNi3(OH)(SIP)2(H2O)5·H2O (SIP = 5-sulfoisophthalate)","Journal of Materials Chemistry A","2017","5","45","23577","","10.1039/C7TA05910H","","","0.7749","synchrotron","","0.099","0.0589","","","0.1149","0.1285","","","","","","1.025","","","","has coordinates","236373","2020-10-21","18:00:00",""
"7236638","9.8415","0.0013","11.0066","0.0015","12.6355","0.0017","104.131","0.003","92.127","0.003","110.798","0.003","1229.2","0.3","400","2","400","2","","","","","","","","6","P -1","-P 1","2","Partially Dehydrated Nickel 5-sulphoisophthalate","","","- C16 H11 Na Ni3 O17 S2 -","- C16 H9 Na Ni3 O17 S2 -","- C32 H18 Na2 Ni6 O34 S4 -","2","1","","Bell, Jon G.; Morris, Samuel A.; Aidoudi, Farida; McCormick, Laura J.; Morris, Russell E.; Thomas, K. Mark","Physisorption-induced structural change directing carbon monoxide chemisorption and nitric oxide coordination on hemilabile porous metal organic framework NaNi3(OH)(SIP)2(H2O)5·H2O (SIP = 5-sulfoisophthalate)","Journal of Materials Chemistry A","2017","5","45","23577","","10.1039/C7TA05910H","","","0.7749","synchrotron","","0.0835","0.0454","","","0.0888","0.1003","","","","","","0.976","","","","has coordinates","236373","2020-10-21","18:00:00",""
"7236639","9.972","0.004","11.192","0.005","12.679","0.005","104.544","0.009","90.078","0.009","110.086","0.009","1280.4","0.9","300","2","300","2","","","","","","","","6","P -1","-P 1","2","Cobalt 5-sulphoisophthalate","","","- C16 H19 Co3 Na O21 S2 -","- C16 H13 Co3 Na O21.007 S2 -","- C32 H26 Co6 Na2 O42.014 S4 -","2","1","","Bell, Jon G.; Morris, Samuel A.; Aidoudi, Farida; McCormick, Laura J.; Morris, Russell E.; Thomas, K. Mark","Physisorption-induced structural change directing carbon monoxide chemisorption and nitric oxide coordination on hemilabile porous metal organic framework NaNi3(OH)(SIP)2(H2O)5·H2O (SIP = 5-sulfoisophthalate)","Journal of Materials Chemistry A","2017","5","45","23577","","10.1039/C7TA05910H","","","0.7749","Synchrotron","","0.0685","0.0437","","","0.1038","0.1143","","","","","","1.04","","","","has coordinates,has disorder","236373","2020-10-21","18:00:00",""
"7236644","13.6593","0.0002","13.6593","0.0002","12.0051","0.0004","90","","90","","90","","2239.87","0.09","45","2","45","2","","","","","","","","6","P 42","P 4c","77","","","","- C24 H42 Cu4 N4 O17 S4 -","- C24 H32 Cu4 N4 O14 S4 -","- C48 H64 Cu8 N8 O28 S8 -","2","0.5","","Mon, Marta; Qu, Xiaoni; Ferrando-Soria, Jesús; Pellicer-Carreño, Isaac; Sepúlveda-Escribano, Antonio; Ramos-Fernandez, Enrique V.; Jansen, Johannes C.; Armentano, Donatella; Pardo, Emilio","Fine-tuning of the confined space in microporous metal‒organic frameworks for efficient mercury removal","Journal of Materials Chemistry A","2017","5","38","20120","","10.1039/C7TA06199D","","x-ray","0.67165","synchrotron","","0.0696","0.0516","","","0.1215","0.1329","","","","","","0.957","","","","has coordinates","236381","2020-10-21","18:00:00",""
"7236645","13.0954","0.0015","13.0954","0.0015","11.5653","0.0013","90","","90","","90","","1983.3","0.4","90","2","90","2","","","","","","","","8","P 42","P 4c","77","","","","- C24 H38 Cl Cu4 Hg0.5 N4 O15 S4 -","- C24 H32 Cl Cu4 Hg0.5 N4 O15 S4 -","- C48 H64 Cl2 Cu8 Hg N8 O30 S8 -","2","0.5","","Mon, Marta; Qu, Xiaoni; Ferrando-Soria, Jesús; Pellicer-Carreño, Isaac; Sepúlveda-Escribano, Antonio; Ramos-Fernandez, Enrique V.; Jansen, Johannes C.; Armentano, Donatella; Pardo, Emilio","Fine-tuning of the confined space in microporous metal‒organic frameworks for efficient mercury removal","Journal of Materials Chemistry A","2017","5","38","20120","","10.1039/C7TA06199D","","","0.71073","MoKα","","0.1177","0.1045","","","0.2617","0.2708","","","","","","1.044","","","","has coordinates","236381","2020-10-21","18:00:00",""
"7236646","12.9735","0.0002","12.9735","0.0002","11.5283","0.0003","90","","90","","90","","1940.35","0.07","45","2","45","2","","","","","","","","8","P 42","P 4c","77","","","","- C24 H34 Cl2 Cu4 Hg N4 O14 S4 -","- C24 H26 Cl2 Cu4 Hg N4 O13 S4 -","- C48 H52 Cl4 Cu8 Hg2 N8 O26 S8 -","2","0.5","","Mon, Marta; Qu, Xiaoni; Ferrando-Soria, Jesús; Pellicer-Carreño, Isaac; Sepúlveda-Escribano, Antonio; Ramos-Fernandez, Enrique V.; Jansen, Johannes C.; Armentano, Donatella; Pardo, Emilio","Fine-tuning of the confined space in microporous metal‒organic frameworks for efficient mercury removal","Journal of Materials Chemistry A","2017","5","38","20120","","10.1039/C7TA06199D","","","0.6889","Synchrotron","","0.0831","0.0799","","","0.2319","0.237","","","","","","0.996","","","","has coordinates","236381","2020-10-21","18:00:00",""
"7236650","8.749","0.0012","8.749","0.0012","8.2061","0.0011","90","","90","","120","","543.98","0.13","296","2","296","2","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","","","- C2 H6 I3 N Pb -","- C2 I3 N0.99 Pb -","- C4 I6 N1.98 Pb2 -","2","0.0833333","","Ju, Dianxing; Zhao, Tianyu; Yangyang, Dang; Zhang, Guodong; Hu, Xiaobo; Cui, Deliang; Tao, Xutang","Gas induced conversion of hybrid perovskite single crystal to single crystal for great enhancement of their photoelectric properties","Journal of Materials Chemistry A","2017","5","41","21919","","10.1039/C7TA07413A","","","0.71073","MoKα","","0.0249","0.0244","","","0.0688","0.0692","","","","","","1.1","","","","has coordinates","236386","2020-10-21","18:00:00",""
"7236651","6.3026","0.0013","6.3026","0.0013","6.3026","0.0013","90","","90","","90","","250.36","0.09","273","2","273","2","","","","","","","","5","P m -3 m","-P 4 2 3","221","","","","- C H6 I3 N Pb -","- I3 N Pb -","- I3 N Pb -","1","0.0208333","","Ju, Dianxing; Zhao, Tianyu; Yangyang, Dang; Zhang, Guodong; Hu, Xiaobo; Cui, Deliang; Tao, Xutang","Gas induced conversion of hybrid perovskite single crystal to single crystal for great enhancement of their photoelectric properties","Journal of Materials Chemistry A","2017","5","41","21919","","10.1039/C7TA07413A","","","0.71073","MoKα","","0.0387","0.0387","","","0.1208","0.1208","","","","","","1.059","","","","has coordinates","236386","2020-10-21","18:00:00",""
"7236652","8.778","0.002","8.778","0.002","8.212","0.002","90","","90","","120","","548","0.2","273","2","273","2","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","","","- C2 H6 I3 N Pb -","- C2 I3 N0.99 Pb -","- C4 I6 N1.98 Pb2 -","2","0.0833333","","Ju, Dianxing; Zhao, Tianyu; Yangyang, Dang; Zhang, Guodong; Hu, Xiaobo; Cui, Deliang; Tao, Xutang","Gas induced conversion of hybrid perovskite single crystal to single crystal for great enhancement of their photoelectric properties","Journal of Materials Chemistry A","2017","5","41","21919","","10.1039/C7TA07413A","","","0.71073","MoKα","","0.0451","0.0441","","","0.1142","0.1155","","","","","","1.086","","","","has coordinates","236386","2020-10-21","18:00:00",""
"7236653","16.4994","0.0003","17.8761","0.0003","19.447","0.0004","90.9771","0.0007","100.693","0.0007","102.996","0.0007","5481.48","0.18","123","2","123","2","","","","","","","","5","P -1","-P 1","2","TIPSTEP-Mg-Ph-Pyridine","TIPSTEP-Mg-Ph-Pyridine","","- C63 H65 Mg N5 Si2 -","- C63 H65 Mg N5 Si2 -","- C252 H260 Mg4 N20 Si8 -","4","2","","Ogumi, Keisuke; Nakagawa, Takafumi; Okada, Hiroshi; Sakai, Ryohei; Wang, Huan; Matsuo, Yutaka","Substituent effects in magnesium tetraethynylporphyrin with two diketopyrrolopyrrole units for bulk heterojunction organic solar cells","Journal of Materials Chemistry A","2017","5","44","23067","","10.1039/C7TA07576F","","","1.54187","CuKα","","0.1301","0.0754","","","0.2058","0.2472","","","","","","1.106","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236654","8.4747","0.0005","13.7672","0.0008","13.9878","0.0008","82.573","0.003","83.187","0.003","82.072","0.003","1594.37","0.16","296","2","296","2","","","","","","","","5","P -1","-P 1","2","Mg-TIPSTEP-C6H4Hex","Mg-TIPSTEP-C6H4Hex","","- C70 H84 Mg N4 Si2 -","- C70 H84 Mg N4 Si2 -","- C70 H84 Mg N4 Si2 -","1","0.5","","Ogumi, Keisuke; Nakagawa, Takafumi; Okada, Hiroshi; Sakai, Ryohei; Wang, Huan; Matsuo, Yutaka","Substituent effects in magnesium tetraethynylporphyrin with two diketopyrrolopyrrole units for bulk heterojunction organic solar cells","Journal of Materials Chemistry A","2017","5","44","23067","","10.1039/C7TA07576F","","","1.54187","CuK?a","","0.2042","0.1249","","","0.3398","0.4056","","","","","","1.099","","","","has coordinates","301866","2025-08-22","21:38:32",""
"7236655","10.5854","0.0016","12.2457","0.0018","16.403","0.002","90","","90","","90","","2126.2","0.5","298","2","298.15","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C18 H18 Co N6 O6 S -","- C18 H18 Co N6 O6 S -","- C72 H72 Co4 N24 O24 S4 -","4","1","","Wang, Fan; Zhuo, Hong-Yan; Han, Xiguang; Chen, Wen-Miao; Sun, Di","Foam-like CoO@N,S-codoped carbon composites derived from a well-designed N,S-rich Co-MOF for lithium-ion batteries","Journal of Materials Chemistry A","2017","5","44","22964","","10.1039/C7TA07971K","","","0.71073","MoKα","","0.0339","0.0294","","","0.076","0.0789","","","","","","1.031","","","","has coordinates","236390","2020-10-21","18:00:00",""
"7236656","5.222","0.002","8.635","0.004","11.558","0.005","90","","100.115","0.005","90","","513.1","0.4","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","WHU-3","Cu-(Gly-Thr)?2H2O","","- C6 H14 Cu N2 O6 -","- C6 H14 Cu N2 O6 -","- C12 H28 Cu2 N4 O12 -","2","1","","Ma, Ning; Lin, Cong; Wu, Nian; Liu, Qi; Ma, Jia-Le; Meng, Wei; Wang, Xiao-Shuang; Zhang, Lu; Xu, Xiaohui; Zhao, Yifang; Zhuang, Lin; Fan, Jun; Sun, Junliang; Zhuo, Ren-Xi; Zhang, Xian-Zheng","Stomata-like metal peptide coordination polymer","Journal of Materials Chemistry A","2017","5","45","23440","","10.1039/C7TA08002F","","","0.71073","MoKα","","0.0533","0.0474","","","0.1128","0.1167","","","","","","1.032","","","","has coordinates","236391","2020-10-21","18:00:00",""
"7236657","5.2865","0.0007","8.718","0.0011","17.773","0.004","90","","90","","90","","819.1","0.2","180","0.1","180","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Cu-(Gly-Thr)","","- C6 H10 Cu N2 O4 -","- C6 H10 Cu N2 O4 -","- C24 H40 Cu4 N8 O16 -","4","1","","Ma, Ning; Lin, Cong; Wu, Nian; Liu, Qi; Ma, Jia-Le; Meng, Wei; Wang, Xiao-Shuang; Zhang, Lu; Xu, Xiaohui; Zhao, Yifang; Zhuang, Lin; Fan, Jun; Sun, Junliang; Zhuo, Ren-Xi; Zhang, Xian-Zheng","Stomata-like metal peptide coordination polymer","Journal of Materials Chemistry A","2017","5","45","23440","","10.1039/C7TA08002F","","","0.7107","MoKα","","0.1317","0.1119","","","0.27","0.2811","","","","","","1.067","","","","has coordinates","236391","2020-10-21","18:00:00",""
"7236658","28.99097","0.00007","28.99097","0.00007","16.7159","0.00011","90","","90","","90","","14049.3","0.1","100","0.3","100","0.3","","","","","","","","6","I 41/a c d :2","-I 4bd 2c","142","","","","- C24 H12 Cu In N4 O8 -","- C24 H12 Cu In N4 O8 -","- C384 H192 Cu16 In16 N64 O128 -","16","0.5","","Tan, Yan-Xi; Si, Yanan; Wang, Wenjing; Yuan, Daqiang","Tetrahedral crosslinking of dia-type nets into a zeolitic GIS-type framework for optimizing stability and gas sorption","Journal of Materials Chemistry A","2017","5","44","23276","","10.1039/C7TA08288F","","","1.54184","CuKα","","0.0463","0.0452","","","0.1093","0.1099","","","","","","1.18","","","","has coordinates","236393","2020-10-21","18:00:00",""